NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
8605 | 1mjd | 5482 | cing | recoord | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 38 1HT GLY 38 -6.309 -31.063 21.087 2 2H GLY 38 2HT GLY 38 -4.910 -30.830 20.165 3 3H GLY 38 3HT GLY 38 -5.112 -32.260 21.047 4 1HA GLY 38 1HA GLY 38 -5.812 -33.122 19.119 5 2HA GLY 38 2HA GLY 38 -7.316 -32.320 19.547 6 H ALA 39 H ALA 39 -7.677 -32.322 17.213 7 HA ALA 39 HA ALA 39 -6.821 -29.815 16.061 8 1HB ALA 39 1HB ALA 39 -5.038 -30.825 15.082 9 2HB ALA 39 2HB ALA 39 -6.261 -31.234 13.880 10 3HB ALA 39 3HB ALA 39 -5.790 -32.420 15.098 11 H MET 40 H MET 40 -9.031 -29.318 16.160 12 HA MET 40 HA MET 40 -10.898 -30.973 14.659 13 1HB MET 40 2HB MET 40 -11.291 -29.690 16.936 14 2HB MET 40 1HB MET 40 -11.669 -28.350 15.863 15 1HG MET 40 2HG MET 40 -13.387 -29.693 14.776 16 2HG MET 40 1HG MET 40 -13.003 -31.048 15.836 17 1HE MET 40 1HE MET 40 -15.349 -29.047 14.927 18 2HE MET 40 2HE MET 40 -15.396 -27.586 15.915 19 3HE MET 40 3HE MET 40 -16.441 -28.950 16.309 20 H ASP 41 H ASP 41 -10.087 -27.496 14.714 21 HA ASP 41 HA ASP 41 -9.913 -27.414 11.842 22 1HB ASP 41 2HB ASP 41 -12.385 -27.291 12.324 23 2HB ASP 41 1HB ASP 41 -12.079 -25.774 13.163 24 HA PRO 42 HA PRO 42 -7.197 -24.366 13.960 25 1HB PRO 42 2HB PRO 42 -5.163 -24.594 12.173 26 2HB PRO 42 1HB PRO 42 -5.371 -25.696 13.540 27 1HG PRO 42 2HG PRO 42 -6.145 -26.070 10.671 28 2HG PRO 42 1HG PRO 42 -5.375 -27.219 11.782 29 1HD PRO 42 2HD PRO 42 -8.020 -27.301 11.220 30 2HD PRO 42 1HD PRO 42 -7.373 -27.758 12.808 31 H GLU 43 H GLU 43 -6.983 -22.233 13.499 32 HA GLU 43 HA GLU 43 -8.325 -21.219 11.166 33 1HB GLU 43 2HB GLU 43 -7.037 -19.971 13.572 34 2HB GLU 43 1HB GLU 43 -7.500 -18.977 12.198 35 1HG GLU 43 2HG GLU 43 -9.623 -18.972 12.821 36 2HG GLU 43 1HG GLU 43 -9.652 -20.729 12.960 37 H PHE 44 H PHE 44 -5.042 -20.728 12.488 38 HA PHE 44 HA PHE 44 -3.896 -20.933 9.851 39 1HB PHE 44 2HB PHE 44 -2.745 -18.645 10.154 40 2HB PHE 44 1HB PHE 44 -4.414 -18.662 9.599 41 HD1 PHE 44 1HD PHE 44 -2.154 -17.777 12.310 42 HD2 PHE 44 2HD PHE 44 -6.223 -17.967 11.078 43 HE1 PHE 44 1HE PHE 44 -2.783 -16.296 14.172 44 HE2 PHE 44 2HE PHE 44 -6.859 -16.486 12.937 45 HZ PHE 44 HZ PHE 44 -5.138 -15.649 14.487 46 H ALA 45 H ALA 45 -3.031 -22.726 11.184 47 HA ALA 45 HA ALA 45 -0.402 -22.070 12.106 48 1HB ALA 45 1HB ALA 45 -0.721 -23.083 14.381 49 2HB ALA 45 2HB ALA 45 -2.460 -22.975 14.109 50 3HB ALA 45 3HB ALA 45 -1.480 -21.508 14.149 51 H LEU 46 H LEU 46 -1.767 -23.791 10.143 52 HA LEU 46 HA LEU 46 -0.201 -26.156 10.574 53 1HB LEU 46 2HB LEU 46 -2.423 -26.478 11.832 54 2HB LEU 46 1HB LEU 46 -3.155 -26.593 10.243 55 HG LEU 46 HG LEU 46 -0.935 -28.395 11.204 56 1HD1 LEU 46 1HD1 LEU 46 -3.409 -28.416 12.256 57 2HD1 LEU 46 2HD1 LEU 46 -2.428 -29.865 12.035 58 3HD1 LEU 46 3HD1 LEU 46 -3.664 -29.446 10.849 59 1HD2 LEU 46 1HD2 LEU 46 -0.839 -28.523 8.914 60 2HD2 LEU 46 2HD2 LEU 46 -2.559 -28.186 8.714 61 3HD2 LEU 46 3HD2 LEU 46 -2.030 -29.775 9.267 62 H SER 47 H SER 47 0.764 -25.479 8.636 63 HA SER 47 HA SER 47 1.107 -25.509 6.388 64 1HB SER 47 2HB SER 47 -1.488 -27.064 6.244 65 2HB SER 47 1HB SER 47 -0.228 -27.000 5.012 66 HG SER 47 HG SER 47 1.148 -28.091 6.401 67 H ASN 48 H ASN 48 0.830 -23.941 4.923 68 HA ASN 48 HA ASN 48 -1.775 -22.890 4.288 69 1HB ASN 48 2HB ASN 48 -0.414 -21.692 6.410 70 2HB ASN 48 1HB ASN 48 -0.108 -20.631 5.039 71 1HD2 ASN 48 1HD2 ASN 48 -1.950 -19.817 3.870 72 2HD2 ASN 48 2HD2 ASN 48 -3.448 -19.579 4.697 73 H GLU 49 H GLU 49 -1.821 -22.173 2.244 74 HA GLU 49 HA GLU 49 0.579 -22.317 0.670 75 1HB GLU 49 2HB GLU 49 -2.310 -21.768 0.062 76 2HB GLU 49 1HB GLU 49 -1.074 -21.516 -1.162 77 1HG GLU 49 2HG GLU 49 -0.371 -23.886 -0.829 78 2HG GLU 49 1HG GLU 49 -1.766 -24.092 0.228 79 H LYS 50 H LYS 50 1.263 -20.592 -0.798 80 HA LYS 50 HA LYS 50 1.308 -18.039 0.594 81 1HB LYS 50 2HB LYS 50 3.010 -17.459 -1.185 82 2HB LYS 50 1HB LYS 50 3.448 -18.783 -0.114 83 1HG LYS 50 2HG LYS 50 3.123 -20.390 -1.766 84 2HG LYS 50 1HG LYS 50 2.154 -19.303 -2.763 85 1HD LYS 50 2HD LYS 50 3.998 -18.193 -3.580 86 2HD LYS 50 1HD LYS 50 4.988 -18.583 -2.173 87 1HE LYS 50 2HE LYS 50 4.357 -21.046 -3.317 88 2HE LYS 50 1HE LYS 50 4.710 -19.989 -4.683 89 1HZ LYS 50 1HZ LYS 50 6.579 -21.289 -3.327 90 2HZ LYS 50 2HZ LYS 50 6.559 -19.848 -2.445 91 3HZ LYS 50 3HZ LYS 50 6.866 -19.815 -4.106 92 H LYS 51 H LYS 51 0.301 -16.230 -0.063 93 HA LYS 51 HA LYS 51 -0.580 -15.866 -2.776 94 1HB LYS 51 2HB LYS 51 -2.966 -15.670 -2.261 95 2HB LYS 51 1HB LYS 51 -2.378 -17.294 -1.932 96 1HG LYS 51 2HG LYS 51 -2.105 -15.796 0.452 97 2HG LYS 51 1HG LYS 51 -3.719 -15.490 -0.192 98 1HD LYS 51 2HD LYS 51 -3.890 -18.028 -0.469 99 2HD LYS 51 1HD LYS 51 -2.471 -18.113 0.578 100 1HE LYS 51 2HE LYS 51 -3.997 -16.461 2.034 101 2HE LYS 51 1HE LYS 51 -5.265 -17.365 1.207 102 1HZ LYS 51 1HZ LYS 51 -3.105 -18.929 2.376 103 2HZ LYS 51 2HZ LYS 51 -4.763 -19.253 2.309 104 3HZ LYS 51 3HZ LYS 51 -4.158 -18.177 3.465 105 H ALA 52 H ALA 52 -2.101 -13.808 -2.802 106 HA ALA 52 HA ALA 52 -2.339 -11.578 -2.408 107 1HB ALA 52 1HB ALA 52 -2.859 -11.255 -0.276 108 2HB ALA 52 2HB ALA 52 -1.141 -11.160 0.114 109 3HB ALA 52 3HB ALA 52 -1.976 -12.711 0.184 110 H LYS 53 H LYS 53 -0.871 -9.612 -1.478 111 HA LYS 53 HA LYS 53 1.922 -10.061 -2.212 112 1HB LYS 53 2HB LYS 53 0.382 -7.770 -3.421 113 2HB LYS 53 1HB LYS 53 1.987 -8.349 -3.850 114 1HG LYS 53 2HG LYS 53 0.540 -10.561 -4.357 115 2HG LYS 53 1HG LYS 53 -0.663 -9.314 -4.688 116 1HD LYS 53 2HD LYS 53 0.264 -9.048 -6.692 117 2HD LYS 53 1HD LYS 53 1.700 -8.411 -5.888 118 1HE LYS 53 2HE LYS 53 2.645 -10.643 -5.758 119 2HE LYS 53 1HE LYS 53 1.187 -11.325 -6.477 120 1HZ LYS 53 1HZ LYS 53 1.940 -9.440 -8.272 121 2HZ LYS 53 2HZ LYS 53 2.268 -11.094 -8.397 122 3HZ LYS 53 3HZ LYS 53 3.428 -10.050 -7.744 123 H LYS 54 H LYS 54 3.329 -8.833 -1.080 124 HA LYS 54 HA LYS 54 2.227 -7.099 0.966 125 1HB LYS 54 2HB LYS 54 4.371 -8.963 0.876 126 2HB LYS 54 1HB LYS 54 5.060 -7.376 1.192 127 1HG LYS 54 2HG LYS 54 4.578 -7.769 3.326 128 2HG LYS 54 1HG LYS 54 2.904 -7.435 2.883 129 1HD LYS 54 2HD LYS 54 3.092 -10.036 2.176 130 2HD LYS 54 1HD LYS 54 4.224 -9.988 3.530 131 1HE LYS 54 2HE LYS 54 2.079 -8.557 4.475 132 2HE LYS 54 1HE LYS 54 1.310 -9.815 3.509 133 1HZ LYS 54 1HZ LYS 54 1.679 -10.429 5.864 134 2HZ LYS 54 2HZ LYS 54 3.347 -10.345 5.601 135 3HZ LYS 54 3HZ LYS 54 2.418 -11.489 4.771 136 H VAL 55 H VAL 55 2.269 -5.021 0.774 137 HA VAL 55 HA VAL 55 4.343 -3.750 -0.886 138 HB VAL 55 HB VAL 55 2.680 -2.018 -1.535 139 1HG1 VAL 55 1HG1 VAL 55 3.263 -4.230 -2.831 140 2HG1 VAL 55 2HG1 VAL 55 2.029 -3.110 -3.408 141 3HG1 VAL 55 3HG1 VAL 55 1.556 -4.569 -2.538 142 1HG2 VAL 55 1HG2 VAL 55 0.845 -3.868 -0.079 143 2HG2 VAL 55 2HG2 VAL 55 0.248 -2.858 -1.396 144 3HG2 VAL 55 3HG2 VAL 55 0.984 -2.111 0.027 145 H ARG 56 H ARG 56 4.888 -1.621 -0.325 146 HA ARG 56 HA ARG 56 4.251 -0.909 2.452 147 1HB ARG 56 2HB ARG 56 6.703 -1.248 1.614 148 2HB ARG 56 1HB ARG 56 6.480 0.317 0.843 149 1HG ARG 56 2HG ARG 56 6.936 1.347 2.745 150 2HG ARG 56 1HG ARG 56 5.606 0.509 3.544 151 1HD ARG 56 2HD ARG 56 7.005 -1.285 4.196 152 2HD ARG 56 1HD ARG 56 8.302 -0.752 3.127 153 HE ARG 56 HE ARG 56 9.022 0.632 4.787 154 1HH1 ARG 56 1HH1 ARG 56 5.680 -0.169 5.403 155 2HH1 ARG 56 2HH1 ARG 56 5.637 0.645 6.931 156 1HH2 ARG 56 1HH2 ARG 56 8.966 1.702 6.797 157 2HH2 ARG 56 2HH2 ARG 56 7.502 1.706 7.723 158 H PHE 57 H PHE 57 2.531 0.414 2.408 159 HA PHE 57 HA PHE 57 2.160 2.193 0.152 160 1HB PHE 57 2HB PHE 57 0.449 1.434 2.505 161 2HB PHE 57 1HB PHE 57 0.001 2.746 1.423 162 HD1 PHE 57 1HD PHE 57 1.408 0.944 -0.952 163 HD2 PHE 57 2HD PHE 57 -1.751 0.458 1.865 164 HE1 PHE 57 1HE PHE 57 0.313 -0.643 -2.459 165 HE2 PHE 57 2HE PHE 57 -2.841 -1.148 0.358 166 HZ PHE 57 HZ PHE 57 -1.813 -1.699 -1.808 167 H TYR 58 H TYR 58 2.554 4.232 0.087 168 HA TYR 58 HA TYR 58 3.182 5.698 2.561 169 1HB TYR 58 2HB TYR 58 4.271 6.326 -0.168 170 2HB TYR 58 1HB TYR 58 4.758 7.028 1.356 171 HD1 TYR 58 1HD TYR 58 4.970 4.022 -0.761 172 HD2 TYR 58 2HD TYR 58 6.327 5.921 2.795 173 HE1 TYR 58 1HE TYR 58 6.762 2.352 -0.561 174 HE2 TYR 58 2HE TYR 58 8.123 4.255 3.005 175 HH TYR 58 HH TYR 58 8.725 2.090 2.277 176 H ARG 59 H ARG 59 2.403 7.779 2.737 177 HA ARG 59 HA ARG 59 0.195 8.398 0.914 178 1HB ARG 59 2HB ARG 59 -0.178 10.224 2.794 179 2HB ARG 59 1HB ARG 59 -0.720 8.567 3.016 180 1HG ARG 59 2HG ARG 59 1.034 8.065 4.476 181 2HG ARG 59 1HG ARG 59 1.969 9.476 3.978 182 1HD ARG 59 2HD ARG 59 -0.715 9.772 5.277 183 2HD ARG 59 1HD ARG 59 0.740 9.543 6.244 184 HE ARG 59 HE ARG 59 0.103 11.854 4.568 185 1HH1 ARG 59 1HH1 ARG 59 2.298 10.294 6.798 186 2HH1 ARG 59 2HH1 ARG 59 3.152 11.753 7.163 187 1HH2 ARG 59 1HH2 ARG 59 1.235 13.762 5.045 188 2HH2 ARG 59 2HH2 ARG 59 2.552 13.719 6.168 189 H ASN 60 H ASN 60 0.599 9.745 -0.679 190 HA ASN 60 HA ASN 60 2.869 11.056 -1.285 191 1HB ASN 60 2HB ASN 60 1.091 10.942 -2.879 192 2HB ASN 60 1HB ASN 60 0.039 11.918 -1.864 193 1HD2 ASN 60 1HD2 ASN 60 -0.133 13.116 -3.919 194 2HD2 ASN 60 2HD2 ASN 60 1.026 14.360 -4.232 195 H GLY 61 H GLY 61 4.036 12.671 -0.554 196 1HA GLY 61 2HA GLY 61 4.600 14.674 0.452 197 2HA GLY 61 1HA GLY 61 2.887 15.009 0.655 198 H ASP 62 H ASP 62 5.515 13.005 1.965 199 HA ASP 62 HA ASP 62 4.567 13.605 4.652 200 1HB ASP 62 2HB ASP 62 4.535 11.288 5.365 201 2HB ASP 62 1HB ASP 62 3.432 11.494 4.007 202 H ARG 63 H ARG 63 6.972 11.840 2.720 203 HA ARG 63 HA ARG 63 9.234 11.700 2.862 204 1HB ARG 63 2HB ARG 63 8.617 14.286 4.146 205 2HB ARG 63 1HB ARG 63 10.196 13.611 4.526 206 1HG ARG 63 2HG ARG 63 10.999 13.992 2.465 207 2HG ARG 63 1HG ARG 63 9.474 13.577 1.680 208 1HD ARG 63 2HD ARG 63 9.694 15.854 1.255 209 2HD ARG 63 1HD ARG 63 8.616 15.802 2.649 210 HE ARG 63 HE ARG 63 11.300 16.021 3.500 211 1HH1 ARG 63 1HH1 ARG 63 8.745 17.888 2.031 212 2HH1 ARG 63 2HH1 ARG 63 9.331 19.400 2.636 213 1HH2 ARG 63 1HH2 ARG 63 12.073 18.009 4.298 214 2HH2 ARG 63 2HH2 ARG 63 11.220 19.469 3.925 215 H TYR 64 H TYR 64 8.693 12.971 6.129 216 HA TYR 64 HA TYR 64 10.384 11.170 7.404 217 1HB TYR 64 2HB TYR 64 7.996 12.604 8.579 218 2HB TYR 64 1HB TYR 64 9.325 11.901 9.494 219 HD1 TYR 64 1HD TYR 64 8.304 14.661 7.305 220 HD2 TYR 64 2HD TYR 64 11.484 12.995 9.589 221 HE1 TYR 64 1HE TYR 64 9.532 16.785 7.136 222 HE2 TYR 64 2HE TYR 64 12.720 15.115 9.426 223 HH TYR 64 HH TYR 64 11.279 17.999 8.273 224 H PHE 65 H PHE 65 7.009 10.839 6.549 225 HA PHE 65 HA PHE 65 6.551 8.548 8.208 226 1HB PHE 65 2HB PHE 65 4.757 10.139 7.419 227 2HB PHE 65 1HB PHE 65 4.923 9.424 5.819 228 HD1 PHE 65 1HD PHE 65 4.873 7.890 9.215 229 HD2 PHE 65 2HD PHE 65 3.024 8.195 5.393 230 HE1 PHE 65 1HE PHE 65 3.290 6.115 9.844 231 HE2 PHE 65 2HE PHE 65 1.437 6.420 6.016 232 HZ PHE 65 HZ PHE 65 1.569 5.378 8.244 233 H LYS 66 H LYS 66 7.331 6.605 7.836 234 HA LYS 66 HA LYS 66 8.435 5.891 5.284 235 1HB LYS 66 2HB LYS 66 8.054 4.128 7.703 236 2HB LYS 66 1HB LYS 66 9.167 3.873 6.364 237 1HG LYS 66 2HG LYS 66 9.493 6.434 7.759 238 2HG LYS 66 1HG LYS 66 9.834 5.002 8.736 239 1HD LYS 66 2HD LYS 66 11.105 4.382 6.409 240 2HD LYS 66 1HD LYS 66 11.308 6.135 6.462 241 1HE LYS 66 2HE LYS 66 12.176 5.893 8.786 242 2HE LYS 66 1HE LYS 66 12.113 4.143 8.578 243 1HZ LYS 66 1HZ LYS 66 14.221 4.448 7.903 244 2HZ LYS 66 2HZ LYS 66 13.990 6.073 7.493 245 3HZ LYS 66 3HZ LYS 66 13.505 4.854 6.424 246 H GLY 67 H GLY 67 5.319 5.957 6.321 247 1HA GLY 67 2HA GLY 67 3.443 5.171 5.210 248 2HA GLY 67 1HA GLY 67 4.486 4.153 4.230 249 H ILE 68 H ILE 68 2.326 2.925 4.840 250 HA ILE 68 HA ILE 68 2.978 1.203 7.140 251 HB ILE 68 HB ILE 68 0.989 2.517 7.645 252 1HG1 ILE 68 2HG1 ILE 68 0.021 -0.258 6.991 253 2HG1 ILE 68 1HG1 ILE 68 1.224 0.023 8.247 254 1HG2 ILE 68 1HG2 ILE 68 -0.680 2.949 6.218 255 2HG2 ILE 68 2HG2 ILE 68 -0.755 1.278 5.654 256 3HG2 ILE 68 3HG2 ILE 68 0.437 2.384 4.974 257 1HD1 ILE 68 1HD1 ILE 68 -0.291 0.819 9.687 258 2HD1 ILE 68 2HD1 ILE 68 -1.448 -0.018 8.652 259 3HD1 ILE 68 3HD1 ILE 68 -1.162 1.709 8.440 260 H VAL 69 H VAL 69 2.906 -0.985 6.819 261 HA VAL 69 HA VAL 69 2.855 -1.881 4.067 262 HB VAL 69 HB VAL 69 3.260 -3.588 6.521 263 1HG1 VAL 69 1HG1 VAL 69 3.491 -3.987 3.609 264 2HG1 VAL 69 2HG1 VAL 69 3.125 -5.143 4.890 265 3HG1 VAL 69 3HG1 VAL 69 4.795 -4.664 4.585 266 1HG2 VAL 69 1HG2 VAL 69 5.614 -3.201 6.362 267 2HG2 VAL 69 2HG2 VAL 69 4.814 -1.632 6.454 268 3HG2 VAL 69 3HG2 VAL 69 5.409 -2.229 4.904 269 H TYR 70 H TYR 70 1.304 -3.040 3.091 270 HA TYR 70 HA TYR 70 -0.843 -4.184 4.692 271 1HB TYR 70 2HB TYR 70 -1.078 -1.929 2.863 272 2HB TYR 70 1HB TYR 70 -2.144 -3.255 2.421 273 HD1 TYR 70 1HD TYR 70 -4.271 -3.111 3.239 274 HD2 TYR 70 2HD TYR 70 -1.085 -1.549 5.588 275 HE1 TYR 70 1HE TYR 70 -5.885 -2.431 4.963 276 HE2 TYR 70 2HE TYR 70 -2.693 -0.864 7.321 277 HH TYR 70 HH TYR 70 -5.587 -2.003 7.694 278 H ALA 71 H ALA 71 -1.852 -5.912 3.812 279 HA ALA 71 HA ALA 71 -0.466 -7.212 1.579 280 1HB ALA 71 1HB ALA 71 -2.125 -8.273 3.851 281 2HB ALA 71 2HB ALA 71 -0.450 -8.644 3.445 282 3HB ALA 71 3HB ALA 71 -1.758 -9.252 2.431 283 H VAL 72 H VAL 72 -1.647 -7.986 -0.213 284 HA VAL 72 HA VAL 72 -4.488 -7.294 -0.283 285 HB VAL 72 HB VAL 72 -2.822 -6.630 -2.674 286 1HG1 VAL 72 1HG1 VAL 72 -4.638 -5.390 -3.342 287 2HG1 VAL 72 2HG1 VAL 72 -5.186 -5.105 -1.690 288 3HG1 VAL 72 3HG1 VAL 72 -5.428 -6.682 -2.439 289 1HG2 VAL 72 1HG2 VAL 72 -2.807 -4.239 -1.758 290 2HG2 VAL 72 2HG2 VAL 72 -1.630 -5.370 -1.091 291 3HG2 VAL 72 3HG2 VAL 72 -3.086 -4.973 -0.179 292 H SER 73 H SER 73 -5.720 -8.696 -1.288 293 HA SER 73 HA SER 73 -4.730 -10.487 -3.324 294 1HB SER 73 2HB SER 73 -5.788 -12.444 -1.871 295 2HB SER 73 1HB SER 73 -4.100 -11.976 -1.674 296 HG SER 73 HG SER 73 -4.797 -11.889 0.350 297 H SER 74 H SER 74 -6.698 -12.239 -3.615 298 HA SER 74 HA SER 74 -8.932 -10.581 -4.369 299 1HB SER 74 2HB SER 74 -7.819 -12.768 -5.507 300 2HB SER 74 1HB SER 74 -9.160 -13.520 -4.642 301 HG SER 74 HG SER 74 -9.246 -11.528 -6.642 302 H ASP 75 H ASP 75 -8.141 -12.654 -1.731 303 HA ASP 75 HA ASP 75 -10.868 -13.162 -0.964 304 1HB ASP 75 2HB ASP 75 -8.214 -14.076 -0.212 305 2HB ASP 75 1HB ASP 75 -9.225 -13.770 1.188 306 H ARG 76 H ARG 76 -8.383 -10.829 -0.239 307 HA ARG 76 HA ARG 76 -9.858 -9.809 2.060 308 1HB ARG 76 2HB ARG 76 -7.288 -10.055 1.911 309 2HB ARG 76 1HB ARG 76 -7.351 -8.594 0.936 310 1HG ARG 76 2HG ARG 76 -8.298 -7.346 2.742 311 2HG ARG 76 1HG ARG 76 -8.487 -8.808 3.713 312 1HD ARG 76 2HD ARG 76 -6.159 -9.036 4.008 313 2HD ARG 76 1HD ARG 76 -5.806 -7.876 2.727 314 HE ARG 76 HE ARG 76 -6.086 -6.171 4.233 315 1HH1 ARG 76 1HH1 ARG 76 -7.365 -9.117 5.599 316 2HH1 ARG 76 2HH1 ARG 76 -7.603 -8.432 7.171 317 1HH2 ARG 76 1HH2 ARG 76 -6.399 -5.269 6.300 318 2HH2 ARG 76 2HH2 ARG 76 -7.057 -6.248 7.570 319 H PHE 77 H PHE 77 -8.767 -8.706 -1.135 320 HA PHE 77 HA PHE 77 -10.843 -6.623 -1.019 321 1HB PHE 77 2HB PHE 77 -8.105 -6.314 -2.264 322 2HB PHE 77 1HB PHE 77 -9.370 -5.090 -2.209 323 HD1 PHE 77 1HD PHE 77 -6.566 -6.519 -0.527 324 HD2 PHE 77 2HD PHE 77 -10.119 -4.253 0.067 325 HE1 PHE 77 1HE PHE 77 -5.692 -5.720 1.630 326 HE2 PHE 77 2HE PHE 77 -9.251 -3.451 2.224 327 HZ PHE 77 HZ PHE 77 -7.035 -4.183 3.009 328 H ARG 78 H ARG 78 -12.309 -6.905 -2.532 329 HA ARG 78 HA ARG 78 -12.062 -8.768 -4.625 330 1HB ARG 78 2HB ARG 78 -14.062 -6.957 -3.542 331 2HB ARG 78 1HB ARG 78 -14.150 -7.071 -5.286 332 1HG ARG 78 2HG ARG 78 -14.637 -9.345 -5.240 333 2HG ARG 78 1HG ARG 78 -14.023 -9.531 -3.595 334 1HD ARG 78 2HD ARG 78 -15.999 -7.715 -3.213 335 2HD ARG 78 1HD ARG 78 -16.665 -8.658 -4.545 336 HE ARG 78 HE ARG 78 -15.850 -10.556 -2.805 337 1HH1 ARG 78 1HH1 ARG 78 -17.848 -7.716 -2.459 338 2HH1 ARG 78 2HH1 ARG 78 -18.807 -8.392 -1.185 339 1HH2 ARG 78 1HH2 ARG 78 -17.110 -11.447 -1.130 340 2HH2 ARG 78 2HH2 ARG 78 -18.388 -10.510 -0.430 341 H SER 79 H SER 79 -11.400 -5.361 -4.370 342 HA SER 79 HA SER 79 -10.062 -5.355 -6.900 343 1HB SER 79 2HB SER 79 -11.522 -3.364 -7.723 344 2HB SER 79 1HB SER 79 -12.118 -5.008 -7.951 345 HG SER 79 HG SER 79 -12.796 -3.354 -5.748 346 H PHE 80 H PHE 80 -9.536 -2.908 -7.474 347 HA PHE 80 HA PHE 80 -7.896 -1.944 -5.419 348 1HB PHE 80 2HB PHE 80 -8.130 -1.464 -8.103 349 2HB PHE 80 1HB PHE 80 -8.712 0.051 -7.421 350 HD1 PHE 80 1HD PHE 80 -6.031 -2.286 -6.312 351 HD2 PHE 80 2HD PHE 80 -7.041 1.619 -7.664 352 HE1 PHE 80 1HE PHE 80 -3.707 -1.565 -5.952 353 HE2 PHE 80 2HE PHE 80 -4.719 2.349 -7.310 354 HZ PHE 80 HZ PHE 80 -3.048 0.754 -6.452 355 H ASP 81 H ASP 81 -11.183 -1.132 -6.329 356 HA ASP 81 HA ASP 81 -11.442 1.272 -4.907 357 1HB ASP 81 2HB ASP 81 -13.062 0.010 -6.586 358 2HB ASP 81 1HB ASP 81 -13.762 -0.600 -5.090 359 H ALA 82 H ALA 82 -11.905 -2.088 -3.939 360 HA ALA 82 HA ALA 82 -12.872 -1.521 -1.330 361 1HB ALA 82 1HB ALA 82 -11.681 -4.011 -1.207 362 2HB ALA 82 2HB ALA 82 -12.180 -3.850 -2.891 363 3HB ALA 82 3HB ALA 82 -13.365 -3.668 -1.597 364 H LEU 83 H LEU 83 -9.678 -2.098 -2.698 365 HA LEU 83 HA LEU 83 -8.265 -2.259 -0.252 366 1HB LEU 83 2HB LEU 83 -7.382 -2.937 -2.494 367 2HB LEU 83 1HB LEU 83 -7.270 -1.243 -2.918 368 HG LEU 83 HG LEU 83 -5.587 -0.863 -1.235 369 1HD1 LEU 83 1HD1 LEU 83 -4.713 -2.690 0.142 370 2HD1 LEU 83 2HD1 LEU 83 -5.962 -3.760 -0.493 371 3HD1 LEU 83 3HD1 LEU 83 -6.411 -2.364 0.487 372 1HD2 LEU 83 1HD2 LEU 83 -4.496 -3.354 -2.340 373 2HD2 LEU 83 2HD2 LEU 83 -3.909 -1.696 -2.470 374 3HD2 LEU 83 3HD2 LEU 83 -5.204 -2.257 -3.526 375 H LEU 84 H LEU 84 -8.994 0.350 -2.489 376 HA LEU 84 HA LEU 84 -7.674 2.424 -1.154 377 1HB LEU 84 2HB LEU 84 -9.987 2.302 -3.054 378 2HB LEU 84 1HB LEU 84 -9.570 3.829 -2.297 379 HG LEU 84 HG LEU 84 -7.625 2.181 -3.907 380 1HD1 LEU 84 1HD1 LEU 84 -8.006 4.118 -5.565 381 2HD1 LEU 84 2HD1 LEU 84 -9.531 4.343 -4.712 382 3HD1 LEU 84 3HD1 LEU 84 -9.185 2.807 -5.507 383 1HD2 LEU 84 1HD2 LEU 84 -7.558 4.994 -2.830 384 2HD2 LEU 84 2HD2 LEU 84 -6.381 4.328 -3.963 385 3HD2 LEU 84 3HD2 LEU 84 -6.533 3.642 -2.344 386 H ALA 85 H ALA 85 -10.796 0.889 -0.611 387 HA ALA 85 HA ALA 85 -11.882 2.865 1.110 388 1HB ALA 85 1HB ALA 85 -13.444 1.176 1.785 389 2HB ALA 85 2HB ALA 85 -12.379 -0.103 1.200 390 3HB ALA 85 3HB ALA 85 -13.150 0.995 0.054 391 H ASP 86 H ASP 86 -10.009 -0.077 1.735 392 HA ASP 86 HA ASP 86 -9.914 0.302 4.564 393 1HB ASP 86 2HB ASP 86 -8.734 -1.585 2.602 394 2HB ASP 86 1HB ASP 86 -7.841 -1.367 4.104 395 H LEU 87 H LEU 87 -7.877 1.093 1.839 396 HA LEU 87 HA LEU 87 -5.571 1.885 3.248 397 1HB LEU 87 2HB LEU 87 -6.667 2.727 0.566 398 2HB LEU 87 1HB LEU 87 -5.117 3.272 1.166 399 HG LEU 87 HG LEU 87 -5.854 0.744 -0.095 400 1HD1 LEU 87 1HD1 LEU 87 -3.115 1.825 0.463 401 2HD1 LEU 87 2HD1 LEU 87 -4.151 2.498 -0.795 402 3HD1 LEU 87 3HD1 LEU 87 -3.652 0.808 -0.873 403 1HD2 LEU 87 1HD2 LEU 87 -5.642 0.019 2.299 404 2HD2 LEU 87 2HD2 LEU 87 -3.970 0.582 2.251 405 3HD2 LEU 87 3HD2 LEU 87 -4.492 -0.727 1.190 406 H THR 88 H THR 88 -8.471 3.640 2.315 407 HA THR 88 HA THR 88 -7.628 6.211 3.014 408 HB THR 88 HB THR 88 -10.331 4.871 2.918 409 HG1 THR 88 1HG THR 88 -9.928 5.257 0.901 410 1HG2 THR 88 1HG2 THR 88 -10.561 7.695 2.711 411 2HG2 THR 88 2HG2 THR 88 -9.816 7.281 4.254 412 3HG2 THR 88 3HG2 THR 88 -11.373 6.583 3.811 413 H ARG 89 H ARG 89 -9.257 3.680 4.864 414 HA ARG 89 HA ARG 89 -9.421 5.144 7.283 415 1HB ARG 89 2HB ARG 89 -9.938 2.374 6.401 416 2HB ARG 89 1HB ARG 89 -9.548 2.566 8.105 417 1HG ARG 89 2HG ARG 89 -11.662 3.102 8.469 418 2HG ARG 89 1HG ARG 89 -11.405 4.577 7.534 419 1HD ARG 89 2HD ARG 89 -11.848 3.088 5.478 420 2HD ARG 89 1HD ARG 89 -12.525 1.944 6.636 421 HE ARG 89 HE ARG 89 -13.697 4.411 5.747 422 1HH1 ARG 89 1HH1 ARG 89 -13.598 2.064 8.328 423 2HH1 ARG 89 2HH1 ARG 89 -15.175 2.465 8.921 424 1HH2 ARG 89 1HH2 ARG 89 -15.770 4.939 6.525 425 2HH2 ARG 89 2HH2 ARG 89 -16.409 4.096 7.897 426 H SER 90 H SER 90 -7.047 2.778 6.043 427 HA SER 90 HA SER 90 -5.597 2.712 8.512 428 1HB SER 90 2HB SER 90 -5.706 1.021 6.440 429 2HB SER 90 1HB SER 90 -4.241 1.902 6.004 430 HG SER 90 HG SER 90 -4.707 0.158 8.100 431 H LEU 91 H LEU 91 -5.132 4.449 5.445 432 HA LEU 91 HA LEU 91 -2.703 5.623 6.514 433 1HB LEU 91 2HB LEU 91 -3.839 5.109 3.871 434 2HB LEU 91 1HB LEU 91 -3.052 6.658 4.013 435 HG LEU 91 HG LEU 91 -1.858 3.922 4.313 436 1HD1 LEU 91 1HD1 LEU 91 -1.696 6.150 2.414 437 2HD1 LEU 91 2HD1 LEU 91 -1.461 4.420 2.167 438 3HD1 LEU 91 3HD1 LEU 91 -0.154 5.402 2.830 439 1HD2 LEU 91 1HD2 LEU 91 -0.847 6.513 5.418 440 2HD2 LEU 91 2HD2 LEU 91 0.276 5.264 4.880 441 3HD2 LEU 91 3HD2 LEU 91 -0.881 4.915 6.165 442 H SER 92 H SER 92 -5.926 6.351 6.648 443 HA SER 92 HA SER 92 -6.279 8.957 5.899 444 1HB SER 92 2HB SER 92 -7.634 8.996 8.237 445 2HB SER 92 1HB SER 92 -8.227 8.184 6.789 446 HG SER 92 HG SER 92 -8.310 6.577 8.189 447 H ASP 93 H ASP 93 -5.620 10.929 6.545 448 HA ASP 93 HA ASP 93 -4.339 11.276 9.127 449 1HB ASP 93 2HB ASP 93 -2.864 11.036 6.636 450 2HB ASP 93 1HB ASP 93 -2.535 12.563 7.447 451 H ASN 94 H ASN 94 -6.430 12.404 6.909 452 HA ASN 94 HA ASN 94 -7.210 14.472 6.242 453 1HB ASN 94 2HB ASN 94 -8.296 13.914 8.400 454 2HB ASN 94 1HB ASN 94 -7.061 14.851 9.234 455 1HD2 ASN 94 1HD2 ASN 94 -8.132 16.546 10.003 456 2HD2 ASN 94 2HD2 ASN 94 -9.096 17.630 9.063 457 H ILE 95 H ILE 95 -4.339 14.456 6.112 458 HA ILE 95 HA ILE 95 -3.818 17.302 6.638 459 HB ILE 95 HB ILE 95 -2.068 14.917 7.143 460 1HG1 ILE 95 2HG1 ILE 95 -3.268 15.861 9.031 461 2HG1 ILE 95 1HG1 ILE 95 -1.546 16.181 9.208 462 1HG2 ILE 95 1HG2 ILE 95 -0.213 16.738 7.418 463 2HG2 ILE 95 2HG2 ILE 95 -1.181 17.607 6.227 464 3HG2 ILE 95 3HG2 ILE 95 -0.534 16.013 5.843 465 1HD1 ILE 95 1HD1 ILE 95 -2.344 18.224 9.747 466 2HD1 ILE 95 2HD1 ILE 95 -3.789 18.048 8.751 467 3HD1 ILE 95 3HD1 ILE 95 -2.242 18.438 7.999 468 H ASN 96 H ASN 96 -1.995 14.740 5.005 469 HA ASN 96 HA ASN 96 -1.845 16.400 2.607 470 1HB ASN 96 2HB ASN 96 -0.220 14.235 3.783 471 2HB ASN 96 1HB ASN 96 -0.377 14.169 2.030 472 1HD2 ASN 96 1HD2 ASN 96 1.075 15.725 4.692 473 2HD2 ASN 96 2HD2 ASN 96 1.990 16.892 3.807 474 H LEU 97 H LEU 97 -3.688 13.914 3.889 475 HA LEU 97 HA LEU 97 -4.649 13.126 1.223 476 1HB LEU 97 2HB LEU 97 -3.984 11.492 3.618 477 2HB LEU 97 1HB LEU 97 -5.374 11.007 2.665 478 HG LEU 97 HG LEU 97 -2.687 11.448 1.395 479 1HD1 LEU 97 1HD1 LEU 97 -2.395 8.973 1.569 480 2HD1 LEU 97 2HD1 LEU 97 -3.725 8.959 2.729 481 3HD1 LEU 97 3HD1 LEU 97 -2.245 9.844 3.095 482 1HD2 LEU 97 1HD2 LEU 97 -3.674 10.771 -0.477 483 2HD2 LEU 97 2HD2 LEU 97 -5.214 10.930 0.369 484 3HD2 LEU 97 3HD2 LEU 97 -4.389 9.371 0.324 485 HA PRO 98 HA PRO 98 -8.063 15.507 3.272 486 1HB PRO 98 2HB PRO 98 -8.984 14.890 0.485 487 2HB PRO 98 1HB PRO 98 -9.200 16.357 1.433 488 1HG PRO 98 2HG PRO 98 -7.335 16.262 -0.441 489 2HG PRO 98 1HG PRO 98 -6.993 17.042 1.116 490 1HD PRO 98 2HD PRO 98 -6.079 14.405 0.077 491 2HD PRO 98 1HD PRO 98 -5.254 15.539 1.165 492 H GLN 99 H GLN 99 -9.035 13.127 0.824 493 HA GLN 99 HA GLN 99 -10.971 12.036 2.717 494 1HB GLN 99 2HB GLN 99 -10.640 11.488 -0.237 495 2HB GLN 99 1HB GLN 99 -11.970 10.937 0.774 496 1HG GLN 99 2HG GLN 99 -13.041 12.758 0.093 497 2HG GLN 99 1HG GLN 99 -11.982 13.649 1.185 498 1HE2 GLN 99 1HE2 GLN 99 -11.522 12.127 -1.989 499 2HE2 GLN 99 2HE2 GLN 99 -10.895 13.538 -2.765 500 H GLY 100 H GLY 100 -8.367 11.380 3.360 501 1HA GLY 100 2HA GLY 100 -7.201 9.526 4.060 502 2HA GLY 100 1HA GLY 100 -8.546 8.548 3.497 503 H VAL 101 H VAL 101 -8.630 8.067 1.172 504 HA VAL 101 HA VAL 101 -6.286 8.443 -0.451 505 HB VAL 101 HB VAL 101 -6.877 5.627 0.497 506 1HG1 VAL 101 1HG1 VAL 101 -6.072 5.951 -1.869 507 2HG1 VAL 101 2HG1 VAL 101 -5.058 4.926 -0.855 508 3HG1 VAL 101 3HG1 VAL 101 -4.577 6.590 -1.191 509 1HG2 VAL 101 1HG2 VAL 101 -5.774 6.763 2.290 510 2HG2 VAL 101 2HG2 VAL 101 -4.595 7.472 1.186 511 3HG2 VAL 101 3HG2 VAL 101 -4.587 5.736 1.488 512 H ARG 102 H ARG 102 -7.174 8.775 -2.364 513 HA ARG 102 HA ARG 102 -9.594 7.298 -3.095 514 1HB ARG 102 2HB ARG 102 -8.668 10.009 -3.547 515 2HB ARG 102 1HB ARG 102 -9.151 9.228 -5.046 516 1HG ARG 102 2HG ARG 102 -10.935 9.037 -2.675 517 2HG ARG 102 1HG ARG 102 -10.886 10.534 -3.610 518 1HD ARG 102 2HD ARG 102 -12.576 8.622 -4.216 519 2HD ARG 102 1HD ARG 102 -11.787 9.563 -5.475 520 HE ARG 102 HE ARG 102 -10.140 7.624 -5.557 521 1HH1 ARG 102 1HH1 ARG 102 -13.504 7.214 -4.664 522 2HH1 ARG 102 2HH1 ARG 102 -13.557 5.563 -5.175 523 1HH2 ARG 102 1HH2 ARG 102 -10.229 5.460 -6.224 524 2HH2 ARG 102 2HH2 ARG 102 -11.705 4.567 -6.058 525 H TYR 103 H TYR 103 -6.290 7.919 -4.086 526 HA TYR 103 HA TYR 103 -6.572 5.724 -5.997 527 1HB TYR 103 2HB TYR 103 -5.073 8.188 -6.842 528 2HB TYR 103 1HB TYR 103 -5.621 6.836 -7.813 529 HD1 TYR 103 1HD TYR 103 -7.755 6.793 -8.798 530 HD2 TYR 103 2HD TYR 103 -6.748 9.878 -6.049 531 HE1 TYR 103 1HE TYR 103 -9.756 8.038 -9.478 532 HE2 TYR 103 2HE TYR 103 -8.757 11.133 -6.716 533 HH TYR 103 HH TYR 103 -11.253 9.764 -8.562 534 H ILE 104 H ILE 104 -4.525 4.878 -6.765 535 HA ILE 104 HA ILE 104 -2.341 5.294 -4.834 536 HB ILE 104 HB ILE 104 -3.152 2.686 -6.127 537 1HG1 ILE 104 2HG1 ILE 104 -3.496 3.788 -3.340 538 2HG1 ILE 104 1HG1 ILE 104 -4.738 3.178 -4.427 539 1HG2 ILE 104 1HG2 ILE 104 -1.400 1.646 -4.908 540 2HG2 ILE 104 2HG2 ILE 104 -1.056 3.129 -4.013 541 3HG2 ILE 104 3HG2 ILE 104 -0.694 3.033 -5.736 542 1HD1 ILE 104 1HD1 ILE 104 -4.455 1.530 -2.783 543 2HD1 ILE 104 2HD1 ILE 104 -2.696 1.622 -2.877 544 3HD1 ILE 104 3HD1 ILE 104 -3.614 0.918 -4.208 545 H TYR 105 H TYR 105 -0.550 6.005 -5.760 546 HA TYR 105 HA TYR 105 -0.188 5.632 -8.634 547 1HB TYR 105 2HB TYR 105 0.227 7.848 -6.809 548 2HB TYR 105 1HB TYR 105 1.648 7.533 -7.805 549 HD1 TYR 105 1HD TYR 105 -1.654 8.920 -7.724 550 HD2 TYR 105 2HD TYR 105 1.368 7.393 -10.285 551 HE1 TYR 105 1HE TYR 105 -2.733 10.007 -9.629 552 HE2 TYR 105 2HE TYR 105 0.311 8.472 -12.199 553 HH TYR 105 HH TYR 105 -2.520 9.328 -12.511 554 H THR 106 H THR 106 2.051 5.555 -9.426 555 HA THR 106 HA THR 106 3.443 3.401 -8.153 556 HB THR 106 HB THR 106 5.220 4.237 -9.987 557 HG1 THR 106 1HG THR 106 3.792 6.096 -10.393 558 1HG2 THR 106 1HG2 THR 106 4.605 2.301 -10.848 559 2HG2 THR 106 2HG2 THR 106 3.214 3.098 -11.580 560 3HG2 THR 106 3HG2 THR 106 3.069 2.363 -9.985 561 H ILE 107 H ILE 107 5.658 3.442 -7.430 562 HA ILE 107 HA ILE 107 6.220 5.212 -5.435 563 HB ILE 107 HB ILE 107 7.433 3.077 -5.858 564 1HG1 ILE 107 2HG1 ILE 107 9.628 3.912 -5.017 565 2HG1 ILE 107 1HG1 ILE 107 9.095 5.554 -5.371 566 1HG2 ILE 107 1HG2 ILE 107 7.885 3.600 -8.278 567 2HG2 ILE 107 2HG2 ILE 107 9.251 2.948 -7.372 568 3HG2 ILE 107 3HG2 ILE 107 9.170 4.674 -7.723 569 1HD1 ILE 107 1HD1 ILE 107 7.197 4.071 -3.743 570 2HD1 ILE 107 2HD1 ILE 107 7.895 5.673 -3.503 571 3HD1 ILE 107 3HD1 ILE 107 8.783 4.237 -2.992 572 H ASP 108 H ASP 108 6.720 5.687 -8.843 573 HA ASP 108 HA ASP 108 8.287 8.110 -8.380 574 1HB ASP 108 2HB ASP 108 7.763 6.352 -10.727 575 2HB ASP 108 1HB ASP 108 8.096 8.052 -11.042 576 H GLY 109 H GLY 109 5.090 7.071 -9.227 577 1HA GLY 109 2HA GLY 109 3.162 8.388 -9.121 578 2HA GLY 109 1HA GLY 109 4.170 9.826 -9.112 579 H SER 110 H SER 110 5.008 7.611 -11.550 580 HA SER 110 HA SER 110 4.340 9.422 -13.618 581 1HB SER 110 2HB SER 110 4.826 7.224 -15.030 582 2HB SER 110 1HB SER 110 6.127 8.111 -14.235 583 HG SER 110 HG SER 110 6.399 6.023 -13.633 584 H ARG 111 H ARG 111 2.844 6.413 -12.490 585 HA ARG 111 HA ARG 111 0.378 7.195 -13.814 586 1HB ARG 111 2HB ARG 111 0.138 4.732 -14.546 587 2HB ARG 111 1HB ARG 111 1.166 5.789 -15.505 588 1HG ARG 111 2HG ARG 111 3.133 4.836 -14.643 589 2HG ARG 111 1HG ARG 111 2.265 4.036 -13.331 590 1HD ARG 111 2HD ARG 111 1.549 3.372 -16.147 591 2HD ARG 111 1HD ARG 111 3.034 2.710 -15.471 592 HE ARG 111 HE ARG 111 1.763 1.486 -13.917 593 1HH1 ARG 111 1HH1 ARG 111 -0.254 3.317 -16.109 594 2HH1 ARG 111 2HH1 ARG 111 -1.677 2.397 -15.757 595 1HH2 ARG 111 1HH2 ARG 111 -0.111 0.286 -13.457 596 2HH2 ARG 111 2HH2 ARG 111 -1.598 0.681 -14.253 597 H LYS 112 H LYS 112 -1.450 6.437 -12.844 598 HA LYS 112 HA LYS 112 -1.088 5.352 -10.166 599 1HB LYS 112 2HB LYS 112 -2.722 6.753 -9.583 600 2HB LYS 112 1HB LYS 112 -2.793 7.325 -11.239 601 1HG LYS 112 2HG LYS 112 -4.413 5.440 -11.692 602 2HG LYS 112 1HG LYS 112 -4.465 5.190 -9.946 603 1HD LYS 112 2HD LYS 112 -6.318 6.607 -10.724 604 2HD LYS 112 1HD LYS 112 -5.244 7.470 -9.621 605 1HE LYS 112 2HE LYS 112 -4.259 8.699 -11.371 606 2HE LYS 112 1HE LYS 112 -4.933 7.632 -12.604 607 1HZ LYS 112 1HZ LYS 112 -6.833 9.017 -10.881 608 2HZ LYS 112 2HZ LYS 112 -6.931 8.659 -12.531 609 3HZ LYS 112 3HZ LYS 112 -5.999 9.968 -12.004 610 H ILE 113 H ILE 113 -1.990 3.466 -9.452 611 HA ILE 113 HA ILE 113 -2.547 1.486 -11.463 612 HB ILE 113 HB ILE 113 -2.592 1.249 -8.453 613 1HG1 ILE 113 2HG1 ILE 113 -0.403 1.954 -9.626 614 2HG1 ILE 113 1HG1 ILE 113 -0.351 0.600 -8.505 615 1HG2 ILE 113 1HG2 ILE 113 -3.621 -0.682 -8.961 616 2HG2 ILE 113 2HG2 ILE 113 -1.985 -1.216 -9.349 617 3HG2 ILE 113 3HG2 ILE 113 -3.061 -0.666 -10.634 618 1HD1 ILE 113 1HD1 ILE 113 0.364 -0.785 -10.080 619 2HD1 ILE 113 2HD1 ILE 113 0.610 0.644 -11.088 620 3HD1 ILE 113 3HD1 ILE 113 -0.894 -0.268 -11.206 621 H GLY 114 H GLY 114 -4.444 0.462 -11.869 622 1HA GLY 114 2HA GLY 114 -6.837 1.513 -10.490 623 2HA GLY 114 1HA GLY 114 -6.803 1.121 -12.203 624 H SER 115 H SER 115 -5.140 -1.302 -11.623 625 HA SER 115 HA SER 115 -7.260 -2.990 -10.472 626 1HB SER 115 2HB SER 115 -6.788 -4.696 -12.102 627 2HB SER 115 1HB SER 115 -7.035 -3.180 -12.969 628 HG SER 115 HG SER 115 -4.729 -2.975 -13.028 629 H MET 116 H MET 116 -6.635 -4.761 -9.260 630 HA MET 116 HA MET 116 -4.324 -4.484 -7.695 631 1HB MET 116 2HB MET 116 -6.660 -5.922 -7.524 632 2HB MET 116 1HB MET 116 -5.464 -7.184 -7.781 633 1HG MET 116 2HG MET 116 -4.253 -6.551 -5.843 634 2HG MET 116 1HG MET 116 -5.201 -5.075 -5.659 635 1HE MET 116 1HE MET 116 -7.699 -5.097 -5.525 636 2HE MET 116 2HE MET 116 -7.379 -5.135 -3.791 637 3HE MET 116 3HE MET 116 -8.601 -6.200 -4.487 638 H ASP 117 H ASP 117 -4.920 -6.141 -10.679 639 HA ASP 117 HA ASP 117 -2.898 -8.049 -10.639 640 1HB ASP 117 2HB ASP 117 -4.683 -6.828 -12.576 641 2HB ASP 117 1HB ASP 117 -3.123 -7.213 -13.275 642 H GLU 118 H GLU 118 -2.691 -4.629 -10.830 643 HA GLU 118 HA GLU 118 -0.095 -4.639 -12.130 644 1HB GLU 118 2HB GLU 118 -1.726 -2.397 -10.931 645 2HB GLU 118 1HB GLU 118 -0.192 -2.179 -11.763 646 1HG GLU 118 2HG GLU 118 -2.533 -3.503 -13.085 647 2HG GLU 118 1HG GLU 118 -2.329 -1.752 -13.078 648 H LEU 119 H LEU 119 -1.315 -4.913 -8.960 649 HA LEU 119 HA LEU 119 0.987 -3.770 -7.644 650 1HB LEU 119 2HB LEU 119 -0.908 -5.565 -6.213 651 2HB LEU 119 1HB LEU 119 -0.117 -4.104 -5.657 652 HG LEU 119 HG LEU 119 -2.422 -4.178 -7.601 653 1HD1 LEU 119 1HD1 LEU 119 -2.490 -3.243 -4.750 654 2HD1 LEU 119 2HD1 LEU 119 -2.888 -4.897 -5.212 655 3HD1 LEU 119 3HD1 LEU 119 -3.842 -3.553 -5.839 656 1HD2 LEU 119 1HD2 LEU 119 -1.325 -1.805 -6.125 657 2HD2 LEU 119 2HD2 LEU 119 -2.458 -1.832 -7.474 658 3HD2 LEU 119 3HD2 LEU 119 -0.767 -2.259 -7.735 659 H GLU 120 H GLU 120 2.869 -4.798 -7.561 660 HA GLU 120 HA GLU 120 2.904 -7.729 -7.625 661 1HB GLU 120 2HB GLU 120 5.152 -5.751 -8.045 662 2HB GLU 120 1HB GLU 120 5.275 -7.492 -8.207 663 1HG GLU 120 2HG GLU 120 4.502 -7.452 -10.283 664 2HG GLU 120 1HG GLU 120 3.141 -6.425 -9.834 665 H GLU 121 H GLU 121 4.547 -8.817 -6.232 666 HA GLU 121 HA GLU 121 4.146 -8.239 -3.537 667 1HB GLU 121 2HB GLU 121 6.203 -9.911 -4.946 668 2HB GLU 121 1HB GLU 121 6.223 -9.719 -3.196 669 1HG GLU 121 2HG GLU 121 3.578 -10.391 -4.008 670 2HG GLU 121 1HG GLU 121 4.704 -11.521 -4.755 671 H GLY 122 H GLY 122 5.679 -7.634 -1.892 672 1HA GLY 122 2HA GLY 122 6.898 -5.904 -0.999 673 2HA GLY 122 1HA GLY 122 8.150 -6.603 -2.001 674 H GLU 123 H GLU 123 5.224 -4.792 -2.859 675 HA GLU 123 HA GLU 123 6.906 -3.011 -4.477 676 1HB GLU 123 2HB GLU 123 4.070 -3.888 -4.606 677 2HB GLU 123 1HB GLU 123 4.449 -2.282 -5.211 678 1HG GLU 123 2HG GLU 123 6.246 -4.395 -6.151 679 2HG GLU 123 1HG GLU 123 4.569 -4.559 -6.667 680 H SER 124 H SER 124 6.663 -0.756 -4.441 681 HA SER 124 HA SER 124 5.600 0.294 -1.902 682 1HB SER 124 2HB SER 124 7.923 1.125 -3.625 683 2HB SER 124 1HB SER 124 7.172 2.278 -2.522 684 HG SER 124 HG SER 124 8.643 -0.035 -1.964 685 H TYR 125 H TYR 125 3.878 1.605 -2.019 686 HA TYR 125 HA TYR 125 3.330 2.931 -4.585 687 1HB TYR 125 2HB TYR 125 1.465 1.378 -2.856 688 2HB TYR 125 1HB TYR 125 0.860 2.638 -3.907 689 HD1 TYR 125 1HD TYR 125 1.702 -0.793 -3.723 690 HD2 TYR 125 2HD TYR 125 1.630 2.528 -6.364 691 HE1 TYR 125 1HE TYR 125 1.738 -2.325 -5.642 692 HE2 TYR 125 2HE TYR 125 1.671 1.034 -8.278 693 HH TYR 125 HH TYR 125 2.466 -2.205 -8.080 694 H VAL 126 H VAL 126 1.963 4.741 -4.517 695 HA VAL 126 HA VAL 126 2.168 6.229 -1.967 696 HB VAL 126 HB VAL 126 2.701 7.132 -4.769 697 1HG1 VAL 126 1HG1 VAL 126 2.613 9.521 -3.626 698 2HG1 VAL 126 2HG1 VAL 126 1.360 8.745 -2.658 699 3HG1 VAL 126 3HG1 VAL 126 1.198 8.821 -4.413 700 1HG2 VAL 126 1HG2 VAL 126 4.715 7.759 -3.954 701 2HG2 VAL 126 2HG2 VAL 126 4.326 6.566 -2.715 702 3HG2 VAL 126 3HG2 VAL 126 4.047 8.281 -2.408 703 H CYS 127 H CYS 127 0.405 7.328 -1.236 704 HA CYS 127 HA CYS 127 -2.108 6.722 -2.594 705 1HB CYS 127 2HB CYS 127 -1.411 7.621 0.184 706 2HB CYS 127 1HB CYS 127 -3.060 7.757 -0.416 707 HG CYS 127 HG CYS 127 -1.603 5.016 -0.177 708 H SER 128 H SER 128 -3.293 8.166 -3.647 709 HA SER 128 HA SER 128 -2.733 11.027 -3.273 710 1HB SER 128 2HB SER 128 -3.105 9.676 -5.959 711 2HB SER 128 1HB SER 128 -2.814 11.396 -5.681 712 HG SER 128 HG SER 128 -0.846 10.566 -6.131 713 H SER 129 H SER 129 -4.452 12.417 -4.198 714 HA SER 129 HA SER 129 -7.046 11.194 -4.595 715 1HB SER 129 2HB SER 129 -8.132 12.444 -2.775 716 2HB SER 129 1HB SER 129 -6.913 11.336 -2.142 717 HG SER 129 HG SER 129 -7.079 13.951 -1.781 718 H ASP 130 H ASP 130 -5.362 14.254 -3.942 719 HA ASP 130 HA ASP 130 -6.415 15.360 -6.411 720 1HB ASP 130 2HB ASP 130 -7.606 15.966 -3.888 721 2HB ASP 130 1HB ASP 130 -6.777 17.409 -4.463 722 H ASN 131 H ASN 131 -3.797 14.596 -5.449 723 HA ASN 131 HA ASN 131 -2.475 17.231 -5.370 724 1HB ASN 131 2HB ASN 131 -1.073 14.721 -4.539 725 2HB ASN 131 1HB ASN 131 -0.789 16.377 -4.018 726 1HD2 ASN 131 1HD2 ASN 131 -2.470 13.458 -3.439 727 2HD2 ASN 131 2HD2 ASN 131 -3.310 13.959 -2.014 728 H PHE 132 H PHE 132 -0.328 17.313 -6.412 729 HA PHE 132 HA PHE 132 -0.444 15.999 -9.004 730 1HB PHE 132 2HB PHE 132 1.651 17.981 -8.147 731 2HB PHE 132 1HB PHE 132 1.071 17.630 -9.772 732 HD1 PHE 132 1HD PHE 132 0.388 19.404 -6.648 733 HD2 PHE 132 2HD PHE 132 -0.973 18.605 -10.600 734 HE1 PHE 132 1HE PHE 132 -1.193 21.281 -6.479 735 HE2 PHE 132 2HE PHE 132 -2.555 20.482 -10.439 736 HZ PHE 132 HZ PHE 132 -2.667 21.823 -8.376 737 H PHE 133 H PHE 133 0.569 14.854 -6.249 738 HA PHE 133 HA PHE 133 2.030 13.236 -5.622 739 1HB PHE 133 2HB PHE 133 1.520 12.243 -7.829 740 2HB PHE 133 1HB PHE 133 2.832 13.178 -8.535 741 HD1 PHE 133 1HD PHE 133 5.185 12.790 -7.611 742 HD2 PHE 133 2HD PHE 133 1.923 10.147 -6.913 743 HE1 PHE 133 1HE PHE 133 6.767 10.990 -7.053 744 HE2 PHE 133 2HE PHE 133 3.500 8.343 -6.355 745 HZ PHE 133 HZ PHE 133 5.925 8.764 -6.423 746 H LYS 134 H LYS 134 3.741 13.674 -4.422 747 HA LYS 134 HA LYS 134 5.717 15.600 -5.426 748 1HB LYS 134 2HB LYS 134 4.854 14.785 -2.668 749 2HB LYS 134 1HB LYS 134 6.406 15.572 -2.923 750 1HG LYS 134 2HG LYS 134 4.789 17.246 -4.283 751 2HG LYS 134 1HG LYS 134 3.682 16.673 -3.033 752 1HD LYS 134 2HD LYS 134 5.274 17.324 -1.306 753 2HD LYS 134 1HD LYS 134 6.416 17.858 -2.542 754 1HE LYS 134 2HE LYS 134 5.454 19.862 -2.060 755 2HE LYS 134 1HE LYS 134 4.328 19.309 -3.300 756 1HZ LYS 134 1HZ LYS 134 2.686 19.028 -1.807 757 2HZ LYS 134 2HZ LYS 134 3.565 20.154 -0.902 758 3HZ LYS 134 3HZ LYS 134 3.720 18.502 -0.575 759 H LYS 135 H LYS 135 7.613 14.863 -6.096 760 HA LYS 135 HA LYS 135 8.366 12.118 -5.669 761 1HB LYS 135 2HB LYS 135 9.428 14.403 -7.267 762 2HB LYS 135 1HB LYS 135 10.505 13.059 -6.914 763 1HG LYS 135 2HG LYS 135 9.635 12.402 -8.922 764 2HG LYS 135 1HG LYS 135 8.514 11.617 -7.807 765 1HD LYS 135 2HD LYS 135 7.005 12.601 -9.205 766 2HD LYS 135 1HD LYS 135 7.235 13.929 -8.066 767 1HE LYS 135 2HE LYS 135 9.141 14.636 -9.684 768 2HE LYS 135 1HE LYS 135 8.301 13.606 -10.842 769 1HZ LYS 135 1HZ LYS 135 7.682 16.232 -10.080 770 2HZ LYS 135 2HZ LYS 135 6.399 15.237 -9.608 771 3HZ LYS 135 3HZ LYS 135 6.902 15.258 -11.223 772 H VAL 136 H VAL 136 8.905 11.763 -3.557 773 HA VAL 136 HA VAL 136 11.213 13.286 -2.532 774 HB VAL 136 HB VAL 136 10.090 12.191 -0.273 775 1HG1 VAL 136 1HG1 VAL 136 10.278 14.844 -1.509 776 2HG1 VAL 136 2HG1 VAL 136 10.767 14.292 0.093 777 3HG1 VAL 136 3HG1 VAL 136 9.078 14.692 -0.225 778 1HG2 VAL 136 1HG2 VAL 136 8.065 11.554 -1.513 779 2HG2 VAL 136 2HG2 VAL 136 7.825 13.241 -1.968 780 3HG2 VAL 136 3HG2 VAL 136 7.730 12.762 -0.273 781 H GLU 137 H GLU 137 12.065 11.860 -0.483 782 HA GLU 137 HA GLU 137 13.126 9.501 -1.738 783 1HB GLU 137 2HB GLU 137 14.332 9.243 0.489 784 2HB GLU 137 1HB GLU 137 14.684 10.709 -0.417 785 1HG GLU 137 2HG GLU 137 13.878 12.031 1.184 786 2HG GLU 137 1HG GLU 137 12.464 11.010 1.444 787 H TYR 138 H TYR 138 10.800 8.815 -1.890 788 HA TYR 138 HA TYR 138 9.294 7.822 0.195 789 1HB TYR 138 2HB TYR 138 9.624 7.137 -2.689 790 2HB TYR 138 1HB TYR 138 8.567 6.140 -1.683 791 HD1 TYR 138 1HD TYR 138 8.488 8.665 -3.964 792 HD2 TYR 138 2HD TYR 138 7.050 7.816 -0.052 793 HE1 TYR 138 1HE TYR 138 6.686 10.310 -4.276 794 HE2 TYR 138 2HE TYR 138 5.243 9.457 -0.352 795 HH TYR 138 HH TYR 138 5.033 11.685 -1.981 796 H THR 139 H THR 139 12.169 6.502 -1.275 797 HA THR 139 HA THR 139 12.265 4.437 0.764 798 HB THR 139 HB THR 139 12.334 2.580 -0.637 799 HG1 THR 139 1HG THR 139 13.039 2.612 -2.645 800 1HG2 THR 139 1HG2 THR 139 10.060 3.311 -0.666 801 2HG2 THR 139 2HG2 THR 139 10.482 2.731 -2.279 802 3HG2 THR 139 3HG2 THR 139 10.399 4.463 -1.957 803 H LYS 140 H LYS 140 13.777 6.898 -0.333 804 HA LYS 140 HA LYS 140 16.314 5.877 -1.177 805 1HB LYS 140 2HB LYS 140 15.058 8.381 -1.140 806 2HB LYS 140 1HB LYS 140 16.438 8.547 -0.063 807 1HG LYS 140 2HG LYS 140 16.913 7.241 -2.674 808 2HG LYS 140 1HG LYS 140 16.592 8.976 -2.679 809 1HD LYS 140 2HD LYS 140 18.420 9.357 -1.144 810 2HD LYS 140 1HD LYS 140 18.698 7.621 -0.996 811 1HE LYS 140 2HE LYS 140 20.285 8.793 -2.525 812 2HE LYS 140 1HE LYS 140 19.396 7.466 -3.274 813 1HZ LYS 140 1HZ LYS 140 18.090 8.917 -4.488 814 2HZ LYS 140 2HZ LYS 140 19.601 9.677 -4.530 815 3HZ LYS 140 3HZ LYS 140 18.404 10.236 -3.475 816 H ASN 141 H ASN 141 17.753 4.959 0.026 817 HA ASN 141 HA ASN 141 19.064 4.388 1.769 818 1HB ASN 141 2HB ASN 141 18.383 7.193 2.313 819 2HB ASN 141 1HB ASN 141 18.866 6.276 3.736 820 1HD2 ASN 141 1HD2 ASN 141 19.866 6.647 0.350 821 2HD2 ASN 141 2HD2 ASN 141 21.559 6.738 0.684 822 H VAL 142 H VAL 142 15.985 4.034 1.750 823 HA VAL 142 HA VAL 142 15.472 3.643 4.589 824 HB VAL 142 HB VAL 142 13.657 3.082 2.238 825 1HG1 VAL 142 1HG1 VAL 142 13.062 3.323 5.187 826 2HG1 VAL 142 2HG1 VAL 142 13.061 1.831 4.248 827 3HG1 VAL 142 3HG1 VAL 142 11.869 3.085 3.910 828 1HG2 VAL 142 1HG2 VAL 142 14.417 5.566 3.528 829 2HG2 VAL 142 2HG2 VAL 142 12.679 5.281 3.613 830 3HG2 VAL 142 3HG2 VAL 142 13.493 5.299 2.049 831 H ASN 143 H ASN 143 14.882 1.629 5.489 832 HA ASN 143 HA ASN 143 16.373 -0.586 4.451 833 1HB ASN 143 2HB ASN 143 14.507 -0.352 6.818 834 2HB ASN 143 1HB ASN 143 15.456 -1.788 6.445 835 1HD2 ASN 143 1HD2 ASN 143 16.950 -1.883 7.973 836 2HD2 ASN 143 2HD2 ASN 143 18.022 -0.602 8.412 837 HA PRO 144 HA PRO 144 12.732 -2.025 2.197 838 1HB PRO 144 2HB PRO 144 14.359 -3.603 0.506 839 2HB PRO 144 1HB PRO 144 13.711 -2.000 0.164 840 1HG PRO 144 2HG PRO 144 16.412 -2.652 0.511 841 2HG PRO 144 1HG PRO 144 15.720 -1.023 0.508 842 1HD PRO 144 2HD PRO 144 16.507 -2.747 2.809 843 2HD PRO 144 1HD PRO 144 16.562 -0.979 2.646 844 H ASN 145 H ASN 145 14.010 -3.398 4.623 845 HA ASN 145 HA ASN 145 13.738 -6.206 3.927 846 1HB ASN 145 2HB ASN 145 14.283 -4.985 6.638 847 2HB ASN 145 1HB ASN 145 14.506 -6.669 6.170 848 1HD2 ASN 145 1HD2 ASN 145 16.402 -7.279 5.362 849 2HD2 ASN 145 2HD2 ASN 145 17.694 -6.213 4.940 850 H TRP 146 H TRP 146 11.451 -4.101 4.146 851 HA TRP 146 HA TRP 146 9.817 -5.054 6.283 852 1HB TRP 146 2HB TRP 146 7.975 -3.853 4.865 853 2HB TRP 146 1HB TRP 146 9.202 -2.907 5.696 854 HD1 TRP 146 HD TRP 146 11.048 -1.689 4.181 855 HE1 TRP 146 1HE TRP 146 11.049 -1.024 1.695 856 HE3 TRP 146 3HE TRP 146 7.180 -4.615 2.547 857 HZ2 TRP 146 2HZ TRP 146 9.600 -1.648 -0.642 858 HZ3 TRP 146 3HZ TRP 146 6.547 -4.510 0.179 859 HH2 TRP 146 HH TRP 146 7.733 -3.062 -1.384 860 H SER 147 H SER 147 10.044 -5.747 2.833 861 HA SER 147 HA SER 147 7.811 -7.585 2.927 862 1HB SER 147 2HB SER 147 8.461 -8.037 0.536 863 2HB SER 147 1HB SER 147 8.097 -6.347 0.882 864 HG SER 147 HG SER 147 10.160 -7.053 -0.324 865 H VAL 148 H VAL 148 9.471 -8.467 4.806 866 HA VAL 148 HA VAL 148 10.379 -11.009 3.732 867 HB VAL 148 HB VAL 148 12.264 -9.378 5.431 868 1HG1 VAL 148 1HG1 VAL 148 13.540 -11.204 5.517 869 2HG1 VAL 148 2HG1 VAL 148 13.390 -11.478 3.781 870 3HG1 VAL 148 3HG1 VAL 148 12.158 -12.096 4.882 871 1HG2 VAL 148 1HG2 VAL 148 12.303 -9.772 2.439 872 2HG2 VAL 148 2HG2 VAL 148 13.595 -9.038 3.388 873 3HG2 VAL 148 3HG2 VAL 148 12.017 -8.255 3.291 874 H ASN 149 H ASN 149 8.264 -10.004 5.549 875 HA ASN 149 HA ASN 149 9.069 -11.107 8.130 876 1HB ASN 149 2HB ASN 149 6.881 -9.344 7.176 877 2HB ASN 149 1HB ASN 149 6.505 -10.401 8.533 878 1HD2 ASN 149 1HD2 ASN 149 6.624 -9.282 10.334 879 2HD2 ASN 149 2HD2 ASN 149 7.869 -8.162 10.759 880 H VAL 150 H VAL 150 8.660 -12.780 5.699 881 HA VAL 150 HA VAL 150 6.358 -14.394 6.541 882 HB VAL 150 HB VAL 150 6.782 -15.606 4.344 883 1HG1 VAL 150 1HG1 VAL 150 6.071 -12.682 4.148 884 2HG1 VAL 150 2HG1 VAL 150 4.982 -13.946 4.720 885 3HG1 VAL 150 3HG1 VAL 150 5.567 -13.973 3.056 886 1HG2 VAL 150 1HG2 VAL 150 9.139 -14.491 4.235 887 2HG2 VAL 150 2HG2 VAL 150 8.261 -13.155 3.489 888 3HG2 VAL 150 3HG2 VAL 150 8.221 -14.758 2.752 Start of MODEL 2 1 1H GLY 38 1HT GLY 38 8.180 -10.493 -26.515 2 2H GLY 38 2HT GLY 38 7.034 -11.718 -26.306 3 3H GLY 38 3HT GLY 38 8.679 -12.056 -26.101 4 1HA GLY 38 1HA GLY 38 7.848 -11.902 -23.937 5 2HA GLY 38 2HA GLY 38 8.678 -10.385 -24.240 6 H ALA 39 H ALA 39 5.495 -11.925 -24.231 7 HA ALA 39 HA ALA 39 4.212 -9.301 -24.082 8 1HB ALA 39 1HB ALA 39 2.626 -11.812 -24.036 9 2HB ALA 39 2HB ALA 39 3.471 -11.392 -25.526 10 3HB ALA 39 3HB ALA 39 2.293 -10.276 -24.836 11 H MET 40 H MET 40 2.739 -8.769 -22.409 12 HA MET 40 HA MET 40 3.489 -9.910 -19.840 13 1HB MET 40 2HB MET 40 2.272 -7.999 -18.880 14 2HB MET 40 1HB MET 40 3.481 -7.483 -20.046 15 1HG MET 40 2HG MET 40 1.760 -7.164 -21.725 16 2HG MET 40 1HG MET 40 0.534 -7.743 -20.599 17 1HE MET 40 1HE MET 40 1.732 -4.483 -22.138 18 2HE MET 40 2HE MET 40 3.186 -5.159 -21.403 19 3HE MET 40 3HE MET 40 2.507 -3.651 -20.790 20 H ASP 41 H ASP 41 1.990 -10.693 -18.316 21 HA ASP 41 HA ASP 41 0.207 -11.918 -17.617 22 1HB ASP 41 2HB ASP 41 -1.285 -10.284 -19.683 23 2HB ASP 41 1HB ASP 41 -2.028 -11.241 -18.404 24 HA PRO 42 HA PRO 42 0.781 -14.893 -21.101 25 1HB PRO 42 2HB PRO 42 1.063 -17.054 -19.451 26 2HB PRO 42 1HB PRO 42 2.406 -16.015 -19.940 27 1HG PRO 42 2HG PRO 42 0.815 -15.990 -17.405 28 2HG PRO 42 1HG PRO 42 2.566 -15.818 -17.630 29 1HD PRO 42 2HD PRO 42 0.970 -13.692 -17.190 30 2HD PRO 42 1HD PRO 42 2.395 -13.592 -18.245 31 H GLU 43 H GLU 43 -1.031 -15.535 -18.098 32 HA GLU 43 HA GLU 43 -3.188 -16.177 -17.745 33 1HB GLU 43 2HB GLU 43 -3.286 -14.993 -20.342 34 2HB GLU 43 1HB GLU 43 -4.281 -16.443 -20.361 35 1HG GLU 43 2HG GLU 43 -5.856 -15.524 -19.078 36 2HG GLU 43 1HG GLU 43 -4.679 -14.776 -17.999 37 H PHE 44 H PHE 44 -2.143 -17.629 -20.835 38 HA PHE 44 HA PHE 44 -3.188 -20.204 -20.012 39 1HB PHE 44 2HB PHE 44 -2.277 -18.975 -22.531 40 2HB PHE 44 1HB PHE 44 -1.917 -20.690 -22.371 41 HD1 PHE 44 1HD PHE 44 -4.738 -18.295 -21.933 42 HD2 PHE 44 2HD PHE 44 -3.505 -22.221 -23.017 43 HE1 PHE 44 1HE PHE 44 -7.048 -18.836 -22.585 44 HE2 PHE 44 2HE PHE 44 -5.813 -22.769 -23.671 45 HZ PHE 44 HZ PHE 44 -7.588 -21.075 -23.457 46 H ALA 45 H ALA 45 -0.919 -19.095 -18.520 47 HA ALA 45 HA ALA 45 0.709 -21.442 -18.479 48 1HB ALA 45 1HB ALA 45 2.838 -19.921 -18.787 49 2HB ALA 45 2HB ALA 45 1.730 -18.964 -19.771 50 3HB ALA 45 3HB ALA 45 2.030 -20.655 -20.172 51 H LEU 46 H LEU 46 1.929 -21.618 -16.598 52 HA LEU 46 HA LEU 46 1.093 -19.892 -14.449 53 1HB LEU 46 2HB LEU 46 2.907 -22.299 -14.541 54 2HB LEU 46 1HB LEU 46 2.536 -21.426 -13.066 55 HG LEU 46 HG LEU 46 0.272 -22.464 -14.708 56 1HD1 LEU 46 1HD1 LEU 46 2.255 -24.195 -14.150 57 2HD1 LEU 46 2HD1 LEU 46 0.548 -24.639 -14.195 58 3HD1 LEU 46 3HD1 LEU 46 1.329 -24.290 -12.652 59 1HD2 LEU 46 1HD2 LEU 46 -0.931 -22.175 -12.821 60 2HD2 LEU 46 2HD2 LEU 46 0.373 -21.060 -12.414 61 3HD2 LEU 46 3HD2 LEU 46 0.385 -22.701 -11.771 62 H SER 47 H SER 47 2.023 -17.947 -14.329 63 HA SER 47 HA SER 47 4.775 -17.528 -15.081 64 1HB SER 47 2HB SER 47 2.680 -15.912 -15.272 65 2HB SER 47 1HB SER 47 3.201 -15.430 -13.658 66 HG SER 47 HG SER 47 5.131 -14.766 -14.475 67 H ASN 48 H ASN 48 3.566 -18.931 -12.433 68 HA ASN 48 HA ASN 48 4.418 -19.394 -10.379 69 1HB ASN 48 2HB ASN 48 6.682 -18.329 -11.840 70 2HB ASN 48 1HB ASN 48 6.777 -17.895 -10.137 71 1HD2 ASN 48 1HD2 ASN 48 7.947 -20.002 -12.172 72 2HD2 ASN 48 2HD2 ASN 48 8.026 -21.426 -11.198 73 H GLU 49 H GLU 49 3.411 -18.565 -8.686 74 HA GLU 49 HA GLU 49 4.024 -15.945 -7.703 75 1HB GLU 49 2HB GLU 49 1.767 -16.265 -9.449 76 2HB GLU 49 1HB GLU 49 1.199 -15.849 -7.837 77 1HG GLU 49 2HG GLU 49 3.444 -14.210 -8.601 78 2HG GLU 49 1HG GLU 49 2.146 -14.117 -9.792 79 H LYS 50 H LYS 50 3.725 -15.838 -5.543 80 HA LYS 50 HA LYS 50 2.664 -18.215 -4.235 81 1HB LYS 50 2HB LYS 50 4.626 -16.155 -3.586 82 2HB LYS 50 1HB LYS 50 3.548 -16.509 -2.242 83 1HG LYS 50 2HG LYS 50 4.396 -18.572 -1.924 84 2HG LYS 50 1HG LYS 50 4.667 -18.845 -3.647 85 1HD LYS 50 2HD LYS 50 6.338 -16.788 -2.315 86 2HD LYS 50 1HD LYS 50 6.666 -18.476 -1.919 87 1HE LYS 50 2HE LYS 50 6.639 -17.245 -4.671 88 2HE LYS 50 1HE LYS 50 8.061 -17.767 -3.770 89 1HZ LYS 50 1HZ LYS 50 7.762 -19.624 -4.978 90 2HZ LYS 50 2HZ LYS 50 6.116 -19.344 -5.241 91 3HZ LYS 50 3HZ LYS 50 6.636 -20.008 -3.776 92 H LYS 51 H LYS 51 1.002 -15.962 -5.487 93 HA LYS 51 HA LYS 51 -0.993 -14.958 -5.078 94 1HB LYS 51 2HB LYS 51 -0.896 -17.225 -3.307 95 2HB LYS 51 1HB LYS 51 -1.755 -15.903 -2.529 96 1HG LYS 51 2HG LYS 51 -3.012 -15.760 -4.813 97 2HG LYS 51 1HG LYS 51 -2.447 -17.422 -4.995 98 1HD LYS 51 2HD LYS 51 -3.405 -17.455 -2.448 99 2HD LYS 51 1HD LYS 51 -4.501 -16.306 -3.218 100 1HE LYS 51 2HE LYS 51 -5.492 -17.895 -4.458 101 2HE LYS 51 1HE LYS 51 -3.968 -18.714 -4.800 102 1HZ LYS 51 1HZ LYS 51 -4.528 -20.246 -3.324 103 2HZ LYS 51 2HZ LYS 51 -5.959 -19.427 -2.952 104 3HZ LYS 51 3HZ LYS 51 -4.542 -19.084 -2.094 105 H ALA 52 H ALA 52 -1.826 -13.140 -4.061 106 HA ALA 52 HA ALA 52 -1.786 -11.211 -2.858 107 1HB ALA 52 1HB ALA 52 -1.643 -11.416 -0.606 108 2HB ALA 52 2HB ALA 52 -0.148 -12.350 -0.673 109 3HB ALA 52 3HB ALA 52 -1.693 -13.132 -1.006 110 H LYS 53 H LYS 53 -0.379 -9.471 -2.089 111 HA LYS 53 HA LYS 53 2.460 -9.786 -2.710 112 1HB LYS 53 2HB LYS 53 0.819 -7.544 -3.898 113 2HB LYS 53 1HB LYS 53 2.518 -7.889 -4.187 114 1HG LYS 53 2HG LYS 53 1.767 -8.891 -6.038 115 2HG LYS 53 1HG LYS 53 1.381 -10.227 -4.953 116 1HD LYS 53 2HD LYS 53 -0.875 -9.695 -4.893 117 2HD LYS 53 1HD LYS 53 -0.596 -8.021 -5.377 118 1HE LYS 53 2HE LYS 53 -1.285 -8.728 -7.395 119 2HE LYS 53 1HE LYS 53 0.356 -9.357 -7.539 120 1HZ LYS 53 1HZ LYS 53 -2.009 -10.791 -7.634 121 2HZ LYS 53 2HZ LYS 53 -1.278 -11.214 -6.169 122 3HZ LYS 53 3HZ LYS 53 -0.435 -11.409 -7.622 123 H LYS 54 H LYS 54 3.780 -8.515 -1.481 124 HA LYS 54 HA LYS 54 2.505 -6.990 0.634 125 1HB LYS 54 2HB LYS 54 4.842 -8.629 0.450 126 2HB LYS 54 1HB LYS 54 5.335 -7.008 0.924 127 1HG LYS 54 2HG LYS 54 4.960 -8.041 2.951 128 2HG LYS 54 1HG LYS 54 3.442 -7.186 2.667 129 1HD LYS 54 2HD LYS 54 3.230 -9.736 1.448 130 2HD LYS 54 1HD LYS 54 3.878 -9.974 3.072 131 1HE LYS 54 2HE LYS 54 1.378 -8.442 2.365 132 2HE LYS 54 1HE LYS 54 1.436 -10.060 3.065 133 1HZ LYS 54 1HZ LYS 54 1.772 -9.236 5.093 134 2HZ LYS 54 2HZ LYS 54 1.281 -7.746 4.464 135 3HZ LYS 54 3HZ LYS 54 2.927 -8.117 4.568 136 H VAL 55 H VAL 55 2.362 -4.897 0.532 137 HA VAL 55 HA VAL 55 4.315 -3.395 -1.086 138 HB VAL 55 HB VAL 55 2.545 -1.764 -1.631 139 1HG1 VAL 55 1HG1 VAL 55 1.827 -2.855 -3.482 140 2HG1 VAL 55 2HG1 VAL 55 1.477 -4.351 -2.612 141 3HG1 VAL 55 3HG1 VAL 55 3.145 -3.924 -2.998 142 1HG2 VAL 55 1HG2 VAL 55 0.838 -3.728 -0.153 143 2HG2 VAL 55 2HG2 VAL 55 0.158 -2.646 -1.366 144 3HG2 VAL 55 3HG2 VAL 55 0.964 -1.981 0.060 145 H ARG 56 H ARG 56 4.837 -1.340 -0.417 146 HA ARG 56 HA ARG 56 4.160 -0.720 2.375 147 1HB ARG 56 2HB ARG 56 6.669 -0.794 1.019 148 2HB ARG 56 1HB ARG 56 6.327 0.888 1.405 149 1HG ARG 56 2HG ARG 56 5.684 -0.402 3.737 150 2HG ARG 56 1HG ARG 56 7.069 -1.321 3.151 151 1HD ARG 56 2HD ARG 56 8.312 0.808 2.897 152 2HD ARG 56 1HD ARG 56 6.942 1.656 3.612 153 HE ARG 56 HE ARG 56 8.961 0.209 4.992 154 1HH1 ARG 56 1HH1 ARG 56 5.566 1.012 5.096 155 2HH1 ARG 56 2HH1 ARG 56 5.449 0.835 6.816 156 1HH2 ARG 56 1HH2 ARG 56 8.810 -0.021 7.251 157 2HH2 ARG 56 2HH2 ARG 56 7.291 0.251 8.039 158 H PHE 57 H PHE 57 2.480 0.644 2.348 159 HA PHE 57 HA PHE 57 2.137 2.456 0.127 160 1HB PHE 57 2HB PHE 57 0.454 1.831 2.544 161 2HB PHE 57 1HB PHE 57 0.023 3.082 1.386 162 HD1 PHE 57 1HD PHE 57 1.311 1.148 -0.925 163 HD2 PHE 57 2HD PHE 57 -1.742 0.823 2.032 164 HE1 PHE 57 1HE PHE 57 0.154 -0.509 -2.305 165 HE2 PHE 57 2HE PHE 57 -2.892 -0.852 0.651 166 HZ PHE 57 HZ PHE 57 -1.950 -1.517 -1.521 167 H TYR 58 H TYR 58 2.593 4.467 0.037 168 HA TYR 58 HA TYR 58 3.356 5.953 2.460 169 1HB TYR 58 2HB TYR 58 4.398 6.410 -0.324 170 2HB TYR 58 1HB TYR 58 4.918 7.220 1.133 171 HD1 TYR 58 1HD TYR 58 6.654 6.338 2.456 172 HD2 TYR 58 2HD TYR 58 4.888 3.920 -0.564 173 HE1 TYR 58 1HE TYR 58 8.424 4.661 2.770 174 HE2 TYR 58 2HE TYR 58 6.650 2.235 -0.257 175 HH TYR 58 HH TYR 58 9.488 2.802 1.245 176 H ARG 59 H ARG 59 2.704 8.095 2.579 177 HA ARG 59 HA ARG 59 0.414 8.735 0.869 178 1HB ARG 59 2HB ARG 59 1.261 10.343 3.263 179 2HB ARG 59 1HB ARG 59 -0.338 10.188 2.555 180 1HG ARG 59 2HG ARG 59 -0.777 8.223 3.630 181 2HG ARG 59 1HG ARG 59 0.923 7.759 3.710 182 1HD ARG 59 2HD ARG 59 -0.198 8.417 5.898 183 2HD ARG 59 1HD ARG 59 1.343 9.185 5.524 184 HE ARG 59 HE ARG 59 -0.898 10.726 4.638 185 1HH1 ARG 59 1HH1 ARG 59 1.090 9.966 7.404 186 2HH1 ARG 59 2HH1 ARG 59 0.760 11.463 8.209 187 1HH2 ARG 59 1HH2 ARG 59 -1.333 12.696 5.696 188 2HH2 ARG 59 2HH2 ARG 59 -0.616 13.012 7.240 189 H ASN 60 H ASN 60 0.756 9.987 -0.829 190 HA ASN 60 HA ASN 60 3.071 11.210 -1.579 191 1HB ASN 60 2HB ASN 60 1.175 10.924 -3.086 192 2HB ASN 60 1HB ASN 60 0.267 12.140 -2.205 193 1HD2 ASN 60 1HD2 ASN 60 0.255 12.835 -4.590 194 2HD2 ASN 60 2HD2 ASN 60 1.474 13.977 -5.033 195 H GLY 61 H GLY 61 4.108 13.097 -1.269 196 1HA GLY 61 2HA GLY 61 4.741 15.033 -0.209 197 2HA GLY 61 1HA GLY 61 3.043 15.476 -0.280 198 H ASP 62 H ASP 62 5.353 13.541 1.601 199 HA ASP 62 HA ASP 62 4.031 14.469 4.039 200 1HB ASP 62 2HB ASP 62 2.999 12.307 3.590 201 2HB ASP 62 1HB ASP 62 4.582 11.559 3.418 202 H ARG 63 H ARG 63 6.733 12.605 2.680 203 HA ARG 63 HA ARG 63 8.839 12.195 3.517 204 1HB ARG 63 2HB ARG 63 10.185 14.239 3.567 205 2HB ARG 63 1HB ARG 63 9.086 14.222 2.197 206 1HG ARG 63 2HG ARG 63 7.533 15.608 3.736 207 2HG ARG 63 1HG ARG 63 9.006 15.905 4.661 208 1HD ARG 63 2HD ARG 63 10.088 16.817 2.696 209 2HD ARG 63 1HD ARG 63 8.673 16.437 1.714 210 HE ARG 63 HE ARG 63 8.105 18.157 3.947 211 1HH1 ARG 63 1HH1 ARG 63 9.166 18.038 0.624 212 2HH1 ARG 63 2HH1 ARG 63 8.673 19.662 0.278 213 1HH2 ARG 63 1HH2 ARG 63 7.457 20.292 3.494 214 2HH2 ARG 63 2HH2 ARG 63 7.704 20.942 1.907 215 H TYR 64 H TYR 64 6.910 11.988 5.593 216 HA TYR 64 HA TYR 64 8.651 12.379 7.871 217 1HB TYR 64 2HB TYR 64 6.307 14.054 7.355 218 2HB TYR 64 1HB TYR 64 6.258 13.265 8.925 219 HD1 TYR 64 1HD TYR 64 8.315 15.475 6.773 220 HD2 TYR 64 2HD TYR 64 7.573 14.059 10.717 221 HE1 TYR 64 1HE TYR 64 9.829 17.193 7.668 222 HE2 TYR 64 2HE TYR 64 9.085 15.774 11.623 223 HH TYR 64 HH TYR 64 10.915 17.175 10.918 224 H PHE 65 H PHE 65 7.431 10.182 6.303 225 HA PHE 65 HA PHE 65 6.619 8.543 8.508 226 1HB PHE 65 2HB PHE 65 4.486 9.651 8.015 227 2HB PHE 65 1HB PHE 65 4.607 9.158 6.331 228 HD1 PHE 65 1HD PHE 65 2.994 7.606 5.863 229 HD2 PHE 65 2HD PHE 65 5.100 7.335 9.550 230 HE1 PHE 65 1HE PHE 65 1.802 5.520 6.384 231 HE2 PHE 65 2HE PHE 65 3.911 5.247 10.080 232 HZ PHE 65 HZ PHE 65 2.258 4.336 8.497 233 H LYS 66 H LYS 66 7.207 6.482 8.134 234 HA LYS 66 HA LYS 66 8.532 5.847 5.678 235 1HB LYS 66 2HB LYS 66 7.913 4.147 8.097 236 2HB LYS 66 1HB LYS 66 8.926 3.639 6.753 237 1HG LYS 66 2HG LYS 66 10.257 5.816 7.315 238 2HG LYS 66 1HG LYS 66 9.469 5.646 8.885 239 1HD LYS 66 2HD LYS 66 11.643 4.559 8.906 240 2HD LYS 66 1HD LYS 66 10.358 3.362 9.068 241 1HE LYS 66 2HE LYS 66 11.023 3.823 6.293 242 2HE LYS 66 1HE LYS 66 12.445 3.351 7.222 243 1HZ LYS 66 1HZ LYS 66 11.448 1.377 6.445 244 2HZ LYS 66 2HZ LYS 66 9.900 1.860 6.928 245 3HZ LYS 66 3HZ LYS 66 11.065 1.467 8.090 246 H GLY 67 H GLY 67 5.307 5.789 6.503 247 1HA GLY 67 2HA GLY 67 3.583 5.099 5.060 248 2HA GLY 67 1HA GLY 67 4.723 4.042 4.244 249 H ILE 68 H ILE 68 2.424 2.896 4.644 250 HA ILE 68 HA ILE 68 2.827 1.180 7.006 251 HB ILE 68 HB ILE 68 0.858 2.499 7.412 252 1HG1 ILE 68 2HG1 ILE 68 -0.263 -0.128 6.480 253 2HG1 ILE 68 1HG1 ILE 68 0.894 -0.068 7.807 254 1HG2 ILE 68 1HG2 ILE 68 0.542 2.595 4.706 255 2HG2 ILE 68 2HG2 ILE 68 -0.653 3.133 5.888 256 3HG2 ILE 68 3HG2 ILE 68 -0.765 1.516 5.188 257 1HD1 ILE 68 1HD1 ILE 68 -1.393 1.778 8.001 258 2HD1 ILE 68 2HD1 ILE 68 -0.601 0.806 9.243 259 3HD1 ILE 68 3HD1 ILE 68 -1.757 0.057 8.140 260 H VAL 69 H VAL 69 2.730 -1.006 6.694 261 HA VAL 69 HA VAL 69 2.839 -1.915 3.944 262 HB VAL 69 HB VAL 69 3.159 -3.568 6.451 263 1HG1 VAL 69 1HG1 VAL 69 2.883 -5.111 4.766 264 2HG1 VAL 69 2HG1 VAL 69 4.630 -4.871 4.712 265 3HG1 VAL 69 3HG1 VAL 69 3.591 -4.061 3.539 266 1HG2 VAL 69 1HG2 VAL 69 4.767 -1.482 5.783 267 2HG2 VAL 69 2HG2 VAL 69 5.558 -2.811 4.936 268 3HG2 VAL 69 3HG2 VAL 69 5.296 -2.906 6.677 269 H TYR 70 H TYR 70 1.353 -3.081 2.897 270 HA TYR 70 HA TYR 70 -0.900 -4.194 4.379 271 1HB TYR 70 2HB TYR 70 -0.987 -1.984 2.487 272 2HB TYR 70 1HB TYR 70 -2.026 -3.315 1.992 273 HD1 TYR 70 1HD TYR 70 -4.214 -3.022 2.590 274 HD2 TYR 70 2HD TYR 70 -1.182 -1.661 5.246 275 HE1 TYR 70 1HE TYR 70 -5.941 -2.290 4.179 276 HE2 TYR 70 2HE TYR 70 -2.898 -0.929 6.841 277 HH TYR 70 HH TYR 70 -5.378 -1.623 7.330 278 H ALA 71 H ALA 71 -1.765 -6.008 3.547 279 HA ALA 71 HA ALA 71 -0.271 -7.284 1.368 280 1HB ALA 71 1HB ALA 71 -0.391 -8.435 3.590 281 2HB ALA 71 2HB ALA 71 -0.977 -9.388 2.227 282 3HB ALA 71 3HB ALA 71 -2.125 -8.625 3.326 283 H VAL 72 H VAL 72 -1.204 -7.183 -0.540 284 HA VAL 72 HA VAL 72 -4.089 -6.863 -0.727 285 HB VAL 72 HB VAL 72 -2.299 -6.700 -3.115 286 1HG1 VAL 72 1HG1 VAL 72 -3.997 -4.864 -3.618 287 2HG1 VAL 72 2HG1 VAL 72 -4.900 -5.482 -2.235 288 3HG1 VAL 72 3HG1 VAL 72 -4.586 -6.526 -3.622 289 1HG2 VAL 72 1HG2 VAL 72 -1.042 -5.231 -1.888 290 2HG2 VAL 72 2HG2 VAL 72 -2.384 -4.801 -0.827 291 3HG2 VAL 72 3HG2 VAL 72 -2.304 -4.140 -2.460 292 H SER 73 H SER 73 -5.299 -8.475 -1.172 293 HA SER 73 HA SER 73 -4.558 -10.499 -3.096 294 1HB SER 73 2HB SER 73 -3.757 -11.143 -0.658 295 2HB SER 73 1HB SER 73 -5.453 -11.582 -0.454 296 HG SER 73 HG SER 73 -3.688 -13.115 -1.434 297 H SER 74 H SER 74 -6.348 -11.831 -3.740 298 HA SER 74 HA SER 74 -8.769 -10.430 -3.948 299 1HB SER 74 2HB SER 74 -7.934 -13.241 -4.590 300 2HB SER 74 1HB SER 74 -9.622 -12.756 -4.750 301 HG SER 74 HG SER 74 -8.774 -12.303 -6.694 302 H ASP 75 H ASP 75 -7.587 -12.397 -1.416 303 HA ASP 75 HA ASP 75 -10.160 -13.228 -0.445 304 1HB ASP 75 2HB ASP 75 -7.361 -13.756 0.138 305 2HB ASP 75 1HB ASP 75 -8.311 -13.551 1.598 306 H ARG 76 H ARG 76 -7.919 -10.608 0.104 307 HA ARG 76 HA ARG 76 -9.432 -9.683 2.423 308 1HB ARG 76 2HB ARG 76 -6.852 -8.751 1.167 309 2HB ARG 76 1HB ARG 76 -7.635 -7.901 2.492 310 1HG ARG 76 2HG ARG 76 -7.528 -10.120 3.749 311 2HG ARG 76 1HG ARG 76 -6.397 -10.631 2.494 312 1HD ARG 76 2HD ARG 76 -4.732 -9.434 3.374 313 2HD ARG 76 1HD ARG 76 -5.752 -8.006 3.558 314 HE ARG 76 HE ARG 76 -5.118 -9.959 5.571 315 1HH1 ARG 76 1HH1 ARG 76 -7.409 -7.527 4.562 316 2HH1 ARG 76 2HH1 ARG 76 -8.009 -7.249 6.163 317 1HH2 ARG 76 1HH2 ARG 76 -5.906 -9.595 7.678 318 2HH2 ARG 76 2HH2 ARG 76 -7.154 -8.422 7.932 319 H PHE 77 H PHE 77 -8.459 -8.537 -0.797 320 HA PHE 77 HA PHE 77 -10.760 -6.708 -0.740 321 1HB PHE 77 2HB PHE 77 -8.151 -5.988 -2.064 322 2HB PHE 77 1HB PHE 77 -9.513 -4.935 -1.696 323 HD1 PHE 77 1HD PHE 77 -6.348 -6.086 -0.620 324 HD2 PHE 77 2HD PHE 77 -10.079 -4.616 0.807 325 HE1 PHE 77 1HE PHE 77 -5.285 -5.467 1.511 326 HE2 PHE 77 2HE PHE 77 -9.022 -3.993 2.939 327 HZ PHE 77 HZ PHE 77 -6.622 -4.417 3.293 328 H ARG 78 H ARG 78 -12.132 -7.169 -2.311 329 HA ARG 78 HA ARG 78 -11.550 -8.989 -4.383 330 1HB ARG 78 2HB ARG 78 -13.838 -7.532 -3.352 331 2HB ARG 78 1HB ARG 78 -13.865 -7.637 -5.100 332 1HG ARG 78 2HG ARG 78 -13.570 -9.984 -3.242 333 2HG ARG 78 1HG ARG 78 -15.081 -9.473 -3.998 334 1HD ARG 78 2HD ARG 78 -14.243 -9.952 -6.175 335 2HD ARG 78 1HD ARG 78 -12.609 -10.193 -5.560 336 HE ARG 78 HE ARG 78 -13.181 -12.329 -4.953 337 1HH1 ARG 78 1HH1 ARG 78 -16.085 -10.532 -5.679 338 2HH1 ARG 78 2HH1 ARG 78 -17.112 -11.925 -5.618 339 1HH2 ARG 78 1HH2 ARG 78 -14.530 -14.162 -4.876 340 2HH2 ARG 78 2HH2 ARG 78 -16.229 -13.986 -5.162 341 H SER 79 H SER 79 -11.209 -5.556 -4.136 342 HA SER 79 HA SER 79 -10.007 -5.434 -6.732 343 1HB SER 79 2HB SER 79 -11.705 -3.450 -7.302 344 2HB SER 79 1HB SER 79 -12.017 -5.119 -7.779 345 HG SER 79 HG SER 79 -12.919 -4.055 -5.319 346 H PHE 80 H PHE 80 -9.589 -3.003 -7.307 347 HA PHE 80 HA PHE 80 -7.956 -1.942 -5.295 348 1HB PHE 80 2HB PHE 80 -8.281 -1.501 -7.988 349 2HB PHE 80 1HB PHE 80 -8.868 0.007 -7.292 350 HD1 PHE 80 1HD PHE 80 -7.282 1.666 -7.287 351 HD2 PHE 80 2HD PHE 80 -6.062 -2.344 -6.567 352 HE1 PHE 80 1HE PHE 80 -4.962 2.428 -7.008 353 HE2 PHE 80 2HE PHE 80 -3.742 -1.591 -6.277 354 HZ PHE 80 HZ PHE 80 -3.186 0.795 -6.500 355 H ASP 81 H ASP 81 -11.290 -1.273 -6.159 356 HA ASP 81 HA ASP 81 -11.613 1.134 -4.750 357 1HB ASP 81 2HB ASP 81 -13.218 -0.053 -6.413 358 2HB ASP 81 1HB ASP 81 -13.813 -0.903 -4.990 359 H ALA 82 H ALA 82 -12.030 -2.235 -3.771 360 HA ALA 82 HA ALA 82 -12.907 -1.660 -1.130 361 1HB ALA 82 1HB ALA 82 -11.759 -4.161 -1.032 362 2HB ALA 82 2HB ALA 82 -12.269 -4.000 -2.713 363 3HB ALA 82 3HB ALA 82 -13.442 -3.798 -1.412 364 H LEU 83 H LEU 83 -9.771 -2.229 -2.618 365 HA LEU 83 HA LEU 83 -8.262 -2.445 -0.235 366 1HB LEU 83 2HB LEU 83 -7.450 -3.077 -2.503 367 2HB LEU 83 1HB LEU 83 -7.400 -1.381 -2.928 368 HG LEU 83 HG LEU 83 -5.719 -1.024 -1.124 369 1HD1 LEU 83 1HD1 LEU 83 -4.701 -2.810 0.006 370 2HD1 LEU 83 2HD1 LEU 83 -5.463 -4.012 -1.034 371 3HD1 LEU 83 3HD1 LEU 83 -6.434 -3.113 0.131 372 1HD2 LEU 83 1HD2 LEU 83 -4.555 -1.113 -3.046 373 2HD2 LEU 83 2HD2 LEU 83 -5.333 -2.606 -3.572 374 3HD2 LEU 83 3HD2 LEU 83 -4.002 -2.665 -2.415 375 H LEU 84 H LEU 84 -9.052 0.217 -2.389 376 HA LEU 84 HA LEU 84 -7.698 2.257 -1.034 377 1HB LEU 84 2HB LEU 84 -10.051 2.184 -2.886 378 2HB LEU 84 1HB LEU 84 -9.613 3.692 -2.103 379 HG LEU 84 HG LEU 84 -7.714 2.077 -3.801 380 1HD1 LEU 84 1HD1 LEU 84 -9.559 4.340 -4.501 381 2HD1 LEU 84 2HD1 LEU 84 -9.383 2.776 -5.297 382 3HD1 LEU 84 3HD1 LEU 84 -8.105 3.985 -5.433 383 1HD2 LEU 84 1HD2 LEU 84 -6.643 3.524 -2.156 384 2HD2 LEU 84 2HD2 LEU 84 -7.594 4.894 -2.735 385 3HD2 LEU 84 3HD2 LEU 84 -6.401 4.140 -3.793 386 H ALA 85 H ALA 85 -10.828 0.736 -0.484 387 HA ALA 85 HA ALA 85 -11.878 2.660 1.307 388 1HB ALA 85 1HB ALA 85 -13.428 0.949 1.972 389 2HB ALA 85 2HB ALA 85 -12.378 -0.311 1.325 390 3HB ALA 85 3HB ALA 85 -13.171 0.823 0.231 391 H ASP 86 H ASP 86 -9.975 -0.275 1.817 392 HA ASP 86 HA ASP 86 -9.855 -0.011 4.654 393 1HB ASP 86 2HB ASP 86 -9.336 -2.047 2.925 394 2HB ASP 86 1HB ASP 86 -7.699 -1.516 3.302 395 H LEU 87 H LEU 87 -7.906 1.014 1.952 396 HA LEU 87 HA LEU 87 -5.576 1.757 3.339 397 1HB LEU 87 2HB LEU 87 -6.798 2.842 0.798 398 2HB LEU 87 1HB LEU 87 -5.213 3.306 1.373 399 HG LEU 87 HG LEU 87 -6.021 0.973 -0.149 400 1HD1 LEU 87 1HD1 LEU 87 -4.272 2.658 -0.710 401 2HD1 LEU 87 2HD1 LEU 87 -3.735 0.982 -0.811 402 3HD1 LEU 87 3HD1 LEU 87 -3.278 1.972 0.574 403 1HD2 LEU 87 1HD2 LEU 87 -5.861 -0.070 2.130 404 2HD2 LEU 87 2HD2 LEU 87 -4.167 0.417 2.161 405 3HD2 LEU 87 3HD2 LEU 87 -4.740 -0.713 0.935 406 H THR 88 H THR 88 -8.570 3.480 2.697 407 HA THR 88 HA THR 88 -7.791 6.017 3.598 408 HB THR 88 HB THR 88 -10.542 5.309 4.294 409 HG1 THR 88 1HG THR 88 -11.180 4.431 2.480 410 1HG2 THR 88 1HG2 THR 88 -9.132 7.403 2.851 411 2HG2 THR 88 2HG2 THR 88 -10.602 7.479 3.820 412 3HG2 THR 88 3HG2 THR 88 -10.681 6.962 2.136 413 H ARG 89 H ARG 89 -9.087 3.206 5.270 414 HA ARG 89 HA ARG 89 -9.301 4.410 7.820 415 1HB ARG 89 2HB ARG 89 -9.386 1.622 6.769 416 2HB ARG 89 1HB ARG 89 -9.194 1.862 8.500 417 1HG ARG 89 2HG ARG 89 -11.423 1.905 8.546 418 2HG ARG 89 1HG ARG 89 -11.256 3.552 7.932 419 1HD ARG 89 2HD ARG 89 -11.091 1.727 5.745 420 2HD ARG 89 1HD ARG 89 -12.518 1.336 6.705 421 HE ARG 89 HE ARG 89 -12.099 3.678 5.093 422 1HH1 ARG 89 1HH1 ARG 89 -13.845 2.346 7.806 423 2HH1 ARG 89 2HH1 ARG 89 -15.153 3.472 7.676 424 1HH2 ARG 89 1HH2 ARG 89 -13.820 5.161 4.922 425 2HH2 ARG 89 2HH2 ARG 89 -15.140 5.070 6.040 426 H SER 90 H SER 90 -6.751 2.358 6.354 427 HA SER 90 HA SER 90 -5.199 2.376 8.763 428 1HB SER 90 2HB SER 90 -5.125 1.018 6.251 429 2HB SER 90 1HB SER 90 -3.535 1.715 6.567 430 HG SER 90 HG SER 90 -3.601 0.691 8.625 431 H LEU 91 H LEU 91 -5.073 4.222 5.740 432 HA LEU 91 HA LEU 91 -2.744 5.651 6.715 433 1HB LEU 91 2HB LEU 91 -3.954 5.064 4.124 434 2HB LEU 91 1HB LEU 91 -3.405 6.713 4.275 435 HG LEU 91 HG LEU 91 -1.790 4.187 4.407 436 1HD1 LEU 91 1HD1 LEU 91 -1.412 4.756 2.303 437 2HD1 LEU 91 2HD1 LEU 91 -0.505 6.140 2.910 438 3HD1 LEU 91 3HD1 LEU 91 -2.213 6.312 2.506 439 1HD2 LEU 91 1HD2 LEU 91 -1.262 6.749 5.759 440 2HD2 LEU 91 2HD2 LEU 91 0.074 6.094 4.812 441 3HD2 LEU 91 3HD2 LEU 91 -0.648 5.130 6.101 442 H SER 92 H SER 92 -5.997 5.915 7.087 443 HA SER 92 HA SER 92 -6.999 8.298 6.480 444 1HB SER 92 2HB SER 92 -7.798 8.340 9.028 445 2HB SER 92 1HB SER 92 -8.429 7.171 7.870 446 HG SER 92 HG SER 92 -6.294 6.753 9.695 447 H ASP 93 H ASP 93 -6.534 10.361 6.640 448 HA ASP 93 HA ASP 93 -5.096 11.446 8.898 449 1HB ASP 93 2HB ASP 93 -3.778 10.887 6.355 450 2HB ASP 93 1HB ASP 93 -3.660 12.584 6.803 451 H ASN 94 H ASN 94 -4.464 13.940 7.773 452 HA ASN 94 HA ASN 94 -6.688 14.993 6.319 453 1HB ASN 94 2HB ASN 94 -7.577 16.443 8.081 454 2HB ASN 94 1HB ASN 94 -7.750 14.746 8.518 455 1HD2 ASN 94 1HD2 ASN 94 -6.513 13.901 10.181 456 2HD2 ASN 94 2HD2 ASN 94 -5.669 14.904 11.307 457 H ILE 95 H ILE 95 -3.770 14.965 6.265 458 HA ILE 95 HA ILE 95 -3.324 17.864 6.180 459 HB ILE 95 HB ILE 95 -1.578 15.734 7.371 460 1HG1 ILE 95 2HG1 ILE 95 -1.341 18.249 8.650 461 2HG1 ILE 95 1HG1 ILE 95 -3.051 18.016 8.299 462 1HG2 ILE 95 1HG2 ILE 95 -0.100 16.665 5.778 463 2HG2 ILE 95 2HG2 ILE 95 0.297 17.405 7.330 464 3HG2 ILE 95 3HG2 ILE 95 -0.636 18.306 6.135 465 1HD1 ILE 95 1HD1 ILE 95 -1.405 16.794 10.314 466 2HD1 ILE 95 2HD1 ILE 95 -2.194 15.576 9.314 467 3HD1 ILE 95 3HD1 ILE 95 -3.160 16.798 10.141 468 H ASN 96 H ASN 96 -1.904 14.747 5.190 469 HA ASN 96 HA ASN 96 -1.051 15.931 2.665 470 1HB ASN 96 2HB ASN 96 -0.508 13.184 3.812 471 2HB ASN 96 1HB ASN 96 0.233 13.871 2.374 472 1HD2 ASN 96 1HD2 ASN 96 1.132 13.000 5.184 473 2HD2 ASN 96 2HD2 ASN 96 2.167 14.292 5.681 474 H LEU 97 H LEU 97 -3.276 13.571 3.976 475 HA LEU 97 HA LEU 97 -4.283 13.044 1.257 476 1HB LEU 97 2HB LEU 97 -4.226 11.345 3.730 477 2HB LEU 97 1HB LEU 97 -5.365 11.024 2.438 478 HG LEU 97 HG LEU 97 -2.468 11.238 1.764 479 1HD1 LEU 97 1HD1 LEU 97 -2.030 9.698 3.355 480 2HD1 LEU 97 2HD1 LEU 97 -2.665 8.596 2.135 481 3HD1 LEU 97 3HD1 LEU 97 -3.702 9.151 3.449 482 1HD2 LEU 97 1HD2 LEU 97 -4.786 10.660 0.357 483 2HD2 LEU 97 2HD2 LEU 97 -4.015 9.091 0.595 484 3HD2 LEU 97 3HD2 LEU 97 -3.129 10.401 -0.187 485 HA PRO 98 HA PRO 98 -7.610 15.805 2.700 486 1HB PRO 98 2HB PRO 98 -8.684 14.564 0.189 487 2HB PRO 98 1HB PRO 98 -8.778 16.234 0.740 488 1HG PRO 98 2HG PRO 98 -7.009 15.548 -1.105 489 2HG PRO 98 1HG PRO 98 -6.562 16.682 0.184 490 1HD PRO 98 2HD PRO 98 -5.815 13.820 -0.165 491 2HD PRO 98 1HD PRO 98 -4.896 15.147 0.571 492 H GLN 99 H GLN 99 -8.841 12.962 0.955 493 HA GLN 99 HA GLN 99 -10.633 12.441 3.213 494 1HB GLN 99 2HB GLN 99 -10.743 11.843 0.288 495 2HB GLN 99 1HB GLN 99 -11.657 10.834 1.400 496 1HG GLN 99 2HG GLN 99 -13.034 12.581 2.058 497 2HG GLN 99 1HG GLN 99 -11.905 13.811 1.491 498 1HE2 GLN 99 1HE2 GLN 99 -11.540 13.848 -0.885 499 2HE2 GLN 99 2HE2 GLN 99 -12.903 13.569 -1.909 500 H GLY 100 H GLY 100 -7.741 11.602 3.026 501 1HA GLY 100 2HA GLY 100 -6.823 9.768 4.211 502 2HA GLY 100 1HA GLY 100 -8.231 8.815 3.779 503 H VAL 101 H VAL 101 -8.425 8.312 1.387 504 HA VAL 101 HA VAL 101 -6.068 8.334 -0.242 505 HB VAL 101 HB VAL 101 -6.921 5.646 0.875 506 1HG1 VAL 101 1HG1 VAL 101 -5.172 4.698 -0.462 507 2HG1 VAL 101 2HG1 VAL 101 -4.653 6.297 -0.997 508 3HG1 VAL 101 3HG1 VAL 101 -6.215 5.663 -1.504 509 1HG2 VAL 101 1HG2 VAL 101 -4.433 7.272 1.374 510 2HG2 VAL 101 2HG2 VAL 101 -4.586 5.559 1.766 511 3HG2 VAL 101 3HG2 VAL 101 -5.630 6.739 2.558 512 H ARG 102 H ARG 102 -6.965 8.676 -2.162 513 HA ARG 102 HA ARG 102 -9.469 7.279 -2.807 514 1HB ARG 102 2HB ARG 102 -8.577 10.005 -3.249 515 2HB ARG 102 1HB ARG 102 -9.112 9.241 -4.739 516 1HG ARG 102 2HG ARG 102 -10.702 9.442 -2.195 517 2HG ARG 102 1HG ARG 102 -10.934 10.414 -3.649 518 1HD ARG 102 2HD ARG 102 -11.578 7.550 -3.149 519 2HD ARG 102 1HD ARG 102 -12.525 8.791 -3.963 520 HE ARG 102 HE ARG 102 -10.124 7.605 -5.222 521 1HH1 ARG 102 1HH1 ARG 102 -13.528 8.435 -5.326 522 2HH1 ARG 102 2HH1 ARG 102 -13.705 7.982 -6.986 523 1HH2 ARG 102 1HH2 ARG 102 -10.377 7.011 -7.395 524 2HH2 ARG 102 2HH2 ARG 102 -11.923 7.176 -8.159 525 H TYR 103 H TYR 103 -6.202 7.917 -3.896 526 HA TYR 103 HA TYR 103 -6.560 5.759 -5.839 527 1HB TYR 103 2HB TYR 103 -5.011 8.175 -6.706 528 2HB TYR 103 1HB TYR 103 -5.694 6.881 -7.668 529 HD1 TYR 103 1HD TYR 103 -7.738 7.105 -8.709 530 HD2 TYR 103 2HD TYR 103 -6.660 9.838 -5.633 531 HE1 TYR 103 1HE TYR 103 -9.677 8.491 -9.276 532 HE2 TYR 103 2HE TYR 103 -8.610 11.234 -6.187 533 HH TYR 103 HH TYR 103 -10.063 11.622 -8.275 534 H ILE 104 H ILE 104 -4.556 4.912 -6.688 535 HA ILE 104 HA ILE 104 -2.301 5.254 -4.826 536 HB ILE 104 HB ILE 104 -3.196 2.693 -6.155 537 1HG1 ILE 104 2HG1 ILE 104 -3.437 3.735 -3.337 538 2HG1 ILE 104 1HG1 ILE 104 -4.713 3.137 -4.392 539 1HG2 ILE 104 1HG2 ILE 104 -0.724 2.987 -5.855 540 2HG2 ILE 104 2HG2 ILE 104 -1.417 1.597 -5.022 541 3HG2 ILE 104 3HG2 ILE 104 -1.014 3.058 -4.117 542 1HD1 ILE 104 1HD1 ILE 104 -2.610 1.557 -2.948 543 2HD1 ILE 104 2HD1 ILE 104 -3.597 0.876 -4.241 544 3HD1 ILE 104 3HD1 ILE 104 -4.363 1.472 -2.769 545 H TYR 105 H TYR 105 -0.537 5.973 -5.811 546 HA TYR 105 HA TYR 105 -0.307 5.661 -8.704 547 1HB TYR 105 2HB TYR 105 0.209 7.833 -6.857 548 2HB TYR 105 1HB TYR 105 1.581 7.527 -7.923 549 HD1 TYR 105 1HD TYR 105 1.208 7.464 -10.384 550 HD2 TYR 105 2HD TYR 105 -1.723 8.910 -7.674 551 HE1 TYR 105 1HE TYR 105 0.073 8.578 -12.230 552 HE2 TYR 105 2HE TYR 105 -2.875 10.042 -9.510 553 HH TYR 105 HH TYR 105 -2.300 10.934 -11.787 554 H THR 106 H THR 106 1.867 5.550 -9.614 555 HA THR 106 HA THR 106 3.310 3.382 -8.418 556 HB THR 106 HB THR 106 4.939 3.966 -10.376 557 HG1 THR 106 1HG THR 106 4.299 5.450 -11.732 558 1HG2 THR 106 1HG2 THR 106 2.125 3.152 -11.053 559 2HG2 THR 106 2HG2 THR 106 3.365 2.072 -10.416 560 3HG2 THR 106 3HG2 THR 106 3.581 2.830 -11.994 561 H ILE 107 H ILE 107 5.460 3.368 -7.689 562 HA ILE 107 HA ILE 107 6.209 5.297 -5.897 563 HB ILE 107 HB ILE 107 7.184 2.990 -6.125 564 1HG1 ILE 107 2HG1 ILE 107 9.481 3.728 -5.350 565 2HG1 ILE 107 1HG1 ILE 107 8.990 5.377 -5.727 566 1HG2 ILE 107 1HG2 ILE 107 7.758 3.408 -8.593 567 2HG2 ILE 107 2HG2 ILE 107 8.912 2.508 -7.608 568 3HG2 ILE 107 3HG2 ILE 107 9.202 4.209 -7.972 569 1HD1 ILE 107 1HD1 ILE 107 8.773 4.531 -3.310 570 2HD1 ILE 107 2HD1 ILE 107 7.345 3.678 -3.898 571 3HD1 ILE 107 3HD1 ILE 107 7.433 5.436 -4.013 572 H ASP 108 H ASP 108 6.623 5.359 -9.339 573 HA ASP 108 HA ASP 108 8.509 7.582 -9.201 574 1HB ASP 108 2HB ASP 108 7.515 5.798 -11.394 575 2HB ASP 108 1HB ASP 108 8.232 7.354 -11.799 576 H GLY 109 H GLY 109 5.143 6.988 -9.605 577 1HA GLY 109 2HA GLY 109 3.432 8.556 -9.569 578 2HA GLY 109 1HA GLY 109 4.632 9.829 -9.726 579 H SER 110 H SER 110 4.938 7.333 -12.034 580 HA SER 110 HA SER 110 4.417 9.089 -14.190 581 1HB SER 110 2HB SER 110 4.379 6.136 -14.616 582 2HB SER 110 1HB SER 110 5.181 7.397 -15.552 583 HG SER 110 HG SER 110 6.787 6.370 -14.476 584 H ARG 111 H ARG 111 2.624 6.286 -12.926 585 HA ARG 111 HA ARG 111 0.155 7.460 -13.886 586 1HB ARG 111 2HB ARG 111 -0.454 5.057 -14.715 587 2HB ARG 111 1HB ARG 111 0.462 6.135 -15.759 588 1HG ARG 111 2HG ARG 111 1.613 4.153 -15.969 589 2HG ARG 111 1HG ARG 111 2.536 4.980 -14.713 590 1HD ARG 111 2HD ARG 111 2.161 2.651 -14.118 591 2HD ARG 111 1HD ARG 111 1.321 3.725 -13.000 592 HE ARG 111 HE ARG 111 -0.668 2.845 -13.706 593 1HH1 ARG 111 1HH1 ARG 111 1.816 1.992 -16.003 594 2HH1 ARG 111 2HH1 ARG 111 0.793 0.925 -16.904 595 1HH2 ARG 111 1HH2 ARG 111 -2.017 1.443 -14.889 596 2HH2 ARG 111 2HH2 ARG 111 -1.384 0.612 -16.272 597 H LYS 112 H LYS 112 -1.705 6.532 -12.919 598 HA LYS 112 HA LYS 112 -1.152 5.455 -10.271 599 1HB LYS 112 2HB LYS 112 -2.803 6.788 -9.583 600 2HB LYS 112 1HB LYS 112 -2.964 7.382 -11.224 601 1HG LYS 112 2HG LYS 112 -4.555 5.443 -11.618 602 2HG LYS 112 1HG LYS 112 -4.533 5.208 -9.869 603 1HD LYS 112 2HD LYS 112 -6.447 6.585 -10.613 604 2HD LYS 112 1HD LYS 112 -5.371 7.454 -9.519 605 1HE LYS 112 2HE LYS 112 -4.569 8.832 -11.179 606 2HE LYS 112 1HE LYS 112 -4.935 7.678 -12.460 607 1HZ LYS 112 1HZ LYS 112 -7.220 8.212 -12.351 608 2HZ LYS 112 2HZ LYS 112 -6.397 9.689 -12.372 609 3HZ LYS 112 3HZ LYS 112 -7.033 9.097 -10.921 610 H ILE 113 H ILE 113 -1.937 3.534 -9.508 611 HA ILE 113 HA ILE 113 -2.518 1.537 -11.489 612 HB ILE 113 HB ILE 113 -2.449 1.276 -8.483 613 1HG1 ILE 113 2HG1 ILE 113 -0.340 2.100 -9.818 614 2HG1 ILE 113 1HG1 ILE 113 -0.177 0.872 -8.569 615 1HG2 ILE 113 1HG2 ILE 113 -1.745 -1.142 -9.403 616 2HG2 ILE 113 2HG2 ILE 113 -2.833 -0.635 -10.695 617 3HG2 ILE 113 3HG2 ILE 113 -3.409 -0.690 -9.029 618 1HD1 ILE 113 1HD1 ILE 113 -0.373 0.343 -11.520 619 2HD1 ILE 113 2HD1 ILE 113 -0.149 -0.869 -10.256 620 3HD1 ILE 113 3HD1 ILE 113 1.110 0.329 -10.566 621 H GLY 114 H GLY 114 -4.391 0.537 -11.902 622 1HA GLY 114 2HA GLY 114 -6.754 1.352 -10.328 623 2HA GLY 114 1HA GLY 114 -6.792 1.146 -12.073 624 H SER 115 H SER 115 -4.864 -1.251 -11.480 625 HA SER 115 HA SER 115 -6.992 -3.134 -10.710 626 1HB SER 115 2HB SER 115 -5.608 -4.735 -12.273 627 2HB SER 115 1HB SER 115 -6.774 -3.610 -12.969 628 HG SER 115 HG SER 115 -5.180 -2.412 -13.754 629 H MET 116 H MET 116 -6.475 -4.778 -9.359 630 HA MET 116 HA MET 116 -4.297 -4.474 -7.614 631 1HB MET 116 2HB MET 116 -6.652 -5.894 -7.606 632 2HB MET 116 1HB MET 116 -5.447 -7.169 -7.725 633 1HG MET 116 2HG MET 116 -5.734 -6.938 -5.450 634 2HG MET 116 1HG MET 116 -4.297 -5.966 -5.765 635 1HE MET 116 1HE MET 116 -8.059 -4.697 -3.748 636 2HE MET 116 2HE MET 116 -7.305 -6.281 -3.929 637 3HE MET 116 3HE MET 116 -8.316 -5.631 -5.221 638 H ASP 117 H ASP 117 -4.660 -6.213 -10.595 639 HA ASP 117 HA ASP 117 -2.607 -8.096 -10.294 640 1HB ASP 117 2HB ASP 117 -4.342 -7.096 -12.396 641 2HB ASP 117 1HB ASP 117 -2.740 -7.481 -12.997 642 H GLU 118 H GLU 118 -2.464 -4.704 -10.681 643 HA GLU 118 HA GLU 118 0.158 -4.724 -11.926 644 1HB GLU 118 2HB GLU 118 -1.549 -2.456 -10.892 645 2HB GLU 118 1HB GLU 118 -0.001 -2.250 -11.700 646 1HG GLU 118 2HG GLU 118 -2.312 -3.674 -12.981 647 2HG GLU 118 1HG GLU 118 -2.079 -1.930 -13.105 648 H LEU 119 H LEU 119 -1.112 -4.887 -8.776 649 HA LEU 119 HA LEU 119 1.098 -3.583 -7.463 650 1HB LEU 119 2HB LEU 119 -0.759 -5.432 -6.041 651 2HB LEU 119 1HB LEU 119 -0.020 -3.948 -5.475 652 HG LEU 119 HG LEU 119 -2.316 -4.157 -7.421 653 1HD1 LEU 119 1HD1 LEU 119 -2.541 -2.755 -4.831 654 2HD1 LEU 119 2HD1 LEU 119 -2.470 -4.516 -4.780 655 3HD1 LEU 119 3HD1 LEU 119 -3.728 -3.711 -5.717 656 1HD2 LEU 119 1HD2 LEU 119 -2.334 -1.833 -7.577 657 2HD2 LEU 119 2HD2 LEU 119 -0.627 -2.249 -7.719 658 3HD2 LEU 119 3HD2 LEU 119 -1.260 -1.634 -6.193 659 H GLU 120 H GLU 120 3.039 -4.519 -7.463 660 HA GLU 120 HA GLU 120 3.218 -7.438 -7.321 661 1HB GLU 120 2HB GLU 120 5.528 -5.558 -7.715 662 2HB GLU 120 1HB GLU 120 5.409 -7.250 -8.150 663 1HG GLU 120 2HG GLU 120 4.060 -6.814 -9.998 664 2HG GLU 120 1HG GLU 120 3.662 -5.193 -9.432 665 H GLU 121 H GLU 121 4.549 -8.462 -5.771 666 HA GLU 121 HA GLU 121 4.320 -7.493 -3.166 667 1HB GLU 121 2HB GLU 121 6.048 -9.285 -2.619 668 2HB GLU 121 1HB GLU 121 4.559 -9.818 -3.388 669 1HG GLU 121 2HG GLU 121 6.631 -9.168 -5.309 670 2HG GLU 121 1HG GLU 121 7.121 -10.427 -4.177 671 H GLY 122 H GLY 122 6.130 -7.149 -1.621 672 1HA GLY 122 2HA GLY 122 7.730 -5.670 -0.901 673 2HA GLY 122 1HA GLY 122 8.705 -6.443 -2.133 674 H GLU 123 H GLU 123 5.860 -4.528 -2.872 675 HA GLU 123 HA GLU 123 7.593 -2.650 -4.309 676 1HB GLU 123 2HB GLU 123 4.689 -3.378 -4.558 677 2HB GLU 123 1HB GLU 123 5.323 -1.912 -5.290 678 1HG GLU 123 2HG GLU 123 6.332 -4.691 -5.841 679 2HG GLU 123 1HG GLU 123 5.208 -3.795 -6.860 680 H SER 124 H SER 124 6.810 -0.361 -4.413 681 HA SER 124 HA SER 124 5.763 0.533 -1.809 682 1HB SER 124 2HB SER 124 8.077 1.643 -3.405 683 2HB SER 124 1HB SER 124 7.275 2.562 -2.132 684 HG SER 124 HG SER 124 7.750 0.644 -0.778 685 H TYR 125 H TYR 125 3.864 1.500 -2.092 686 HA TYR 125 HA TYR 125 3.397 2.945 -4.611 687 1HB TYR 125 2HB TYR 125 1.550 1.385 -2.871 688 2HB TYR 125 1HB TYR 125 0.921 2.645 -3.907 689 HD1 TYR 125 1HD TYR 125 2.029 2.531 -6.365 690 HD2 TYR 125 2HD TYR 125 1.417 -0.765 -3.764 691 HE1 TYR 125 1HE TYR 125 2.045 1.038 -8.288 692 HE2 TYR 125 2HE TYR 125 1.429 -2.292 -5.688 693 HH TYR 125 HH TYR 125 0.935 -1.463 -8.695 694 H VAL 126 H VAL 126 2.004 4.748 -4.562 695 HA VAL 126 HA VAL 126 2.212 6.269 -2.033 696 HB VAL 126 HB VAL 126 2.703 7.136 -4.856 697 1HG1 VAL 126 1HG1 VAL 126 1.218 8.831 -4.486 698 2HG1 VAL 126 2HG1 VAL 126 2.647 9.532 -3.725 699 3HG1 VAL 126 3HG1 VAL 126 1.408 8.764 -2.733 700 1HG2 VAL 126 1HG2 VAL 126 4.732 7.795 -4.087 701 2HG2 VAL 126 2HG2 VAL 126 4.385 6.570 -2.865 702 3HG2 VAL 126 3HG2 VAL 126 4.100 8.276 -2.512 703 H CYS 127 H CYS 127 0.430 7.281 -1.270 704 HA CYS 127 HA CYS 127 -2.082 6.715 -2.639 705 1HB CYS 127 2HB CYS 127 -1.389 7.598 0.155 706 2HB CYS 127 1HB CYS 127 -3.042 7.672 -0.447 707 HG CYS 127 HG CYS 127 -1.601 4.933 -0.484 708 H SER 128 H SER 128 -3.147 8.186 -3.770 709 HA SER 128 HA SER 128 -2.535 11.032 -3.308 710 1HB SER 128 2HB SER 128 -3.053 9.712 -5.984 711 2HB SER 128 1HB SER 128 -2.753 11.431 -5.717 712 HG SER 128 HG SER 128 -0.944 9.325 -5.112 713 H SER 129 H SER 129 -4.227 12.521 -4.006 714 HA SER 129 HA SER 129 -6.885 11.446 -4.401 715 1HB SER 129 2HB SER 129 -6.028 12.773 -1.846 716 2HB SER 129 1HB SER 129 -7.687 12.942 -2.416 717 HG SER 129 HG SER 129 -6.313 10.633 -1.587 718 H ASP 130 H ASP 130 -4.984 14.344 -3.631 719 HA ASP 130 HA ASP 130 -6.149 15.709 -5.916 720 1HB ASP 130 2HB ASP 130 -7.257 16.127 -3.401 721 2HB ASP 130 1HB ASP 130 -6.160 17.490 -3.607 722 H ASN 131 H ASN 131 -3.523 14.700 -5.212 723 HA ASN 131 HA ASN 131 -1.995 17.199 -4.941 724 1HB ASN 131 2HB ASN 131 -0.932 14.386 -4.666 725 2HB ASN 131 1HB ASN 131 -0.140 15.883 -4.186 726 1HD2 ASN 131 1HD2 ASN 131 -1.921 13.292 -3.136 727 2HD2 ASN 131 2HD2 ASN 131 -2.454 13.923 -1.619 728 H PHE 132 H PHE 132 0.428 16.294 -6.010 729 HA PHE 132 HA PHE 132 -0.076 15.401 -8.723 730 1HB PHE 132 2HB PHE 132 -0.372 17.994 -8.494 731 2HB PHE 132 1HB PHE 132 1.387 18.003 -8.438 732 HD1 PHE 132 1HD PHE 132 -1.180 16.188 -10.455 733 HD2 PHE 132 2HD PHE 132 2.323 18.603 -10.433 734 HE1 PHE 132 1HE PHE 132 -1.105 16.095 -12.912 735 HE2 PHE 132 2HE PHE 132 2.404 18.516 -12.891 736 HZ PHE 132 HZ PHE 132 0.688 17.260 -14.134 737 H PHE 133 H PHE 133 1.271 13.993 -6.918 738 HA PHE 133 HA PHE 133 3.263 13.082 -6.265 739 1HB PHE 133 2HB PHE 133 2.856 12.451 -8.723 740 2HB PHE 133 1HB PHE 133 4.140 13.596 -9.091 741 HD1 PHE 133 1HD PHE 133 3.391 10.576 -7.066 742 HD2 PHE 133 2HD PHE 133 6.366 12.934 -8.989 743 HE1 PHE 133 1HE PHE 133 5.066 8.835 -6.600 744 HE2 PHE 133 2HE PHE 133 8.046 11.197 -8.528 745 HZ PHE 133 HZ PHE 133 7.398 9.144 -7.331 746 H LYS 134 H LYS 134 4.612 14.058 -4.917 747 HA LYS 134 HA LYS 134 6.064 16.443 -5.805 748 1HB LYS 134 2HB LYS 134 5.981 15.337 -3.004 749 2HB LYS 134 1HB LYS 134 6.414 16.963 -3.514 750 1HG LYS 134 2HG LYS 134 3.750 16.326 -4.380 751 2HG LYS 134 1HG LYS 134 3.920 16.050 -2.645 752 1HD LYS 134 2HD LYS 134 3.307 18.286 -2.748 753 2HD LYS 134 1HD LYS 134 5.067 18.372 -2.634 754 1HE LYS 134 2HE LYS 134 5.294 19.180 -4.730 755 2HE LYS 134 1HE LYS 134 3.972 18.200 -5.363 756 1HZ LYS 134 1HZ LYS 134 2.458 19.801 -4.929 757 2HZ LYS 134 2HZ LYS 134 3.803 20.818 -5.072 758 3HZ LYS 134 3HZ LYS 134 3.250 20.356 -3.541 759 H LYS 135 H LYS 135 6.596 13.291 -6.017 760 HA LYS 135 HA LYS 135 8.373 11.852 -5.837 761 1HB LYS 135 2HB LYS 135 10.360 12.709 -7.082 762 2HB LYS 135 1HB LYS 135 8.832 12.910 -7.925 763 1HG LYS 135 2HG LYS 135 9.819 15.175 -6.281 764 2HG LYS 135 1HG LYS 135 10.633 14.832 -7.805 765 1HD LYS 135 2HD LYS 135 7.816 14.715 -8.232 766 2HD LYS 135 1HD LYS 135 8.195 16.215 -7.384 767 1HE LYS 135 2HE LYS 135 8.277 16.535 -9.798 768 2HE LYS 135 1HE LYS 135 9.870 16.756 -9.077 769 1HZ LYS 135 1HZ LYS 135 9.773 15.400 -11.178 770 2HZ LYS 135 2HZ LYS 135 9.013 14.188 -10.277 771 3HZ LYS 135 3HZ LYS 135 10.581 14.680 -9.878 772 H VAL 136 H VAL 136 8.792 11.460 -3.705 773 HA VAL 136 HA VAL 136 11.001 13.020 -2.533 774 HB VAL 136 HB VAL 136 9.757 11.921 -0.338 775 1HG1 VAL 136 1HG1 VAL 136 10.726 14.152 -0.530 776 2HG1 VAL 136 2HG1 VAL 136 9.120 14.204 0.197 777 3HG1 VAL 136 3HG1 VAL 136 9.341 14.673 -1.489 778 1HG2 VAL 136 1HG2 VAL 136 7.525 13.156 -1.912 779 2HG2 VAL 136 2HG2 VAL 136 7.447 12.198 -0.434 780 3HG2 VAL 136 3HG2 VAL 136 7.828 11.420 -1.970 781 H GLU 137 H GLU 137 11.820 11.630 -0.487 782 HA GLU 137 HA GLU 137 12.883 9.233 -1.671 783 1HB GLU 137 2HB GLU 137 13.252 10.229 1.164 784 2HB GLU 137 1HB GLU 137 14.263 9.071 0.313 785 1HG GLU 137 2HG GLU 137 15.578 10.805 -0.137 786 2HG GLU 137 1HG GLU 137 14.363 11.251 -1.334 787 H TYR 138 H TYR 138 10.608 8.526 -1.866 788 HA TYR 138 HA TYR 138 9.042 7.593 0.216 789 1HB TYR 138 2HB TYR 138 9.423 6.799 -2.644 790 2HB TYR 138 1HB TYR 138 8.247 5.959 -1.625 791 HD1 TYR 138 1HD TYR 138 7.051 8.085 -0.060 792 HD2 TYR 138 2HD TYR 138 8.263 8.112 -4.137 793 HE1 TYR 138 1HE TYR 138 5.412 9.861 -0.526 794 HE2 TYR 138 2HE TYR 138 6.625 9.883 -4.619 795 HH TYR 138 HH TYR 138 4.577 10.796 -3.711 796 H THR 139 H THR 139 11.169 5.599 -1.843 797 HA THR 139 HA THR 139 11.167 3.502 0.175 798 HB THR 139 HB THR 139 12.138 2.087 -1.545 799 HG1 THR 139 1HG THR 139 13.445 3.546 -2.619 800 1HG2 THR 139 1HG2 THR 139 10.271 3.220 -3.385 801 2HG2 THR 139 2HG2 THR 139 9.603 3.254 -1.753 802 3HG2 THR 139 3HG2 THR 139 10.158 1.731 -2.447 803 H LYS 140 H LYS 140 13.115 6.122 -0.650 804 HA LYS 140 HA LYS 140 15.677 4.942 -0.250 805 1HB LYS 140 2HB LYS 140 14.643 7.520 -0.921 806 2HB LYS 140 1HB LYS 140 15.763 7.703 0.422 807 1HG LYS 140 2HG LYS 140 17.550 7.256 -0.846 808 2HG LYS 140 1HG LYS 140 16.733 5.954 -1.712 809 1HD LYS 140 2HD LYS 140 15.620 8.542 -2.383 810 2HD LYS 140 1HD LYS 140 17.357 8.484 -2.691 811 1HE LYS 140 2HE LYS 140 15.979 7.792 -4.636 812 2HE LYS 140 1HE LYS 140 17.103 6.549 -4.088 813 1HZ LYS 140 1HZ LYS 140 14.305 6.592 -3.148 814 2HZ LYS 140 2HZ LYS 140 15.392 5.297 -3.175 815 3HZ LYS 140 3HZ LYS 140 14.718 5.864 -4.618 816 H ASN 141 H ASN 141 16.695 4.427 1.502 817 HA ASN 141 HA ASN 141 17.293 4.205 3.662 818 1HB ASN 141 2HB ASN 141 16.207 6.915 3.550 819 2HB ASN 141 1HB ASN 141 16.064 6.184 5.146 820 1HD2 ASN 141 1HD2 ASN 141 18.391 6.667 2.524 821 2HD2 ASN 141 2HD2 ASN 141 19.765 6.889 3.548 822 H VAL 142 H VAL 142 14.502 3.444 2.500 823 HA VAL 142 HA VAL 142 13.017 3.081 4.984 824 HB VAL 142 HB VAL 142 12.227 2.307 2.173 825 1HG1 VAL 142 1HG1 VAL 142 9.908 2.423 3.280 826 2HG1 VAL 142 2HG1 VAL 142 10.787 2.302 4.804 827 3HG1 VAL 142 3HG1 VAL 142 10.917 1.013 3.606 828 1HG2 VAL 142 1HG2 VAL 142 10.678 4.464 3.144 829 2HG2 VAL 142 2HG2 VAL 142 11.807 4.455 1.789 830 3HG2 VAL 142 3HG2 VAL 142 12.373 4.879 3.405 831 H ASN 143 H ASN 143 14.505 1.160 2.406 832 HA ASN 143 HA ASN 143 15.400 -0.942 2.452 833 1HB ASN 143 2HB ASN 143 15.428 -0.259 5.144 834 2HB ASN 143 1HB ASN 143 14.561 -1.790 5.114 835 1HD2 ASN 143 1HD2 ASN 143 16.257 -2.820 6.179 836 2HD2 ASN 143 2HD2 ASN 143 17.731 -3.225 5.372 837 HA PRO 144 HA PRO 144 11.450 -2.892 1.594 838 1HB PRO 144 2HB PRO 144 12.262 -4.510 -0.363 839 2HB PRO 144 1HB PRO 144 12.179 -2.760 -0.603 840 1HG PRO 144 2HG PRO 144 14.557 -4.489 -0.058 841 2HG PRO 144 1HG PRO 144 14.402 -3.113 -1.164 842 1HD PRO 144 2HD PRO 144 15.510 -2.994 1.379 843 2HD PRO 144 1HD PRO 144 14.879 -1.602 0.478 844 H ASN 145 H ASN 145 13.076 -3.852 3.854 845 HA ASN 145 HA ASN 145 13.117 -6.740 3.547 846 1HB ASN 145 2HB ASN 145 13.753 -5.043 5.971 847 2HB ASN 145 1HB ASN 145 14.061 -6.769 5.804 848 1HD2 ASN 145 1HD2 ASN 145 16.247 -6.661 6.028 849 2HD2 ASN 145 2HD2 ASN 145 17.289 -5.913 4.871 850 H TRP 146 H TRP 146 10.702 -4.641 4.010 851 HA TRP 146 HA TRP 146 9.359 -5.788 6.261 852 1HB TRP 146 2HB TRP 146 7.356 -4.550 4.878 853 2HB TRP 146 1HB TRP 146 8.407 -3.757 6.041 854 HD1 TRP 146 HD TRP 146 10.247 -2.081 5.097 855 HE1 TRP 146 1HE TRP 146 10.505 -0.898 2.828 856 HE3 TRP 146 3HE TRP 146 6.973 -4.884 2.334 857 HZ2 TRP 146 2HZ TRP 146 9.461 -1.118 0.217 858 HZ3 TRP 146 3HZ TRP 146 6.660 -4.323 -0.037 859 HH2 TRP 146 HH TRP 146 7.880 -2.484 -1.075 860 H SER 147 H SER 147 9.669 -6.672 2.966 861 HA SER 147 HA SER 147 7.202 -8.160 2.842 862 1HB SER 147 2HB SER 147 8.295 -9.044 0.681 863 2HB SER 147 1HB SER 147 7.893 -7.329 0.752 864 HG SER 147 HG SER 147 10.409 -8.578 0.919 865 H VAL 148 H VAL 148 10.430 -8.755 3.900 866 HA VAL 148 HA VAL 148 10.182 -11.638 3.678 867 HB VAL 148 HB VAL 148 12.430 -11.675 4.732 868 1HG1 VAL 148 1HG1 VAL 148 12.450 -11.740 2.390 869 2HG1 VAL 148 2HG1 VAL 148 13.584 -10.455 2.803 870 3HG1 VAL 148 3HG1 VAL 148 11.958 -10.052 2.252 871 1HG2 VAL 148 1HG2 VAL 148 12.601 -8.717 4.385 872 2HG2 VAL 148 2HG2 VAL 148 13.572 -9.787 5.395 873 3HG2 VAL 148 3HG2 VAL 148 11.924 -9.380 5.873 874 H ASN 149 H ASN 149 9.530 -9.181 5.978 875 HA ASN 149 HA ASN 149 9.653 -11.020 8.239 876 1HB ASN 149 2HB ASN 149 9.541 -8.090 7.897 877 2HB ASN 149 1HB ASN 149 8.637 -8.716 9.274 878 1HD2 ASN 149 1HD2 ASN 149 9.714 -9.018 11.082 879 2HD2 ASN 149 2HD2 ASN 149 11.430 -9.147 11.232 880 H VAL 150 H VAL 150 7.860 -12.051 6.631 881 HA VAL 150 HA VAL 150 5.220 -11.081 7.480 882 HB VAL 150 HB VAL 150 4.318 -12.570 5.709 883 1HG1 VAL 150 1HG1 VAL 150 6.190 -10.329 5.127 884 2HG1 VAL 150 2HG1 VAL 150 4.438 -10.412 4.946 885 3HG1 VAL 150 3HG1 VAL 150 5.485 -11.222 3.779 886 1HG2 VAL 150 1HG2 VAL 150 7.216 -12.954 4.965 887 2HG2 VAL 150 2HG2 VAL 150 5.820 -13.545 4.064 888 3HG2 VAL 150 3HG2 VAL 150 6.169 -14.184 5.671 Start of MODEL 3 1 1H GLY 38 1HT GLY 38 18.327 -33.949 -7.280 2 2H GLY 38 2HT GLY 38 18.518 -32.269 -7.267 3 3H GLY 38 3HT GLY 38 18.022 -33.073 -5.865 4 1HA GLY 38 1HA GLY 38 20.164 -32.966 -5.276 5 2HA GLY 38 2HA GLY 38 20.310 -34.351 -6.349 6 H ALA 39 H ALA 39 19.915 -30.860 -6.941 7 HA ALA 39 HA ALA 39 22.556 -30.418 -7.805 8 1HB ALA 39 1HB ALA 39 22.392 -30.420 -10.160 9 2HB ALA 39 2HB ALA 39 20.642 -30.643 -10.114 10 3HB ALA 39 3HB ALA 39 21.713 -31.958 -9.626 11 H MET 40 H MET 40 19.349 -29.451 -9.043 12 HA MET 40 HA MET 40 20.093 -26.654 -8.737 13 1HB MET 40 2HB MET 40 17.827 -28.093 -10.081 14 2HB MET 40 1HB MET 40 17.717 -26.368 -9.758 15 1HG MET 40 2HG MET 40 18.501 -26.528 -11.950 16 2HG MET 40 1HG MET 40 19.927 -26.149 -10.985 17 1HE MET 40 1HE MET 40 22.357 -27.971 -11.896 18 2HE MET 40 2HE MET 40 21.449 -26.565 -12.451 19 3HE MET 40 3HE MET 40 21.661 -27.954 -13.516 20 H ASP 41 H ASP 41 18.907 -25.154 -7.516 21 HA ASP 41 HA ASP 41 16.750 -26.008 -5.825 22 1HB ASP 41 2HB ASP 41 19.384 -26.305 -4.835 23 2HB ASP 41 1HB ASP 41 18.682 -24.923 -3.998 24 HA PRO 42 HA PRO 42 17.748 -21.293 -4.985 25 1HB PRO 42 2HB PRO 42 19.784 -20.825 -7.093 26 2HB PRO 42 1HB PRO 42 19.703 -20.192 -5.446 27 1HG PRO 42 2HG PRO 42 21.456 -22.091 -6.091 28 2HG PRO 42 1HG PRO 42 20.628 -22.106 -4.522 29 1HD PRO 42 2HD PRO 42 20.091 -23.749 -6.967 30 2HD PRO 42 1HD PRO 42 20.057 -24.226 -5.258 31 H GLU 43 H GLU 43 18.021 -22.672 -8.218 32 HA GLU 43 HA GLU 43 16.613 -20.509 -9.484 33 1HB GLU 43 2HB GLU 43 18.051 -22.878 -10.315 34 2HB GLU 43 1HB GLU 43 16.522 -22.748 -11.174 35 1HG GLU 43 2HG GLU 43 17.471 -21.305 -12.549 36 2HG GLU 43 1HG GLU 43 17.633 -20.179 -11.203 37 H PHE 44 H PHE 44 15.818 -23.675 -8.201 38 HA PHE 44 HA PHE 44 13.118 -23.610 -9.235 39 1HB PHE 44 2HB PHE 44 14.821 -25.631 -8.426 40 2HB PHE 44 1HB PHE 44 13.658 -25.545 -7.108 41 HD1 PHE 44 1HD PHE 44 14.083 -26.159 -10.704 42 HD2 PHE 44 2HD PHE 44 11.393 -26.226 -7.408 43 HE1 PHE 44 1HE PHE 44 12.479 -27.455 -12.045 44 HE2 PHE 44 2HE PHE 44 9.783 -27.523 -8.742 45 HZ PHE 44 HZ PHE 44 10.326 -28.140 -11.064 46 H ALA 45 H ALA 45 11.286 -24.024 -7.652 47 HA ALA 45 HA ALA 45 10.024 -23.456 -5.831 48 1HB ALA 45 1HB ALA 45 12.218 -24.005 -4.577 49 2HB ALA 45 2HB ALA 45 10.984 -23.049 -3.757 50 3HB ALA 45 3HB ALA 45 12.396 -22.255 -4.454 51 H LEU 46 H LEU 46 9.394 -21.413 -4.541 52 HA LEU 46 HA LEU 46 10.229 -18.903 -5.663 53 1HB LEU 46 2HB LEU 46 7.797 -18.366 -6.332 54 2HB LEU 46 1HB LEU 46 8.796 -19.288 -7.437 55 HG LEU 46 HG LEU 46 6.420 -20.088 -7.173 56 1HD1 LEU 46 1HD1 LEU 46 7.054 -22.178 -7.726 57 2HD1 LEU 46 2HD1 LEU 46 8.104 -22.351 -6.320 58 3HD1 LEU 46 3HD1 LEU 46 8.661 -21.452 -7.730 59 1HD2 LEU 46 1HD2 LEU 46 7.441 -21.003 -4.486 60 2HD2 LEU 46 2HD2 LEU 46 5.889 -21.428 -5.207 61 3HD2 LEU 46 3HD2 LEU 46 6.225 -19.756 -4.759 62 H SER 47 H SER 47 10.386 -19.739 -3.094 63 HA SER 47 HA SER 47 9.944 -19.091 -0.963 64 1HB SER 47 2HB SER 47 8.397 -16.924 -2.398 65 2HB SER 47 1HB SER 47 8.640 -16.957 -0.653 66 HG SER 47 HG SER 47 10.958 -17.071 -1.201 67 H ASN 48 H ASN 48 6.819 -18.123 -2.335 68 HA ASN 48 HA ASN 48 5.494 -20.484 -1.356 69 1HB ASN 48 2HB ASN 48 3.931 -19.115 0.113 70 2HB ASN 48 1HB ASN 48 5.554 -19.378 0.744 71 1HD2 ASN 48 1HD2 ASN 48 7.108 -17.638 0.450 72 2HD2 ASN 48 2HD2 ASN 48 6.548 -16.005 0.464 73 H GLU 49 H GLU 49 5.004 -17.109 -2.368 74 HA GLU 49 HA GLU 49 3.446 -16.141 -3.731 75 1HB GLU 49 2HB GLU 49 4.427 -18.565 -5.158 76 2HB GLU 49 1HB GLU 49 3.073 -17.692 -5.861 77 1HG GLU 49 2HG GLU 49 4.699 -15.631 -5.408 78 2HG GLU 49 1HG GLU 49 5.906 -16.904 -5.584 79 H LYS 50 H LYS 50 2.205 -17.376 -1.615 80 HA LYS 50 HA LYS 50 0.005 -18.967 -2.653 81 1HB LYS 50 2HB LYS 50 1.061 -18.278 0.033 82 2HB LYS 50 1HB LYS 50 -0.668 -18.574 -0.078 83 1HG LYS 50 2HG LYS 50 0.192 -20.707 -1.421 84 2HG LYS 50 1HG LYS 50 1.601 -20.441 -0.392 85 1HD LYS 50 2HD LYS 50 0.105 -20.432 1.582 86 2HD LYS 50 1HD LYS 50 -1.252 -20.810 0.519 87 1HE LYS 50 2HE LYS 50 0.371 -22.777 -0.218 88 2HE LYS 50 1HE LYS 50 1.010 -22.519 1.405 89 1HZ LYS 50 1HZ LYS 50 -1.549 -22.591 1.976 90 2HZ LYS 50 2HZ LYS 50 -0.621 -24.001 1.874 91 3HZ LYS 50 3HZ LYS 50 -1.597 -23.536 0.573 92 H LYS 51 H LYS 51 -0.223 -16.724 -3.958 93 HA LYS 51 HA LYS 51 -1.651 -15.038 -4.493 94 1HB LYS 51 2HB LYS 51 -3.287 -16.064 -2.169 95 2HB LYS 51 1HB LYS 51 -3.854 -14.987 -3.437 96 1HG LYS 51 2HG LYS 51 -3.695 -16.695 -5.077 97 2HG LYS 51 1HG LYS 51 -2.826 -17.761 -3.971 98 1HD LYS 51 2HD LYS 51 -5.454 -16.831 -3.026 99 2HD LYS 51 1HD LYS 51 -5.490 -17.893 -4.435 100 1HE LYS 51 2HE LYS 51 -5.544 -19.457 -2.775 101 2HE LYS 51 1HE LYS 51 -3.799 -19.301 -2.981 102 1HZ LYS 51 1HZ LYS 51 -5.035 -17.484 -1.077 103 2HZ LYS 51 2HZ LYS 51 -3.563 -18.310 -0.986 104 3HZ LYS 51 3HZ LYS 51 -5.007 -19.116 -0.631 105 H ALA 52 H ALA 52 -2.646 -12.990 -3.646 106 HA ALA 52 HA ALA 52 -2.554 -11.062 -2.444 107 1HB ALA 52 1HB ALA 52 -2.707 -12.875 -0.508 108 2HB ALA 52 2HB ALA 52 -2.474 -11.157 -0.180 109 3HB ALA 52 3HB ALA 52 -1.092 -12.254 -0.164 110 H LYS 53 H LYS 53 -1.000 -9.436 -1.631 111 HA LYS 53 HA LYS 53 1.803 -10.023 -2.208 112 1HB LYS 53 2HB LYS 53 0.434 -7.632 -3.436 113 2HB LYS 53 1HB LYS 53 2.070 -8.201 -3.733 114 1HG LYS 53 2HG LYS 53 -0.339 -9.856 -4.410 115 2HG LYS 53 1HG LYS 53 0.332 -8.663 -5.523 116 1HD LYS 53 2HD LYS 53 2.470 -9.811 -5.508 117 2HD LYS 53 1HD LYS 53 1.863 -10.969 -4.321 118 1HE LYS 53 2HE LYS 53 0.729 -12.151 -5.868 119 2HE LYS 53 1HE LYS 53 0.237 -10.709 -6.756 120 1HZ LYS 53 1HZ LYS 53 2.713 -12.283 -7.005 121 2HZ LYS 53 2HZ LYS 53 2.709 -10.652 -7.450 122 3HZ LYS 53 3HZ LYS 53 1.666 -11.740 -8.218 123 H LYS 54 H LYS 54 3.234 -8.821 -1.031 124 HA LYS 54 HA LYS 54 2.113 -7.175 1.078 125 1HB LYS 54 2HB LYS 54 4.647 -8.696 0.698 126 2HB LYS 54 1HB LYS 54 4.694 -7.281 1.739 127 1HG LYS 54 2HG LYS 54 2.688 -9.487 2.098 128 2HG LYS 54 1HG LYS 54 4.278 -9.503 2.864 129 1HD LYS 54 2HD LYS 54 3.469 -8.244 4.508 130 2HD LYS 54 1HD LYS 54 3.162 -6.954 3.346 131 1HE LYS 54 2HE LYS 54 0.944 -7.474 3.146 132 2HE LYS 54 1HE LYS 54 1.199 -9.180 3.512 133 1HZ LYS 54 1HZ LYS 54 0.662 -6.969 5.296 134 2HZ LYS 54 2HZ LYS 54 1.876 -8.017 5.829 135 3HZ LYS 54 3HZ LYS 54 0.333 -8.618 5.485 136 H VAL 55 H VAL 55 2.147 -5.077 0.949 137 HA VAL 55 HA VAL 55 4.209 -3.768 -0.700 138 HB VAL 55 HB VAL 55 2.542 -2.033 -1.308 139 1HG1 VAL 55 1HG1 VAL 55 1.788 -3.129 -3.160 140 2HG1 VAL 55 2HG1 VAL 55 1.416 -4.611 -2.275 141 3HG1 VAL 55 3HG1 VAL 55 3.091 -4.204 -2.651 142 1HG2 VAL 55 1HG2 VAL 55 0.108 -2.830 -1.108 143 2HG2 VAL 55 2HG2 VAL 55 0.892 -2.137 0.316 144 3HG2 VAL 55 3HG2 VAL 55 0.717 -3.888 0.164 145 H ARG 56 H ARG 56 4.770 -1.661 -0.129 146 HA ARG 56 HA ARG 56 4.186 -0.942 2.659 147 1HB ARG 56 2HB ARG 56 6.613 -1.350 1.893 148 2HB ARG 56 1HB ARG 56 6.449 0.141 0.976 149 1HG ARG 56 2HG ARG 56 7.367 0.973 2.877 150 2HG ARG 56 1HG ARG 56 5.663 1.074 3.322 151 1HD ARG 56 2HD ARG 56 5.791 -0.755 4.728 152 2HD ARG 56 1HD ARG 56 7.216 -1.405 3.925 153 HE ARG 56 HE ARG 56 8.550 -0.056 5.235 154 1HH1 ARG 56 1HH1 ARG 56 5.201 0.841 5.655 155 2HH1 ARG 56 2HH1 ARG 56 5.515 1.849 7.027 156 1HH2 ARG 56 1HH2 ARG 56 8.961 1.270 7.038 157 2HH2 ARG 56 2HH2 ARG 56 7.648 2.093 7.813 158 H PHE 57 H PHE 57 2.495 0.439 2.623 159 HA PHE 57 HA PHE 57 2.160 2.213 0.360 160 1HB PHE 57 2HB PHE 57 0.458 1.573 2.755 161 2HB PHE 57 1HB PHE 57 0.044 2.866 1.638 162 HD1 PHE 57 1HD PHE 57 -1.812 0.703 2.134 163 HD2 PHE 57 2HD PHE 57 1.395 0.905 -0.664 164 HE1 PHE 57 1HE PHE 57 -2.966 -0.915 0.688 165 HE2 PHE 57 2HE PHE 57 0.243 -0.697 -2.107 166 HZ PHE 57 HZ PHE 57 -1.943 -1.616 -1.437 167 H TYR 58 H TYR 58 2.630 4.225 0.257 168 HA TYR 58 HA TYR 58 3.385 5.718 2.678 169 1HB TYR 58 2HB TYR 58 4.413 6.199 -0.106 170 2HB TYR 58 1HB TYR 58 4.950 6.979 1.362 171 HD1 TYR 58 1HD TYR 58 5.914 4.686 -0.985 172 HD2 TYR 58 2HD TYR 58 5.659 5.087 3.242 173 HE1 TYR 58 1HE TYR 58 7.679 2.994 -0.724 174 HE2 TYR 58 2HE TYR 58 7.422 3.394 3.515 175 HH TYR 58 HH TYR 58 9.242 2.412 2.265 176 H ARG 59 H ARG 59 2.731 7.855 2.808 177 HA ARG 59 HA ARG 59 0.447 8.508 1.093 178 1HB ARG 59 2HB ARG 59 1.301 10.061 3.530 179 2HB ARG 59 1HB ARG 59 -0.289 9.988 2.784 180 1HG ARG 59 2HG ARG 59 -0.882 8.168 3.940 181 2HG ARG 59 1HG ARG 59 0.697 7.405 3.747 182 1HD ARG 59 2HD ARG 59 0.162 7.922 6.102 183 2HD ARG 59 1HD ARG 59 1.611 8.747 5.530 184 HE ARG 59 HE ARG 59 -0.650 10.408 5.201 185 1HH1 ARG 59 1HH1 ARG 59 1.462 9.139 7.671 186 2HH1 ARG 59 2HH1 ARG 59 1.220 10.477 8.743 187 1HH2 ARG 59 1HH2 ARG 59 -0.970 12.171 6.609 188 2HH2 ARG 59 2HH2 ARG 59 -0.160 12.199 8.140 189 H ASN 60 H ASN 60 0.804 9.762 -0.588 190 HA ASN 60 HA ASN 60 3.048 10.898 -1.477 191 1HB ASN 60 2HB ASN 60 0.422 11.002 -2.241 192 2HB ASN 60 1HB ASN 60 0.778 12.691 -1.922 193 1HD2 ASN 60 1HD2 ASN 60 0.393 10.884 -4.374 194 2HD2 ASN 60 2HD2 ASN 60 1.684 11.356 -5.418 195 H GLY 61 H GLY 61 4.367 12.547 -1.076 196 1HA GLY 61 2HA GLY 61 5.281 14.390 -0.052 197 2HA GLY 61 1HA GLY 61 3.639 14.993 0.122 198 H ASP 62 H ASP 62 5.331 12.180 1.502 199 HA ASP 62 HA ASP 62 5.139 13.334 4.163 200 1HB ASP 62 2HB ASP 62 3.023 11.870 3.427 201 2HB ASP 62 1HB ASP 62 4.083 10.559 3.939 202 H ARG 63 H ARG 63 7.471 13.249 3.491 203 HA ARG 63 HA ARG 63 8.758 10.688 3.425 204 1HB ARG 63 2HB ARG 63 10.814 11.923 3.247 205 2HB ARG 63 1HB ARG 63 9.605 12.672 2.210 206 1HG ARG 63 2HG ARG 63 9.556 13.874 4.817 207 2HG ARG 63 1HG ARG 63 11.191 13.905 4.155 208 1HD ARG 63 2HD ARG 63 10.588 15.224 2.370 209 2HD ARG 63 1HD ARG 63 8.908 14.691 2.408 210 HE ARG 63 HE ARG 63 8.438 16.372 3.890 211 1HH1 ARG 63 1HH1 ARG 63 11.899 15.974 3.684 212 2HH1 ARG 63 2HH1 ARG 63 12.244 17.392 4.615 213 1HH2 ARG 63 1HH2 ARG 63 8.889 18.239 5.114 214 2HH2 ARG 63 2HH2 ARG 63 10.535 18.680 5.425 215 H TYR 64 H TYR 64 7.318 12.125 5.936 216 HA TYR 64 HA TYR 64 9.303 11.108 7.852 217 1HB TYR 64 2HB TYR 64 7.915 13.711 7.762 218 2HB TYR 64 1HB TYR 64 7.913 12.914 9.332 219 HD1 TYR 64 1HD TYR 64 9.582 13.611 10.751 220 HD2 TYR 64 2HD TYR 64 10.388 13.464 6.576 221 HE1 TYR 64 1HE TYR 64 11.867 14.420 11.169 222 HE2 TYR 64 2HE TYR 64 12.674 14.272 6.983 223 HH TYR 64 HH TYR 64 13.907 15.527 8.692 224 H PHE 65 H PHE 65 7.839 9.213 7.229 225 HA PHE 65 HA PHE 65 6.066 8.735 9.428 226 1HB PHE 65 2HB PHE 65 4.478 9.896 8.043 227 2HB PHE 65 1HB PHE 65 4.941 8.955 6.631 228 HD1 PHE 65 1HD PHE 65 3.275 7.545 5.961 229 HD2 PHE 65 2HD PHE 65 3.933 8.106 10.128 230 HE1 PHE 65 1HE PHE 65 1.495 5.921 6.455 231 HE2 PHE 65 2HE PHE 65 2.154 6.482 10.631 232 HZ PHE 65 HZ PHE 65 0.932 5.387 8.794 233 H LYS 66 H LYS 66 7.342 7.674 6.319 234 HA LYS 66 HA LYS 66 8.315 5.702 5.714 235 1HB LYS 66 2HB LYS 66 7.549 4.673 8.453 236 2HB LYS 66 1HB LYS 66 8.619 3.879 7.309 237 1HG LYS 66 2HG LYS 66 9.352 6.634 8.048 238 2HG LYS 66 1HG LYS 66 9.476 5.423 9.328 239 1HD LYS 66 2HD LYS 66 11.272 4.463 8.390 240 2HD LYS 66 1HD LYS 66 10.564 4.517 6.775 241 1HE LYS 66 2HE LYS 66 11.913 6.808 8.202 242 2HE LYS 66 1HE LYS 66 12.605 5.850 6.893 243 1HZ LYS 66 1HZ LYS 66 10.407 6.633 5.702 244 2HZ LYS 66 2HZ LYS 66 11.798 7.595 5.712 245 3HZ LYS 66 3HZ LYS 66 10.541 7.918 6.796 246 H GLY 67 H GLY 67 5.158 6.286 6.245 247 1HA GLY 67 2HA GLY 67 3.247 5.365 5.375 248 2HA GLY 67 1HA GLY 67 4.288 4.310 4.435 249 H ILE 68 H ILE 68 2.152 3.081 5.036 250 HA ILE 68 HA ILE 68 2.754 1.441 7.409 251 HB ILE 68 HB ILE 68 0.753 2.714 7.873 252 1HG1 ILE 68 2HG1 ILE 68 -0.185 -0.052 7.125 253 2HG1 ILE 68 1HG1 ILE 68 0.916 0.236 8.469 254 1HG2 ILE 68 1HG2 ILE 68 0.280 2.657 5.187 255 2HG2 ILE 68 2HG2 ILE 68 -0.870 3.201 6.409 256 3HG2 ILE 68 3HG2 ILE 68 -0.944 1.546 5.799 257 1HD1 ILE 68 1HD1 ILE 68 -1.655 0.065 8.859 258 2HD1 ILE 68 2HD1 ILE 68 -1.640 1.752 8.346 259 3HD1 ILE 68 3HD1 ILE 68 -0.691 1.246 9.745 260 H VAL 69 H VAL 69 2.680 -0.767 7.163 261 HA VAL 69 HA VAL 69 2.735 -1.747 4.438 262 HB VAL 69 HB VAL 69 3.065 -3.361 6.968 263 1HG1 VAL 69 1HG1 VAL 69 4.625 -4.539 5.115 264 2HG1 VAL 69 2HG1 VAL 69 3.346 -3.898 4.084 265 3HG1 VAL 69 3HG1 VAL 69 2.946 -4.988 5.410 266 1HG2 VAL 69 1HG2 VAL 69 4.661 -1.266 6.332 267 2HG2 VAL 69 2HG2 VAL 69 5.466 -2.574 5.466 268 3HG2 VAL 69 3HG2 VAL 69 5.202 -2.697 7.206 269 H TYR 70 H TYR 70 1.196 -2.883 3.427 270 HA TYR 70 HA TYR 70 -0.965 -4.066 4.974 271 1HB TYR 70 2HB TYR 70 -1.205 -1.783 3.187 272 2HB TYR 70 1HB TYR 70 -2.238 -3.118 2.692 273 HD1 TYR 70 1HD TYR 70 -1.267 -1.512 5.936 274 HD2 TYR 70 2HD TYR 70 -4.386 -2.991 3.451 275 HE1 TYR 70 1HE TYR 70 -2.914 -0.909 7.658 276 HE2 TYR 70 2HE TYR 70 -6.044 -2.386 5.163 277 HH TYR 70 HH TYR 70 -6.321 -0.993 7.051 278 H ALA 71 H ALA 71 -2.050 -5.711 3.975 279 HA ALA 71 HA ALA 71 -0.590 -7.036 1.802 280 1HB ALA 71 1HB ALA 71 -2.677 -8.378 3.481 281 2HB ALA 71 2HB ALA 71 -1.046 -8.145 4.108 282 3HB ALA 71 3HB ALA 71 -1.299 -9.086 2.638 283 H VAL 72 H VAL 72 -1.723 -7.767 -0.043 284 HA VAL 72 HA VAL 72 -4.548 -7.026 -0.225 285 HB VAL 72 HB VAL 72 -2.771 -6.306 -2.517 286 1HG1 VAL 72 1HG1 VAL 72 -4.532 -4.946 -3.180 287 2HG1 VAL 72 2HG1 VAL 72 -5.205 -4.854 -1.551 288 3HG1 VAL 72 3HG1 VAL 72 -5.351 -6.344 -2.483 289 1HG2 VAL 72 1HG2 VAL 72 -3.268 -4.557 -0.106 290 2HG2 VAL 72 2HG2 VAL 72 -2.552 -4.018 -1.626 291 3HG2 VAL 72 3HG2 VAL 72 -1.713 -5.206 -0.629 292 H SER 73 H SER 73 -5.733 -8.434 -1.278 293 HA SER 73 HA SER 73 -4.683 -10.101 -3.386 294 1HB SER 73 2HB SER 73 -4.328 -11.132 -0.914 295 2HB SER 73 1HB SER 73 -5.961 -11.707 -1.245 296 HG SER 73 HG SER 73 -5.160 -12.644 -3.168 297 H SER 74 H SER 74 -6.420 -11.535 -4.288 298 HA SER 74 HA SER 74 -8.777 -10.024 -4.709 299 1HB SER 74 2HB SER 74 -7.511 -12.005 -6.085 300 2HB SER 74 1HB SER 74 -8.886 -12.885 -5.417 301 HG SER 74 HG SER 74 -9.045 -10.465 -6.894 302 H ASP 75 H ASP 75 -7.919 -12.239 -2.264 303 HA ASP 75 HA ASP 75 -10.595 -13.136 -1.705 304 1HB ASP 75 2HB ASP 75 -7.891 -13.779 -0.860 305 2HB ASP 75 1HB ASP 75 -9.004 -13.712 0.495 306 H ARG 76 H ARG 76 -8.404 -10.652 -0.583 307 HA ARG 76 HA ARG 76 -10.173 -9.956 1.628 308 1HB ARG 76 2HB ARG 76 -7.602 -9.988 1.749 309 2HB ARG 76 1HB ARG 76 -7.672 -8.477 0.853 310 1HG ARG 76 2HG ARG 76 -8.374 -7.299 2.631 311 2HG ARG 76 1HG ARG 76 -9.402 -8.606 3.225 312 1HD ARG 76 2HD ARG 76 -7.476 -9.756 4.130 313 2HD ARG 76 1HD ARG 76 -6.394 -8.542 3.447 314 HE ARG 76 HE ARG 76 -8.321 -7.366 5.179 315 1HH1 ARG 76 1HH1 ARG 76 -5.330 -9.165 5.160 316 2HH1 ARG 76 2HH1 ARG 76 -4.811 -8.558 6.696 317 1HH2 ARG 76 1HH2 ARG 76 -7.639 -6.567 7.199 318 2HH2 ARG 76 2HH2 ARG 76 -6.121 -7.083 7.855 319 H PHE 77 H PHE 77 -8.940 -8.564 -1.386 320 HA PHE 77 HA PHE 77 -11.135 -6.605 -1.274 321 1HB PHE 77 2HB PHE 77 -8.449 -6.034 -2.521 322 2HB PHE 77 1HB PHE 77 -9.742 -4.893 -2.161 323 HD1 PHE 77 1HD PHE 77 -6.904 -6.736 -0.844 324 HD2 PHE 77 2HD PHE 77 -10.165 -4.186 0.145 325 HE1 PHE 77 1HE PHE 77 -5.869 -6.262 1.337 326 HE2 PHE 77 2HE PHE 77 -9.134 -3.708 2.326 327 HZ PHE 77 HZ PHE 77 -6.982 -4.746 2.925 328 H ARG 78 H ARG 78 -12.523 -6.918 -2.861 329 HA ARG 78 HA ARG 78 -12.086 -8.665 -5.011 330 1HB ARG 78 2HB ARG 78 -14.218 -6.986 -3.955 331 2HB ARG 78 1HB ARG 78 -14.236 -7.074 -5.703 332 1HG ARG 78 2HG ARG 78 -14.815 -9.262 -5.727 333 2HG ARG 78 1HG ARG 78 -13.905 -9.620 -4.257 334 1HD ARG 78 2HD ARG 78 -15.903 -7.908 -3.404 335 2HD ARG 78 1HD ARG 78 -16.706 -8.935 -4.590 336 HE ARG 78 HE ARG 78 -15.845 -9.689 -1.987 337 1HH1 ARG 78 1HH1 ARG 78 -16.244 -10.895 -5.238 338 2HH1 ARG 78 2HH1 ARG 78 -16.434 -12.542 -4.737 339 1HH2 ARG 78 1HH2 ARG 78 -16.092 -11.855 -1.326 340 2HH2 ARG 78 2HH2 ARG 78 -16.345 -13.087 -2.517 341 H SER 79 H SER 79 -11.514 -5.267 -4.602 342 HA SER 79 HA SER 79 -10.178 -5.125 -7.134 343 1HB SER 79 2HB SER 79 -11.549 -3.535 -8.245 344 2HB SER 79 1HB SER 79 -12.643 -4.802 -7.692 345 HG SER 79 HG SER 79 -13.470 -3.475 -6.216 346 H PHE 80 H PHE 80 -9.549 -2.724 -7.575 347 HA PHE 80 HA PHE 80 -7.957 -1.854 -5.446 348 1HB PHE 80 2HB PHE 80 -8.128 -1.287 -8.131 349 2HB PHE 80 1HB PHE 80 -8.643 0.228 -7.398 350 HD1 PHE 80 1HD PHE 80 -6.891 1.712 -7.594 351 HD2 PHE 80 2HD PHE 80 -6.092 -2.269 -6.325 352 HE1 PHE 80 1HE PHE 80 -4.543 2.315 -7.200 353 HE2 PHE 80 2HE PHE 80 -3.742 -1.673 -5.924 354 HZ PHE 80 HZ PHE 80 -2.962 0.621 -6.362 355 H ASP 81 H ASP 81 -11.192 -0.934 -6.438 356 HA ASP 81 HA ASP 81 -11.438 1.439 -4.960 357 1HB ASP 81 2HB ASP 81 -13.027 0.315 -6.734 358 2HB ASP 81 1HB ASP 81 -13.779 -0.396 -5.309 359 H ALA 82 H ALA 82 -12.020 -1.932 -4.099 360 HA ALA 82 HA ALA 82 -13.067 -1.408 -1.513 361 1HB ALA 82 1HB ALA 82 -13.593 -3.537 -1.838 362 2HB ALA 82 2HB ALA 82 -11.925 -3.929 -1.420 363 3HB ALA 82 3HB ALA 82 -12.384 -3.711 -3.110 364 H LEU 83 H LEU 83 -9.838 -2.052 -2.772 365 HA LEU 83 HA LEU 83 -8.524 -2.285 -0.276 366 1HB LEU 83 2HB LEU 83 -7.578 -2.947 -2.501 367 2HB LEU 83 1HB LEU 83 -7.398 -1.250 -2.881 368 HG LEU 83 HG LEU 83 -5.786 -0.963 -1.103 369 1HD1 LEU 83 1HD1 LEU 83 -4.994 -3.234 -0.042 370 2HD1 LEU 83 2HD1 LEU 83 -6.662 -3.705 -0.364 371 3HD1 LEU 83 3HD1 LEU 83 -6.322 -2.311 0.660 372 1HD2 LEU 83 1HD2 LEU 83 -4.185 -2.953 -1.923 373 2HD2 LEU 83 2HD2 LEU 83 -4.520 -1.516 -2.887 374 3HD2 LEU 83 3HD2 LEU 83 -5.408 -3.008 -3.194 375 H LEU 84 H LEU 84 -9.170 0.361 -2.477 376 HA LEU 84 HA LEU 84 -7.825 2.399 -1.113 377 1HB LEU 84 2HB LEU 84 -10.190 2.377 -2.966 378 2HB LEU 84 1HB LEU 84 -9.624 3.872 -2.245 379 HG LEU 84 HG LEU 84 -7.905 2.059 -3.937 380 1HD1 LEU 84 1HD1 LEU 84 -9.666 4.366 -4.636 381 2HD1 LEU 84 2HD1 LEU 84 -9.418 2.843 -5.489 382 3HD1 LEU 84 3HD1 LEU 84 -8.174 4.092 -5.535 383 1HD2 LEU 84 1HD2 LEU 84 -6.388 3.955 -3.996 384 2HD2 LEU 84 2HD2 LEU 84 -6.689 3.460 -2.329 385 3HD2 LEU 84 3HD2 LEU 84 -7.489 4.890 -2.985 386 H ALA 85 H ALA 85 -11.008 0.947 -0.639 387 HA ALA 85 HA ALA 85 -12.036 2.906 1.130 388 1HB ALA 85 1HB ALA 85 -13.366 1.112 0.024 389 2HB ALA 85 2HB ALA 85 -13.659 1.251 1.758 390 3HB ALA 85 3HB ALA 85 -12.638 -0.046 1.136 391 H ASP 86 H ASP 86 -10.260 -0.109 1.686 392 HA ASP 86 HA ASP 86 -10.167 0.195 4.525 393 1HB ASP 86 2HB ASP 86 -9.698 -1.886 2.797 394 2HB ASP 86 1HB ASP 86 -8.064 -1.453 3.294 395 H LEU 87 H LEU 87 -8.124 1.030 1.826 396 HA LEU 87 HA LEU 87 -5.783 1.696 3.236 397 1HB LEU 87 2HB LEU 87 -6.899 2.685 0.613 398 2HB LEU 87 1HB LEU 87 -5.333 3.181 1.213 399 HG LEU 87 HG LEU 87 -6.085 0.779 -0.215 400 1HD1 LEU 87 1HD1 LEU 87 -4.278 2.443 -0.732 401 2HD1 LEU 87 2HD1 LEU 87 -3.798 0.747 -0.800 402 3HD1 LEU 87 3HD1 LEU 87 -3.356 1.735 0.593 403 1HD2 LEU 87 1HD2 LEU 87 -4.361 0.321 2.213 404 2HD2 LEU 87 2HD2 LEU 87 -4.874 -0.865 1.013 405 3HD2 LEU 87 3HD2 LEU 87 -6.055 -0.158 2.111 406 H THR 88 H THR 88 -8.544 3.684 2.244 407 HA THR 88 HA THR 88 -7.590 6.122 3.234 408 HB THR 88 HB THR 88 -10.311 4.996 2.641 409 HG1 THR 88 1HG THR 88 -9.609 5.766 0.820 410 1HG2 THR 88 1HG2 THR 88 -10.815 7.649 2.904 411 2HG2 THR 88 2HG2 THR 88 -9.796 7.330 4.307 412 3HG2 THR 88 3HG2 THR 88 -11.276 6.402 4.061 413 H ARG 89 H ARG 89 -9.290 3.444 4.716 414 HA ARG 89 HA ARG 89 -9.807 4.693 7.207 415 1HB ARG 89 2HB ARG 89 -10.381 2.215 5.977 416 2HB ARG 89 1HB ARG 89 -9.543 1.846 7.479 417 1HG ARG 89 2HG ARG 89 -11.262 2.517 8.755 418 2HG ARG 89 1HG ARG 89 -11.647 3.881 7.702 419 1HD ARG 89 2HD ARG 89 -12.179 1.148 6.674 420 2HD ARG 89 1HD ARG 89 -13.244 1.768 7.935 421 HE ARG 89 HE ARG 89 -12.857 3.605 5.763 422 1HH1 ARG 89 1HH1 ARG 89 -14.712 0.870 6.886 423 2HH1 ARG 89 2HH1 ARG 89 -16.073 1.219 5.874 424 1HH2 ARG 89 1HH2 ARG 89 -14.645 4.066 4.433 425 2HH2 ARG 89 2HH2 ARG 89 -16.036 3.034 4.482 426 H SER 90 H SER 90 -7.192 2.514 6.091 427 HA SER 90 HA SER 90 -5.913 2.511 8.658 428 1HB SER 90 2HB SER 90 -5.748 0.849 6.555 429 2HB SER 90 1HB SER 90 -4.319 1.841 6.250 430 HG SER 90 HG SER 90 -4.924 0.346 8.581 431 H LEU 91 H LEU 91 -5.432 4.301 5.650 432 HA LEU 91 HA LEU 91 -3.151 5.678 6.786 433 1HB LEU 91 2HB LEU 91 -4.255 5.179 4.120 434 2HB LEU 91 1HB LEU 91 -3.624 6.788 4.336 435 HG LEU 91 HG LEU 91 -2.163 4.172 4.490 436 1HD1 LEU 91 1HD1 LEU 91 -2.439 6.228 2.554 437 2HD1 LEU 91 2HD1 LEU 91 -1.492 4.743 2.465 438 3HD1 LEU 91 3HD1 LEU 91 -0.767 6.212 3.113 439 1HD2 LEU 91 1HD2 LEU 91 -0.168 5.710 5.105 440 2HD2 LEU 91 2HD2 LEU 91 -1.258 5.152 6.377 441 3HD2 LEU 91 3HD2 LEU 91 -1.417 6.786 5.734 442 H SER 92 H SER 92 -6.414 6.010 6.963 443 HA SER 92 HA SER 92 -7.321 8.427 6.340 444 1HB SER 92 2HB SER 92 -8.390 8.459 8.725 445 2HB SER 92 1HB SER 92 -8.805 7.163 7.604 446 HG SER 92 HG SER 92 -7.698 6.968 10.013 447 H ASP 93 H ASP 93 -6.787 10.468 6.555 448 HA ASP 93 HA ASP 93 -5.493 11.475 8.935 449 1HB ASP 93 2HB ASP 93 -4.005 10.893 6.493 450 2HB ASP 93 1HB ASP 93 -3.858 12.580 6.970 451 H ASN 94 H ASN 94 -4.665 13.951 7.826 452 HA ASN 94 HA ASN 94 -6.789 15.090 6.278 453 1HB ASN 94 2HB ASN 94 -7.505 16.697 8.080 454 2HB ASN 94 1HB ASN 94 -8.013 15.031 8.335 455 1HD2 ASN 94 1HD2 ASN 94 -7.052 13.818 9.966 456 2HD2 ASN 94 2HD2 ASN 94 -6.151 14.554 11.244 457 H ILE 95 H ILE 95 -3.854 14.903 6.358 458 HA ILE 95 HA ILE 95 -3.268 17.767 6.161 459 HB ILE 95 HB ILE 95 -1.692 15.643 7.584 460 1HG1 ILE 95 2HG1 ILE 95 -1.465 18.189 8.783 461 2HG1 ILE 95 1HG1 ILE 95 -3.147 18.024 8.290 462 1HG2 ILE 95 1HG2 ILE 95 -0.104 16.492 6.025 463 2HG2 ILE 95 2HG2 ILE 95 0.245 17.207 7.600 464 3HG2 ILE 95 3HG2 ILE 95 -0.579 18.156 6.362 465 1HD1 ILE 95 1HD1 ILE 95 -3.562 16.367 9.774 466 2HD1 ILE 95 2HD1 ILE 95 -2.257 17.182 10.636 467 3HD1 ILE 95 3HD1 ILE 95 -1.919 15.730 9.694 468 H ASN 96 H ASN 96 -2.061 14.501 5.412 469 HA ASN 96 HA ASN 96 -0.862 15.485 2.942 470 1HB ASN 96 2HB ASN 96 -0.744 12.760 4.255 471 2HB ASN 96 1HB ASN 96 0.142 13.234 2.810 472 1HD2 ASN 96 1HD2 ASN 96 -0.307 14.006 6.218 473 2HD2 ASN 96 2HD2 ASN 96 1.296 14.595 6.482 474 H LEU 97 H LEU 97 -3.506 13.533 4.102 475 HA LEU 97 HA LEU 97 -4.385 13.135 1.321 476 1HB LEU 97 2HB LEU 97 -4.559 11.249 3.659 477 2HB LEU 97 1HB LEU 97 -5.572 11.073 2.239 478 HG LEU 97 HG LEU 97 -2.657 11.266 1.756 479 1HD1 LEU 97 1HD1 LEU 97 -2.873 8.601 2.148 480 2HD1 LEU 97 2HD1 LEU 97 -3.873 9.211 3.468 481 3HD1 LEU 97 3HD1 LEU 97 -2.191 9.725 3.323 482 1HD2 LEU 97 1HD2 LEU 97 -4.919 10.614 0.288 483 2HD2 LEU 97 2HD2 LEU 97 -4.108 9.073 0.558 484 3HD2 LEU 97 3HD2 LEU 97 -3.240 10.403 -0.207 485 HA PRO 98 HA PRO 98 -7.659 15.949 2.639 486 1HB PRO 98 2HB PRO 98 -8.863 14.442 0.339 487 2HB PRO 98 1HB PRO 98 -8.956 16.160 0.718 488 1HG PRO 98 2HG PRO 98 -7.259 15.292 -1.126 489 2HG PRO 98 1HG PRO 98 -6.779 16.570 0.006 490 1HD PRO 98 2HD PRO 98 -5.956 13.719 -0.087 491 2HD PRO 98 1HD PRO 98 -5.072 15.130 0.526 492 H GLN 99 H GLN 99 -9.007 12.941 1.309 493 HA GLN 99 HA GLN 99 -10.719 12.734 3.675 494 1HB GLN 99 2HB GLN 99 -10.871 11.616 0.892 495 2HB GLN 99 1HB GLN 99 -11.824 10.911 2.191 496 1HG GLN 99 2HG GLN 99 -13.099 12.834 2.470 497 2HG GLN 99 1HG GLN 99 -11.924 13.848 1.634 498 1HE2 GLN 99 1HE2 GLN 99 -11.473 12.677 -0.682 499 2HE2 GLN 99 2HE2 GLN 99 -12.919 12.502 -1.610 500 H GLY 100 H GLY 100 -8.136 11.080 2.015 501 1HA GLY 100 2HA GLY 100 -7.121 9.652 4.058 502 2HA GLY 100 1HA GLY 100 -8.467 8.643 3.549 503 H VAL 101 H VAL 101 -8.512 8.125 1.175 504 HA VAL 101 HA VAL 101 -6.072 8.218 -0.329 505 HB VAL 101 HB VAL 101 -6.929 5.526 0.775 506 1HG1 VAL 101 1HG1 VAL 101 -4.648 6.200 -1.081 507 2HG1 VAL 101 2HG1 VAL 101 -6.170 5.459 -1.571 508 3HG1 VAL 101 3HG1 VAL 101 -5.083 4.599 -0.483 509 1HG2 VAL 101 1HG2 VAL 101 -4.596 5.505 1.713 510 2HG2 VAL 101 2HG2 VAL 101 -5.704 6.644 2.477 511 3HG2 VAL 101 3HG2 VAL 101 -4.501 7.222 1.322 512 H ARG 102 H ARG 102 -6.962 8.663 -2.235 513 HA ARG 102 HA ARG 102 -9.395 7.236 -3.033 514 1HB ARG 102 2HB ARG 102 -8.434 9.945 -3.425 515 2HB ARG 102 1HB ARG 102 -8.912 9.196 -4.940 516 1HG ARG 102 2HG ARG 102 -10.614 9.441 -2.475 517 2HG ARG 102 1HG ARG 102 -10.765 10.395 -3.952 518 1HD ARG 102 2HD ARG 102 -11.457 7.538 -3.450 519 2HD ARG 102 1HD ARG 102 -12.376 8.786 -4.283 520 HE ARG 102 HE ARG 102 -9.942 7.662 -5.516 521 1HH1 ARG 102 1HH1 ARG 102 -13.399 8.228 -5.599 522 2HH1 ARG 102 2HH1 ARG 102 -13.557 7.729 -7.247 523 1HH2 ARG 102 1HH2 ARG 102 -10.170 7.005 -7.674 524 2HH2 ARG 102 2HH2 ARG 102 -11.731 7.035 -8.423 525 H TYR 103 H TYR 103 -6.072 7.832 -3.973 526 HA TYR 103 HA TYR 103 -6.361 5.676 -5.928 527 1HB TYR 103 2HB TYR 103 -4.751 8.073 -6.728 528 2HB TYR 103 1HB TYR 103 -5.417 6.792 -7.719 529 HD1 TYR 103 1HD TYR 103 -7.439 7.035 -8.810 530 HD2 TYR 103 2HD TYR 103 -6.390 9.777 -5.734 531 HE1 TYR 103 1HE TYR 103 -9.334 8.454 -9.445 532 HE2 TYR 103 2HE TYR 103 -8.295 11.207 -6.354 533 HH TYR 103 HH TYR 103 -10.056 10.768 -9.246 534 H ILE 104 H ILE 104 -4.316 4.818 -6.686 535 HA ILE 104 HA ILE 104 -2.141 5.168 -4.732 536 HB ILE 104 HB ILE 104 -2.990 2.582 -6.044 537 1HG1 ILE 104 2HG1 ILE 104 -3.349 3.674 -3.256 538 2HG1 ILE 104 1HG1 ILE 104 -4.589 3.090 -4.362 539 1HG2 ILE 104 1HG2 ILE 104 -0.923 2.951 -3.894 540 2HG2 ILE 104 2HG2 ILE 104 -0.526 2.903 -5.611 541 3HG2 ILE 104 3HG2 ILE 104 -1.267 1.503 -4.839 542 1HD1 ILE 104 1HD1 ILE 104 -2.589 1.492 -2.799 543 2HD1 ILE 104 2HD1 ILE 104 -3.509 0.811 -4.141 544 3HD1 ILE 104 3HD1 ILE 104 -4.350 1.430 -2.720 545 H TYR 105 H TYR 105 -0.317 5.830 -5.654 546 HA TYR 105 HA TYR 105 0.008 5.475 -8.536 547 1HB TYR 105 2HB TYR 105 0.504 7.668 -6.706 548 2HB TYR 105 1HB TYR 105 1.907 7.316 -7.714 549 HD1 TYR 105 1HD TYR 105 -1.367 8.772 -7.603 550 HD2 TYR 105 2HD TYR 105 1.618 7.220 -10.189 551 HE1 TYR 105 1HE TYR 105 -2.432 9.899 -9.492 552 HE2 TYR 105 2HE TYR 105 0.576 8.338 -12.088 553 HH TYR 105 HH TYR 105 -1.124 10.649 -12.170 554 H THR 106 H THR 106 2.224 5.327 -9.361 555 HA THR 106 HA THR 106 3.561 3.119 -8.124 556 HB THR 106 HB THR 106 5.330 3.852 -9.983 557 HG1 THR 106 1HG THR 106 4.033 5.822 -10.331 558 1HG2 THR 106 1HG2 THR 106 4.452 2.289 -11.369 559 2HG2 THR 106 2HG2 THR 106 2.797 2.858 -11.148 560 3HG2 THR 106 3HG2 THR 106 3.571 1.887 -9.895 561 H ILE 107 H ILE 107 5.762 3.057 -7.422 562 HA ILE 107 HA ILE 107 6.444 4.811 -5.449 563 HB ILE 107 HB ILE 107 7.508 2.589 -5.887 564 1HG1 ILE 107 2HG1 ILE 107 9.683 3.225 -4.946 565 2HG1 ILE 107 1HG1 ILE 107 9.404 4.899 -5.417 566 1HG2 ILE 107 1HG2 ILE 107 9.317 4.111 -7.750 567 2HG2 ILE 107 2HG2 ILE 107 8.008 3.057 -8.288 568 3HG2 ILE 107 3HG2 ILE 107 9.361 2.388 -7.374 569 1HD1 ILE 107 1HD1 ILE 107 8.053 5.294 -3.673 570 2HD1 ILE 107 2HD1 ILE 107 8.874 3.898 -2.975 571 3HD1 ILE 107 3HD1 ILE 107 7.304 3.700 -3.752 572 H ASP 108 H ASP 108 6.933 5.217 -8.868 573 HA ASP 108 HA ASP 108 8.667 7.533 -8.451 574 1HB ASP 108 2HB ASP 108 8.982 5.686 -10.273 575 2HB ASP 108 1HB ASP 108 7.744 6.586 -11.144 576 H GLY 109 H GLY 109 5.383 6.729 -9.164 577 1HA GLY 109 2HA GLY 109 3.561 8.178 -9.074 578 2HA GLY 109 1HA GLY 109 4.671 9.539 -9.096 579 H SER 110 H SER 110 5.299 7.238 -11.520 580 HA SER 110 HA SER 110 4.748 9.070 -13.602 581 1HB SER 110 2HB SER 110 5.661 6.241 -13.429 582 2HB SER 110 1HB SER 110 5.006 6.790 -14.971 583 HG SER 110 HG SER 110 6.534 8.623 -14.678 584 H ARG 111 H ARG 111 3.070 6.131 -12.511 585 HA ARG 111 HA ARG 111 0.621 7.145 -13.694 586 1HB ARG 111 2HB ARG 111 0.220 4.672 -14.473 587 2HB ARG 111 1HB ARG 111 1.118 5.788 -15.490 588 1HG ARG 111 2HG ARG 111 2.427 3.904 -15.578 589 2HG ARG 111 1HG ARG 111 3.198 4.809 -14.276 590 1HD ARG 111 2HD ARG 111 3.011 2.885 -13.132 591 2HD ARG 111 1HD ARG 111 1.339 3.393 -12.898 592 HE ARG 111 HE ARG 111 0.724 1.585 -14.128 593 1HH1 ARG 111 1HH1 ARG 111 3.946 2.500 -15.112 594 2HH1 ARG 111 2HH1 ARG 111 4.103 1.202 -16.248 595 1HH2 ARG 111 1HH2 ARG 111 0.930 -0.124 -15.619 596 2HH2 ARG 111 2HH2 ARG 111 2.391 -0.287 -16.536 597 H LYS 112 H LYS 112 -1.239 6.349 -12.759 598 HA LYS 112 HA LYS 112 -0.861 5.248 -10.094 599 1HB LYS 112 2HB LYS 112 -2.502 6.637 -9.499 600 2HB LYS 112 1HB LYS 112 -2.553 7.228 -11.149 601 1HG LYS 112 2HG LYS 112 -4.187 5.357 -11.632 602 2HG LYS 112 1HG LYS 112 -4.260 5.102 -9.887 603 1HD LYS 112 2HD LYS 112 -6.089 6.548 -10.695 604 2HD LYS 112 1HD LYS 112 -5.032 7.378 -9.554 605 1HE LYS 112 2HE LYS 112 -4.045 8.676 -11.218 606 2HE LYS 112 1HE LYS 112 -4.569 7.589 -12.505 607 1HZ LYS 112 1HZ LYS 112 -6.582 8.557 -12.622 608 2HZ LYS 112 2HZ LYS 112 -5.786 9.880 -11.933 609 3HZ LYS 112 3HZ LYS 112 -6.687 8.835 -10.956 610 H ILE 113 H ILE 113 -1.752 3.364 -9.365 611 HA ILE 113 HA ILE 113 -2.301 1.369 -11.360 612 HB ILE 113 HB ILE 113 -2.388 1.137 -8.351 613 1HG1 ILE 113 2HG1 ILE 113 -0.193 1.892 -9.547 614 2HG1 ILE 113 1HG1 ILE 113 -0.129 0.622 -8.331 615 1HG2 ILE 113 1HG2 ILE 113 -1.717 -1.311 -9.201 616 2HG2 ILE 113 2HG2 ILE 113 -2.718 -0.792 -10.557 617 3HG2 ILE 113 3HG2 ILE 113 -3.383 -0.804 -8.924 618 1HD1 ILE 113 1HD1 ILE 113 -0.561 -0.366 -11.040 619 2HD1 ILE 113 2HD1 ILE 113 0.573 -0.902 -9.800 620 3HD1 ILE 113 3HD1 ILE 113 0.966 0.487 -10.816 621 H GLY 114 H GLY 114 -4.178 0.288 -11.734 622 1HA GLY 114 2HA GLY 114 -6.592 1.309 -10.368 623 2HA GLY 114 1HA GLY 114 -6.549 0.967 -12.092 624 H SER 115 H SER 115 -4.824 -1.454 -11.490 625 HA SER 115 HA SER 115 -6.966 -3.196 -10.468 626 1HB SER 115 2HB SER 115 -6.232 -4.913 -12.072 627 2HB SER 115 1HB SER 115 -6.732 -3.438 -12.900 628 HG SER 115 HG SER 115 -4.452 -2.883 -12.945 629 H MET 116 H MET 116 -6.372 -4.964 -9.238 630 HA MET 116 HA MET 116 -4.135 -4.671 -7.573 631 1HB MET 116 2HB MET 116 -6.459 -6.133 -7.506 632 2HB MET 116 1HB MET 116 -5.241 -7.382 -7.719 633 1HG MET 116 2HG MET 116 -4.214 -6.914 -5.703 634 2HG MET 116 1HG MET 116 -4.894 -5.290 -5.618 635 1HE MET 116 1HE MET 116 -8.489 -5.770 -4.535 636 2HE MET 116 2HE MET 116 -7.434 -4.928 -5.671 637 3HE MET 116 3HE MET 116 -7.109 -4.846 -3.939 638 H ASP 117 H ASP 117 -4.584 -6.317 -10.588 639 HA ASP 117 HA ASP 117 -2.549 -8.207 -10.469 640 1HB ASP 117 2HB ASP 117 -4.253 -6.985 -12.477 641 2HB ASP 117 1HB ASP 117 -2.660 -7.356 -13.107 642 H GLU 118 H GLU 118 -2.361 -4.779 -10.644 643 HA GLU 118 HA GLU 118 0.298 -4.782 -11.812 644 1HB GLU 118 2HB GLU 118 -1.453 -2.563 -10.756 645 2HB GLU 118 1HB GLU 118 0.158 -2.306 -11.413 646 1HG GLU 118 2HG GLU 118 -1.908 -3.726 -13.033 647 2HG GLU 118 1HG GLU 118 -1.923 -1.967 -12.917 648 H LEU 119 H LEU 119 -1.088 -5.029 -8.707 649 HA LEU 119 HA LEU 119 1.140 -3.869 -7.286 650 1HB LEU 119 2HB LEU 119 -0.828 -5.646 -5.935 651 2HB LEU 119 1HB LEU 119 -0.068 -4.177 -5.356 652 HG LEU 119 HG LEU 119 -2.282 -4.298 -7.402 653 1HD1 LEU 119 1HD1 LEU 119 -2.486 -3.203 -4.621 654 2HD1 LEU 119 2HD1 LEU 119 -2.799 -4.905 -4.965 655 3HD1 LEU 119 3HD1 LEU 119 -3.776 -3.655 -5.734 656 1HD2 LEU 119 1HD2 LEU 119 -2.334 -1.925 -7.298 657 2HD2 LEU 119 2HD2 LEU 119 -0.662 -2.395 -7.607 658 3HD2 LEU 119 3HD2 LEU 119 -1.153 -1.893 -5.989 659 H GLU 120 H GLU 120 3.023 -4.906 -7.222 660 HA GLU 120 HA GLU 120 3.049 -7.835 -7.169 661 1HB GLU 120 2HB GLU 120 5.371 -5.945 -7.570 662 2HB GLU 120 1HB GLU 120 5.359 -7.678 -7.833 663 1HG GLU 120 2HG GLU 120 4.107 -7.511 -9.774 664 2HG GLU 120 1HG GLU 120 3.509 -5.904 -9.362 665 H GLU 121 H GLU 121 4.568 -8.913 -5.694 666 HA GLU 121 HA GLU 121 4.192 -8.198 -3.039 667 1HB GLU 121 2HB GLU 121 6.143 -10.032 -4.383 668 2HB GLU 121 1HB GLU 121 6.247 -9.736 -2.651 669 1HG GLU 121 2HG GLU 121 4.755 -11.342 -2.361 670 2HG GLU 121 1HG GLU 121 3.559 -10.299 -3.130 671 H GLY 122 H GLY 122 5.764 -7.634 -1.405 672 1HA GLY 122 2HA GLY 122 7.051 -5.929 -0.549 673 2HA GLY 122 1HA GLY 122 8.270 -6.691 -1.544 674 H GLU 123 H GLU 123 5.417 -4.863 -2.572 675 HA GLU 123 HA GLU 123 7.190 -3.127 -4.128 676 1HB GLU 123 2HB GLU 123 4.304 -3.867 -4.303 677 2HB GLU 123 1HB GLU 123 4.835 -2.346 -5.006 678 1HG GLU 123 2HG GLU 123 6.263 -4.880 -5.669 679 2HG GLU 123 1HG GLU 123 4.745 -4.476 -6.467 680 H SER 124 H SER 124 6.812 -0.830 -4.225 681 HA SER 124 HA SER 124 5.806 0.248 -1.673 682 1HB SER 124 2HB SER 124 8.180 0.926 -3.351 683 2HB SER 124 1HB SER 124 7.382 2.237 -2.485 684 HG SER 124 HG SER 124 7.577 0.755 -0.595 685 H TYR 125 H TYR 125 3.967 1.352 -1.862 686 HA TYR 125 HA TYR 125 3.434 2.731 -4.404 687 1HB TYR 125 2HB TYR 125 1.592 1.192 -2.636 688 2HB TYR 125 1HB TYR 125 0.972 2.440 -3.697 689 HD1 TYR 125 1HD TYR 125 1.534 -0.980 -3.491 690 HD2 TYR 125 2HD TYR 125 2.006 2.293 -6.149 691 HE1 TYR 125 1HE TYR 125 1.551 -2.534 -5.393 692 HE2 TYR 125 2HE TYR 125 2.025 0.777 -8.049 693 HH TYR 125 HH TYR 125 2.555 -2.431 -7.846 694 H VAL 126 H VAL 126 2.048 4.532 -4.340 695 HA VAL 126 HA VAL 126 2.255 6.052 -1.809 696 HB VAL 126 HB VAL 126 2.935 6.867 -4.577 697 1HG1 VAL 126 1HG1 VAL 126 1.171 8.390 -4.442 698 2HG1 VAL 126 2HG1 VAL 126 2.550 9.311 -3.835 699 3HG1 VAL 126 3HG1 VAL 126 1.383 8.626 -2.706 700 1HG2 VAL 126 1HG2 VAL 126 4.334 6.592 -2.302 701 2HG2 VAL 126 2HG2 VAL 126 3.922 8.305 -2.201 702 3HG2 VAL 126 3HG2 VAL 126 4.799 7.690 -3.603 703 H CYS 127 H CYS 127 0.489 7.100 -1.072 704 HA CYS 127 HA CYS 127 -2.025 6.548 -2.451 705 1HB CYS 127 2HB CYS 127 -1.303 7.311 0.360 706 2HB CYS 127 1HB CYS 127 -2.948 7.541 -0.223 707 HG CYS 127 HG CYS 127 -2.282 4.735 -0.791 708 H SER 128 H SER 128 -3.066 8.041 -3.574 709 HA SER 128 HA SER 128 -2.455 10.876 -3.064 710 1HB SER 128 2HB SER 128 -2.984 9.618 -5.768 711 2HB SER 128 1HB SER 128 -2.612 11.315 -5.459 712 HG SER 128 HG SER 128 -0.721 10.327 -6.053 713 H SER 129 H SER 129 -4.151 12.349 -3.975 714 HA SER 129 HA SER 129 -6.817 11.241 -4.220 715 1HB SER 129 2HB SER 129 -6.620 13.381 -2.164 716 2HB SER 129 1HB SER 129 -7.737 12.021 -2.271 717 HG SER 129 HG SER 129 -5.024 11.954 -1.445 718 H ASP 130 H ASP 130 -4.796 14.127 -3.941 719 HA ASP 130 HA ASP 130 -6.195 15.286 -6.221 720 1HB ASP 130 2HB ASP 130 -6.845 16.112 -3.674 721 2HB ASP 130 1HB ASP 130 -5.632 17.293 -4.162 722 H ASN 131 H ASN 131 -3.522 15.506 -3.915 723 HA ASN 131 HA ASN 131 -1.924 17.371 -5.191 724 1HB ASN 131 2HB ASN 131 -0.041 16.351 -4.011 725 2HB ASN 131 1HB ASN 131 -1.448 16.446 -2.956 726 1HD2 ASN 131 1HD2 ASN 131 -2.584 14.544 -2.457 727 2HD2 ASN 131 2HD2 ASN 131 -1.853 12.988 -2.628 728 H PHE 132 H PHE 132 -0.505 17.348 -6.869 729 HA PHE 132 HA PHE 132 -0.691 15.100 -8.700 730 1HB PHE 132 2HB PHE 132 0.796 17.703 -9.085 731 2HB PHE 132 1HB PHE 132 0.329 16.551 -10.331 732 HD1 PHE 132 1HD PHE 132 -1.810 16.621 -11.319 733 HD2 PHE 132 2HD PHE 132 -0.962 19.014 -7.904 734 HE1 PHE 132 1HE PHE 132 -3.919 17.843 -11.657 735 HE2 PHE 132 2HE PHE 132 -3.070 20.240 -8.235 736 HZ PHE 132 HZ PHE 132 -4.551 19.654 -10.113 737 H PHE 133 H PHE 133 0.611 14.131 -6.621 738 HA PHE 133 HA PHE 133 2.487 13.028 -5.974 739 1HB PHE 133 2HB PHE 133 2.448 12.461 -8.449 740 2HB PHE 133 1HB PHE 133 3.629 13.744 -8.668 741 HD1 PHE 133 1HD PHE 133 5.866 13.188 -8.623 742 HD2 PHE 133 2HD PHE 133 3.073 10.693 -6.605 743 HE1 PHE 133 1HE PHE 133 7.671 11.598 -8.097 744 HE2 PHE 133 2HE PHE 133 4.872 9.102 -6.071 745 HZ PHE 133 HZ PHE 133 7.175 9.554 -6.819 746 H LYS 134 H LYS 134 3.949 13.725 -4.554 747 HA LYS 134 HA LYS 134 5.102 16.390 -4.948 748 1HB LYS 134 2HB LYS 134 5.132 14.734 -2.428 749 2HB LYS 134 1HB LYS 134 5.488 16.450 -2.582 750 1HG LYS 134 2HG LYS 134 2.811 15.486 -3.433 751 2HG LYS 134 1HG LYS 134 3.160 15.596 -1.707 752 1HD LYS 134 2HD LYS 134 3.489 17.904 -1.797 753 2HD LYS 134 1HD LYS 134 3.743 17.893 -3.544 754 1HE LYS 134 2HE LYS 134 1.471 17.673 -3.995 755 2HE LYS 134 1HE LYS 134 1.110 17.073 -2.378 756 1HZ LYS 134 1HZ LYS 134 2.055 19.504 -1.823 757 2HZ LYS 134 2HZ LYS 134 0.415 19.171 -2.066 758 3HZ LYS 134 3HZ LYS 134 1.346 19.801 -3.330 759 H LYS 135 H LYS 135 5.975 13.363 -5.661 760 HA LYS 135 HA LYS 135 7.927 12.140 -5.706 761 1HB LYS 135 2HB LYS 135 9.712 13.397 -6.932 762 2HB LYS 135 1HB LYS 135 8.124 13.455 -7.681 763 1HG LYS 135 2HG LYS 135 8.835 15.663 -5.841 764 2HG LYS 135 1HG LYS 135 9.654 15.600 -7.400 765 1HD LYS 135 2HD LYS 135 7.525 15.589 -8.556 766 2HD LYS 135 1HD LYS 135 6.662 15.543 -7.018 767 1HE LYS 135 2HE LYS 135 6.679 17.761 -6.958 768 2HE LYS 135 1HE LYS 135 8.442 17.736 -6.911 769 1HZ LYS 135 1HZ LYS 135 7.791 19.049 -8.755 770 2HZ LYS 135 2HZ LYS 135 6.707 17.877 -9.312 771 3HZ LYS 135 3HZ LYS 135 8.372 17.589 -9.387 772 H VAL 136 H VAL 136 8.462 11.628 -3.600 773 HA VAL 136 HA VAL 136 10.581 13.301 -2.413 774 HB VAL 136 HB VAL 136 9.558 11.934 -0.255 775 1HG1 VAL 136 1HG1 VAL 136 8.760 14.095 0.493 776 2HG1 VAL 136 2HG1 VAL 136 8.821 14.710 -1.160 777 3HG1 VAL 136 3HG1 VAL 136 10.311 14.259 -0.330 778 1HG2 VAL 136 1HG2 VAL 136 7.255 12.815 -1.991 779 2HG2 VAL 136 2HG2 VAL 136 7.125 12.439 -0.272 780 3HG2 VAL 136 3HG2 VAL 136 7.595 11.182 -1.417 781 H GLU 137 H GLU 137 11.643 11.852 -0.533 782 HA GLU 137 HA GLU 137 12.842 9.654 -1.948 783 1HB GLU 137 2HB GLU 137 13.306 10.379 0.946 784 2HB GLU 137 1HB GLU 137 14.393 9.520 -0.137 785 1HG GLU 137 2HG GLU 137 14.320 11.732 -1.509 786 2HG GLU 137 1HG GLU 137 13.778 12.432 0.015 787 H TYR 138 H TYR 138 10.604 8.767 -2.062 788 HA TYR 138 HA TYR 138 9.265 7.541 0.021 789 1HB TYR 138 2HB TYR 138 9.575 6.936 -2.897 790 2HB TYR 138 1HB TYR 138 8.515 5.962 -1.870 791 HD1 TYR 138 1HD TYR 138 8.297 8.269 -4.262 792 HD2 TYR 138 2HD TYR 138 7.180 7.862 -0.178 793 HE1 TYR 138 1HE TYR 138 6.517 9.934 -4.588 794 HE2 TYR 138 2HE TYR 138 5.395 9.523 -0.493 795 HH TYR 138 HH TYR 138 4.076 10.331 -3.108 796 H THR 139 H THR 139 11.938 6.336 -1.950 797 HA THR 139 HA THR 139 12.475 4.298 0.070 798 HB THR 139 HB THR 139 12.748 2.549 -1.660 799 HG1 THR 139 1HG THR 139 12.955 3.385 -3.587 800 1HG2 THR 139 1HG2 THR 139 10.677 2.372 -0.604 801 2HG2 THR 139 2HG2 THR 139 10.301 2.352 -2.328 802 3HG2 THR 139 3HG2 THR 139 10.052 3.823 -1.388 803 H LYS 140 H LYS 140 13.645 6.565 -2.208 804 HA LYS 140 HA LYS 140 16.221 5.407 -2.629 805 1HB LYS 140 2HB LYS 140 16.830 7.600 -3.530 806 2HB LYS 140 1HB LYS 140 15.307 7.032 -4.199 807 1HG LYS 140 2HG LYS 140 14.213 8.810 -3.445 808 2HG LYS 140 1HG LYS 140 14.892 8.629 -1.828 809 1HD LYS 140 2HD LYS 140 15.704 10.699 -2.487 810 2HD LYS 140 1HD LYS 140 17.041 9.618 -2.886 811 1HE LYS 140 2HE LYS 140 16.678 9.782 -5.147 812 2HE LYS 140 1HE LYS 140 14.966 10.157 -4.953 813 1HZ LYS 140 1HZ LYS 140 16.297 12.062 -5.715 814 2HZ LYS 140 2HZ LYS 140 17.181 12.014 -4.274 815 3HZ LYS 140 3HZ LYS 140 15.527 12.362 -4.238 816 H ASN 141 H ASN 141 16.293 4.893 -0.279 817 HA ASN 141 HA ASN 141 18.362 5.740 1.053 818 1HB ASN 141 2HB ASN 141 17.575 7.514 2.683 819 2HB ASN 141 1HB ASN 141 17.832 8.077 1.036 820 1HD2 ASN 141 1HD2 ASN 141 16.369 9.670 2.492 821 2HD2 ASN 141 2HD2 ASN 141 14.686 9.549 2.120 822 H VAL 142 H VAL 142 15.058 4.900 1.137 823 HA VAL 142 HA VAL 142 15.080 3.988 3.897 824 HB VAL 142 HB VAL 142 12.926 3.464 1.856 825 1HG1 VAL 142 1HG1 VAL 142 11.483 3.424 3.862 826 2HG1 VAL 142 2HG1 VAL 142 12.916 3.643 4.867 827 3HG1 VAL 142 3HG1 VAL 142 12.735 2.182 3.894 828 1HG2 VAL 142 1HG2 VAL 142 12.013 5.592 3.305 829 2HG2 VAL 142 2HG2 VAL 142 12.700 5.688 1.683 830 3HG2 VAL 142 3HG2 VAL 142 13.717 5.997 3.092 831 H ASN 143 H ASN 143 15.090 1.878 4.569 832 HA ASN 143 HA ASN 143 16.284 -0.034 2.793 833 1HB ASN 143 2HB ASN 143 16.240 -1.536 4.760 834 2HB ASN 143 1HB ASN 143 16.956 0.030 5.135 835 1HD2 ASN 143 1HD2 ASN 143 14.868 -2.270 6.196 836 2HD2 ASN 143 2HD2 ASN 143 13.919 -1.321 7.283 837 HA PRO 144 HA PRO 144 12.236 -1.587 1.593 838 1HB PRO 144 2HB PRO 144 13.010 -2.989 -0.539 839 2HB PRO 144 1HB PRO 144 13.023 -1.221 -0.556 840 1HG PRO 144 2HG PRO 144 15.294 -3.130 -0.176 841 2HG PRO 144 1HG PRO 144 15.237 -1.633 -1.123 842 1HD PRO 144 2HD PRO 144 16.298 -1.844 1.423 843 2HD PRO 144 1HD PRO 144 15.718 -0.334 0.693 844 H ASN 145 H ASN 145 14.083 -2.978 3.607 845 HA ASN 145 HA ASN 145 13.653 -5.780 2.956 846 1HB ASN 145 2HB ASN 145 15.104 -4.368 5.185 847 2HB ASN 145 1HB ASN 145 14.805 -6.103 5.225 848 1HD2 ASN 145 1HD2 ASN 145 16.855 -6.812 5.017 849 2HD2 ASN 145 2HD2 ASN 145 17.843 -6.532 3.628 850 H TRP 146 H TRP 146 11.493 -3.711 3.782 851 HA TRP 146 HA TRP 146 10.484 -4.679 6.270 852 1HB TRP 146 2HB TRP 146 8.303 -3.526 5.284 853 2HB TRP 146 1HB TRP 146 9.641 -2.581 5.924 854 HD1 TRP 146 HD TRP 146 10.903 -0.998 4.278 855 HE1 TRP 146 1HE TRP 146 10.539 -0.326 1.821 856 HE3 TRP 146 3HE TRP 146 7.470 -4.555 2.957 857 HZ2 TRP 146 2HZ TRP 146 9.000 -1.186 -0.382 858 HZ3 TRP 146 3HZ TRP 146 6.600 -4.553 0.663 859 HH2 TRP 146 HH TRP 146 7.352 -2.907 -0.974 860 H SER 147 H SER 147 10.089 -5.588 2.936 861 HA SER 147 HA SER 147 7.795 -7.267 3.447 862 1HB SER 147 2HB SER 147 8.431 -6.042 1.234 863 2HB SER 147 1HB SER 147 9.475 -7.437 0.963 864 HG SER 147 HG SER 147 6.734 -7.702 1.607 865 H VAL 148 H VAL 148 11.201 -7.568 3.640 866 HA VAL 148 HA VAL 148 11.187 -10.462 3.359 867 HB VAL 148 HB VAL 148 13.504 -8.720 4.195 868 1HG1 VAL 148 1HG1 VAL 148 13.423 -11.449 2.911 869 2HG1 VAL 148 2HG1 VAL 148 13.721 -11.135 4.620 870 3HG1 VAL 148 3HG1 VAL 148 14.866 -10.566 3.406 871 1HG2 VAL 148 1HG2 VAL 148 12.932 -9.642 1.388 872 2HG2 VAL 148 2HG2 VAL 148 14.147 -8.484 1.934 873 3HG2 VAL 148 3HG2 VAL 148 12.437 -8.059 1.991 874 H ASN 149 H ASN 149 10.938 -8.102 5.846 875 HA ASN 149 HA ASN 149 11.740 -9.972 7.934 876 1HB ASN 149 2HB ASN 149 11.121 -7.043 7.844 877 2HB ASN 149 1HB ASN 149 11.023 -7.896 9.381 878 1HD2 ASN 149 1HD2 ASN 149 12.741 -6.670 10.189 879 2HD2 ASN 149 2HD2 ASN 149 14.375 -6.982 9.722 880 H VAL 150 H VAL 150 9.626 -11.016 6.677 881 HA VAL 150 HA VAL 150 7.256 -10.319 8.263 882 HB VAL 150 HB VAL 150 6.074 -11.874 6.634 883 1HG1 VAL 150 1HG1 VAL 150 6.523 -9.217 6.552 884 2HG1 VAL 150 2HG1 VAL 150 5.517 -10.080 5.388 885 3HG1 VAL 150 3HG1 VAL 150 7.194 -9.698 4.994 886 1HG2 VAL 150 1HG2 VAL 150 8.259 -12.928 5.889 887 2HG2 VAL 150 2HG2 VAL 150 8.524 -11.466 4.938 888 3HG2 VAL 150 3HG2 VAL 150 7.124 -12.488 4.612 Start of MODEL 4 1 1H GLY 38 1HT GLY 38 -19.508 -24.981 -0.235 2 2H GLY 38 2HT GLY 38 -18.654 -24.783 -1.682 3 3H GLY 38 3HT GLY 38 -19.370 -23.446 -0.934 4 1HA GLY 38 1HA GLY 38 -17.496 -24.908 0.717 5 2HA GLY 38 2HA GLY 38 -16.790 -24.105 -0.678 6 H ALA 39 H ALA 39 -15.959 -22.207 -0.147 7 HA ALA 39 HA ALA 39 -15.699 -20.130 0.747 8 1HB ALA 39 1HB ALA 39 -18.655 -20.260 1.326 9 2HB ALA 39 2HB ALA 39 -17.952 -19.776 -0.218 10 3HB ALA 39 3HB ALA 39 -17.654 -18.811 1.229 11 H MET 40 H MET 40 -14.964 -19.382 2.661 12 HA MET 40 HA MET 40 -16.108 -20.337 5.154 13 1HB MET 40 2HB MET 40 -13.220 -20.847 4.420 14 2HB MET 40 1HB MET 40 -13.913 -21.096 6.016 15 1HG MET 40 2HG MET 40 -15.574 -22.646 4.756 16 2HG MET 40 1HG MET 40 -14.332 -22.650 3.506 17 1HE MET 40 1HE MET 40 -14.027 -25.132 3.562 18 2HE MET 40 2HE MET 40 -15.182 -25.452 4.855 19 3HE MET 40 3HE MET 40 -13.545 -26.100 4.956 20 H ASP 41 H ASP 41 -14.678 -19.387 7.042 21 HA ASP 41 HA ASP 41 -14.613 -16.540 6.585 22 1HB ASP 41 2HB ASP 41 -14.164 -16.401 9.014 23 2HB ASP 41 1HB ASP 41 -15.578 -17.387 8.654 24 HA PRO 42 HA PRO 42 -10.221 -16.621 5.675 25 1HB PRO 42 2HB PRO 42 -9.893 -13.947 5.389 26 2HB PRO 42 1HB PRO 42 -10.647 -14.953 4.148 27 1HG PRO 42 2HG PRO 42 -11.936 -13.222 6.224 28 2HG PRO 42 1HG PRO 42 -12.340 -13.396 4.505 29 1HD PRO 42 2HD PRO 42 -13.731 -14.653 6.464 30 2HD PRO 42 1HD PRO 42 -13.507 -15.358 4.850 31 H GLU 43 H GLU 43 -9.281 -17.257 7.595 32 HA GLU 43 HA GLU 43 -8.136 -15.177 9.204 33 1HB GLU 43 2HB GLU 43 -10.503 -15.653 10.134 34 2HB GLU 43 1HB GLU 43 -9.811 -17.162 10.716 35 1HG GLU 43 2HG GLU 43 -8.681 -16.158 12.368 36 2HG GLU 43 1HG GLU 43 -8.256 -14.767 11.373 37 H PHE 44 H PHE 44 -8.890 -18.663 9.257 38 HA PHE 44 HA PHE 44 -6.279 -19.269 10.348 39 1HB PHE 44 2HB PHE 44 -8.816 -20.696 9.969 40 2HB PHE 44 1HB PHE 44 -7.387 -21.692 9.710 41 HD1 PHE 44 1HD PHE 44 -9.357 -19.831 12.144 42 HD2 PHE 44 2HD PHE 44 -5.832 -22.134 11.525 43 HE1 PHE 44 1HE PHE 44 -9.111 -20.100 14.576 44 HE2 PHE 44 2HE PHE 44 -5.580 -22.408 13.956 45 HZ PHE 44 HZ PHE 44 -7.221 -21.391 15.486 46 H ALA 45 H ALA 45 -6.970 -18.306 7.413 47 HA ALA 45 HA ALA 45 -5.952 -20.420 5.775 48 1HB ALA 45 1HB ALA 45 -6.068 -18.843 3.965 49 2HB ALA 45 2HB ALA 45 -6.213 -17.495 5.092 50 3HB ALA 45 3HB ALA 45 -7.517 -18.675 4.955 51 H LEU 46 H LEU 46 -3.941 -20.998 6.605 52 HA LEU 46 HA LEU 46 -1.866 -19.025 6.940 53 1HB LEU 46 2HB LEU 46 -2.185 -21.919 7.439 54 2HB LEU 46 1HB LEU 46 -0.555 -21.387 7.072 55 HG LEU 46 HG LEU 46 -0.995 -21.481 9.493 56 1HD1 LEU 46 1HD1 LEU 46 -0.730 -18.581 8.953 57 2HD1 LEU 46 2HD1 LEU 46 0.437 -19.661 8.189 58 3HD1 LEU 46 3HD1 LEU 46 0.264 -19.648 9.945 59 1HD2 LEU 46 1HD2 LEU 46 -3.172 -20.974 9.936 60 2HD2 LEU 46 2HD2 LEU 46 -3.246 -19.711 8.708 61 3HD2 LEU 46 3HD2 LEU 46 -2.445 -19.398 10.248 62 H SER 47 H SER 47 -2.555 -18.601 4.453 63 HA SER 47 HA SER 47 -1.941 -18.606 2.256 64 1HB SER 47 2HB SER 47 0.078 -17.662 3.400 65 2HB SER 47 1HB SER 47 0.785 -19.277 3.380 66 HG SER 47 HG SER 47 0.384 -19.152 1.017 67 H ASN 48 H ASN 48 -2.930 -20.287 1.243 68 HA ASN 48 HA ASN 48 -1.280 -22.532 0.517 69 1HB ASN 48 2HB ASN 48 -3.535 -22.815 2.437 70 2HB ASN 48 1HB ASN 48 -3.369 -24.056 1.199 71 1HD2 ASN 48 1HD2 ASN 48 -0.961 -24.740 0.930 72 2HD2 ASN 48 2HD2 ASN 48 -0.155 -25.128 2.407 73 H GLU 49 H GLU 49 -4.815 -22.197 0.621 74 HA GLU 49 HA GLU 49 -4.987 -22.766 -2.198 75 1HB GLU 49 2HB GLU 49 -7.412 -22.673 -1.853 76 2HB GLU 49 1HB GLU 49 -6.631 -23.703 -0.660 77 1HG GLU 49 2HG GLU 49 -7.072 -22.278 1.068 78 2HG GLU 49 1HG GLU 49 -7.113 -20.854 0.031 79 H LYS 50 H LYS 50 -4.031 -20.042 -0.843 80 HA LYS 50 HA LYS 50 -5.146 -18.410 -2.973 81 1HB LYS 50 2HB LYS 50 -5.692 -16.573 -1.364 82 2HB LYS 50 1HB LYS 50 -6.736 -17.981 -1.234 83 1HG LYS 50 2HG LYS 50 -6.327 -17.558 0.969 84 2HG LYS 50 1HG LYS 50 -5.023 -18.693 0.616 85 1HD LYS 50 2HD LYS 50 -3.577 -17.162 1.333 86 2HD LYS 50 1HD LYS 50 -4.025 -16.159 -0.047 87 1HE LYS 50 2HE LYS 50 -4.664 -14.656 1.482 88 2HE LYS 50 1HE LYS 50 -6.077 -15.690 1.699 89 1HZ LYS 50 1HZ LYS 50 -5.224 -15.350 3.832 90 2HZ LYS 50 2HZ LYS 50 -3.621 -15.581 3.344 91 3HZ LYS 50 3HZ LYS 50 -4.681 -16.897 3.413 92 H LYS 51 H LYS 51 -4.180 -16.003 -2.480 93 HA LYS 51 HA LYS 51 -1.490 -16.067 -1.450 94 1HB LYS 51 2HB LYS 51 -2.005 -15.811 -4.415 95 2HB LYS 51 1HB LYS 51 -0.501 -15.316 -3.649 96 1HG LYS 51 2HG LYS 51 -0.515 -17.762 -2.725 97 2HG LYS 51 1HG LYS 51 -1.597 -18.049 -4.090 98 1HD LYS 51 2HD LYS 51 1.012 -16.623 -4.470 99 2HD LYS 51 1HD LYS 51 0.947 -18.386 -4.417 100 1HE LYS 51 2HE LYS 51 -1.056 -17.879 -6.150 101 2HE LYS 51 1HE LYS 51 0.002 -16.508 -6.485 102 1HZ LYS 51 1HZ LYS 51 1.810 -18.364 -6.553 103 2HZ LYS 51 2HZ LYS 51 0.836 -18.075 -7.904 104 3HZ LYS 51 3HZ LYS 51 0.493 -19.374 -6.878 105 H ALA 52 H ALA 52 -0.382 -13.870 -2.015 106 HA ALA 52 HA ALA 52 -2.192 -11.675 -2.480 107 1HB ALA 52 1HB ALA 52 -2.447 -10.848 -0.395 108 2HB ALA 52 2HB ALA 52 -0.853 -11.390 0.132 109 3HB ALA 52 3HB ALA 52 -2.196 -12.531 0.070 110 H LYS 53 H LYS 53 -0.769 -9.592 -1.471 111 HA LYS 53 HA LYS 53 1.987 -9.895 -2.401 112 1HB LYS 53 2HB LYS 53 0.065 -7.812 -3.456 113 2HB LYS 53 1HB LYS 53 1.793 -7.845 -3.778 114 1HG LYS 53 2HG LYS 53 1.469 -9.189 -5.502 115 2HG LYS 53 1HG LYS 53 0.705 -10.385 -4.455 116 1HD LYS 53 2HD LYS 53 -1.408 -8.964 -4.666 117 2HD LYS 53 1HD LYS 53 -0.582 -8.150 -5.996 118 1HE LYS 53 2HE LYS 53 -0.782 -11.135 -5.933 119 2HE LYS 53 1HE LYS 53 -2.140 -10.164 -6.500 120 1HZ LYS 53 1HZ LYS 53 0.543 -10.458 -7.677 121 2HZ LYS 53 2HZ LYS 53 -0.364 -9.064 -7.985 122 3HZ LYS 53 3HZ LYS 53 -0.971 -10.581 -8.424 123 H LYS 54 H LYS 54 3.399 -8.776 -1.198 124 HA LYS 54 HA LYS 54 2.369 -7.111 0.939 125 1HB LYS 54 2HB LYS 54 4.820 -8.707 0.483 126 2HB LYS 54 1HB LYS 54 5.032 -7.222 1.402 127 1HG LYS 54 2HG LYS 54 2.873 -9.150 2.141 128 2HG LYS 54 1HG LYS 54 4.541 -9.434 2.645 129 1HD LYS 54 2HD LYS 54 3.909 -8.197 4.430 130 2HD LYS 54 1HD LYS 54 4.281 -6.852 3.349 131 1HE LYS 54 2HE LYS 54 2.087 -6.333 3.015 132 2HE LYS 54 1HE LYS 54 1.549 -7.999 3.223 133 1HZ LYS 54 1HZ LYS 54 2.622 -6.530 5.531 134 2HZ LYS 54 2HZ LYS 54 1.500 -7.794 5.494 135 3HZ LYS 54 3HZ LYS 54 1.032 -6.236 5.030 136 H VAL 55 H VAL 55 2.383 -5.018 0.792 137 HA VAL 55 HA VAL 55 4.388 -3.698 -0.915 138 HB VAL 55 HB VAL 55 2.701 -1.998 -1.531 139 1HG1 VAL 55 1HG1 VAL 55 3.231 -4.185 -2.844 140 2HG1 VAL 55 2HG1 VAL 55 1.903 -3.135 -3.342 141 3HG1 VAL 55 3HG1 VAL 55 1.570 -4.602 -2.419 142 1HG2 VAL 55 1HG2 VAL 55 0.901 -3.828 0.004 143 2HG2 VAL 55 2HG2 VAL 55 0.274 -2.781 -1.268 144 3HG2 VAL 55 3HG2 VAL 55 1.087 -2.077 0.134 145 H ARG 56 H ARG 56 4.968 -1.611 -0.350 146 HA ARG 56 HA ARG 56 4.390 -0.877 2.435 147 1HB ARG 56 2HB ARG 56 6.838 -1.157 1.181 148 2HB ARG 56 1HB ARG 56 6.551 0.572 1.068 149 1HG ARG 56 2HG ARG 56 6.140 -0.760 3.692 150 2HG ARG 56 1HG ARG 56 7.789 -0.481 3.130 151 1HD ARG 56 2HD ARG 56 6.646 1.927 2.623 152 2HD ARG 56 1HD ARG 56 5.754 1.426 4.059 153 HE ARG 56 HE ARG 56 8.526 2.185 3.908 154 1HH1 ARG 56 1HH1 ARG 56 6.125 0.429 5.733 155 2HH1 ARG 56 2HH1 ARG 56 7.008 0.517 7.220 156 1HH2 ARG 56 1HH2 ARG 56 9.690 2.302 5.863 157 2HH2 ARG 56 2HH2 ARG 56 9.032 1.580 7.294 158 H PHE 57 H PHE 57 2.702 0.490 2.423 159 HA PHE 57 HA PHE 57 2.293 2.233 0.151 160 1HB PHE 57 2HB PHE 57 0.664 1.563 2.582 161 2HB PHE 57 1HB PHE 57 0.211 2.885 1.515 162 HD1 PHE 57 1HD PHE 57 -1.676 0.793 1.958 163 HD2 PHE 57 2HD PHE 57 1.545 0.897 -0.831 164 HE1 PHE 57 1HE PHE 57 -2.873 -0.789 0.507 165 HE2 PHE 57 2HE PHE 57 0.345 -0.670 -2.277 166 HZ PHE 57 HZ PHE 57 -1.866 -1.521 -1.614 167 H TYR 58 H TYR 58 2.716 4.250 0.000 168 HA TYR 58 HA TYR 58 3.548 5.782 2.369 169 1HB TYR 58 2HB TYR 58 4.395 6.273 -0.477 170 2HB TYR 58 1HB TYR 58 4.987 7.091 0.949 171 HD1 TYR 58 1HD TYR 58 4.738 3.611 -0.406 172 HD2 TYR 58 2HD TYR 58 7.025 6.439 1.797 173 HE1 TYR 58 1HE TYR 58 6.562 1.977 -0.218 174 HE2 TYR 58 2HE TYR 58 8.856 4.811 1.997 175 HH TYR 58 HH TYR 58 9.669 2.835 1.180 176 H ARG 59 H ARG 59 2.846 7.893 2.539 177 HA ARG 59 HA ARG 59 0.423 8.473 1.000 178 1HB ARG 59 2HB ARG 59 1.449 9.962 3.419 179 2HB ARG 59 1HB ARG 59 -0.173 10.003 2.744 180 1HG ARG 59 2HG ARG 59 -0.793 8.337 4.057 181 2HG ARG 59 1HG ARG 59 0.475 7.306 3.392 182 1HD ARG 59 2HD ARG 59 0.667 7.515 5.816 183 2HD ARG 59 1HD ARG 59 2.067 8.198 4.998 184 HE ARG 59 HE ARG 59 0.824 10.407 5.332 185 1HH1 ARG 59 1HH1 ARG 59 0.656 7.738 7.603 186 2HH1 ARG 59 2HH1 ARG 59 0.346 8.765 8.957 187 1HH2 ARG 59 1HH2 ARG 59 0.422 11.732 7.127 188 2HH2 ARG 59 2HH2 ARG 59 0.216 11.020 8.693 189 H ASN 60 H ASN 60 0.609 9.723 -0.698 190 HA ASN 60 HA ASN 60 2.756 10.980 -1.713 191 1HB ASN 60 2HB ASN 60 0.655 10.747 -2.920 192 2HB ASN 60 1HB ASN 60 -0.098 11.950 -1.882 193 1HD2 ASN 60 1HD2 ASN 60 -0.395 12.552 -4.341 194 2HD2 ASN 60 2HD2 ASN 60 0.715 13.748 -4.903 195 H GLY 61 H GLY 61 4.128 12.359 -0.852 196 1HA GLY 61 2HA GLY 61 4.936 14.325 0.035 197 2HA GLY 61 1HA GLY 61 3.295 14.954 0.007 198 H ASP 62 H ASP 62 5.615 13.067 1.854 199 HA ASP 62 HA ASP 62 4.294 13.927 4.304 200 1HB ASP 62 2HB ASP 62 4.483 11.601 5.254 201 2HB ASP 62 1HB ASP 62 3.259 11.788 4.002 202 H ARG 63 H ARG 63 6.971 11.985 2.990 203 HA ARG 63 HA ARG 63 9.121 11.685 3.729 204 1HB ARG 63 2HB ARG 63 9.127 14.659 4.141 205 2HB ARG 63 1HB ARG 63 10.414 13.631 3.526 206 1HG ARG 63 2HG ARG 63 9.781 14.423 1.538 207 2HG ARG 63 1HG ARG 63 8.496 13.221 1.661 208 1HD ARG 63 2HD ARG 63 6.915 14.789 1.841 209 2HD ARG 63 1HD ARG 63 7.843 15.702 3.030 210 HE ARG 63 HE ARG 63 9.043 16.136 0.569 211 1HH1 ARG 63 1HH1 ARG 63 5.954 16.749 2.074 212 2HH1 ARG 63 2HH1 ARG 63 5.637 18.168 1.133 213 1HH2 ARG 63 1HH2 ARG 63 8.628 18.002 -0.669 214 2HH2 ARG 63 2HH2 ARG 63 7.153 18.879 -0.424 215 H TYR 64 H TYR 64 7.160 11.507 5.893 216 HA TYR 64 HA TYR 64 9.002 11.954 8.101 217 1HB TYR 64 2HB TYR 64 6.551 13.498 7.660 218 2HB TYR 64 1HB TYR 64 6.642 12.763 9.256 219 HD1 TYR 64 1HD TYR 64 7.978 13.717 10.937 220 HD2 TYR 64 2HD TYR 64 8.492 14.956 6.900 221 HE1 TYR 64 1HE TYR 64 9.459 15.529 11.689 222 HE2 TYR 64 2HE TYR 64 9.976 16.772 7.640 223 HH TYR 64 HH TYR 64 10.109 18.001 10.470 224 H PHE 65 H PHE 65 5.688 10.902 7.315 225 HA PHE 65 HA PHE 65 5.633 8.977 9.435 226 1HB PHE 65 2HB PHE 65 3.539 9.895 8.835 227 2HB PHE 65 1HB PHE 65 3.803 9.590 7.122 228 HD1 PHE 65 1HD PHE 65 3.433 7.401 6.176 229 HD2 PHE 65 2HD PHE 65 2.821 8.126 10.325 230 HE1 PHE 65 1HE PHE 65 2.197 5.282 6.358 231 HE2 PHE 65 2HE PHE 65 1.587 6.005 10.517 232 HZ PHE 65 HZ PHE 65 1.274 4.580 8.531 233 H LYS 66 H LYS 66 6.957 8.977 6.310 234 HA LYS 66 HA LYS 66 8.054 7.380 5.120 235 1HB LYS 66 2HB LYS 66 7.438 5.491 7.398 236 2HB LYS 66 1HB LYS 66 8.663 5.283 6.155 237 1HG LYS 66 2HG LYS 66 8.710 7.611 8.043 238 2HG LYS 66 1HG LYS 66 9.433 6.055 8.454 239 1HD LYS 66 2HD LYS 66 10.488 6.440 6.001 240 2HD LYS 66 1HD LYS 66 10.319 8.114 6.536 241 1HE LYS 66 2HE LYS 66 11.461 7.343 8.693 242 2HE LYS 66 1HE LYS 66 11.901 5.893 7.793 243 1HZ LYS 66 1HZ LYS 66 13.702 7.159 7.336 244 2HZ LYS 66 2HZ LYS 66 12.878 8.625 7.505 245 3HZ LYS 66 3HZ LYS 66 12.712 7.723 6.085 246 H GLY 67 H GLY 67 5.553 5.455 6.796 247 1HA GLY 67 2HA GLY 67 3.540 5.352 5.036 248 2HA GLY 67 1HA GLY 67 4.735 4.342 4.240 249 H ILE 68 H ILE 68 2.431 3.160 4.781 250 HA ILE 68 HA ILE 68 3.021 1.469 7.119 251 HB ILE 68 HB ILE 68 1.033 2.774 7.599 252 1HG1 ILE 68 2HG1 ILE 68 0.097 0.001 6.866 253 2HG1 ILE 68 1HG1 ILE 68 1.192 0.302 8.210 254 1HG2 ILE 68 1HG2 ILE 68 -0.635 3.224 6.161 255 2HG2 ILE 68 2HG2 ILE 68 -0.645 1.585 5.505 256 3HG2 ILE 68 3HG2 ILE 68 0.543 2.755 4.934 257 1HD1 ILE 68 1HD1 ILE 68 -1.471 1.658 7.985 258 2HD1 ILE 68 2HD1 ILE 68 -0.434 1.498 9.403 259 3HD1 ILE 68 3HD1 ILE 68 -1.267 0.085 8.754 260 H VAL 69 H VAL 69 2.945 -0.716 6.827 261 HA VAL 69 HA VAL 69 2.914 -1.647 4.082 262 HB VAL 69 HB VAL 69 3.410 -3.253 6.593 263 1HG1 VAL 69 1HG1 VAL 69 4.169 -3.799 3.724 264 2HG1 VAL 69 2HG1 VAL 69 2.835 -4.564 4.588 265 3HG1 VAL 69 3HG1 VAL 69 4.497 -4.836 5.113 266 1HG2 VAL 69 1HG2 VAL 69 5.558 -2.577 6.653 267 2HG2 VAL 69 2HG2 VAL 69 4.935 -1.159 5.810 268 3HG2 VAL 69 3HG2 VAL 69 5.683 -2.469 4.898 269 H TYR 70 H TYR 70 1.379 -2.855 3.133 270 HA TYR 70 HA TYR 70 -0.735 -4.018 4.763 271 1HB TYR 70 2HB TYR 70 -1.028 -1.791 2.907 272 2HB TYR 70 1HB TYR 70 -2.067 -3.146 2.485 273 HD1 TYR 70 1HD TYR 70 -1.033 -1.368 5.621 274 HD2 TYR 70 2HD TYR 70 -4.192 -3.046 3.315 275 HE1 TYR 70 1HE TYR 70 -2.648 -0.693 7.351 276 HE2 TYR 70 2HE TYR 70 -5.815 -2.375 5.036 277 HH TYR 70 HH TYR 70 -6.074 -0.899 6.850 278 H ALA 71 H ALA 71 -1.852 -5.683 3.793 279 HA ALA 71 HA ALA 71 -0.398 -7.054 1.645 280 1HB ALA 71 1HB ALA 71 -2.473 -8.522 3.143 281 2HB ALA 71 2HB ALA 71 -1.067 -8.020 4.080 282 3HB ALA 71 3HB ALA 71 -0.858 -9.030 2.649 283 H VAL 72 H VAL 72 -1.542 -7.831 -0.178 284 HA VAL 72 HA VAL 72 -4.364 -7.084 -0.349 285 HB VAL 72 HB VAL 72 -2.668 -6.468 -2.719 286 1HG1 VAL 72 1HG1 VAL 72 -5.041 -6.318 -2.984 287 2HG1 VAL 72 2HG1 VAL 72 -4.392 -4.678 -2.961 288 3HG1 VAL 72 3HG1 VAL 72 -5.192 -5.331 -1.531 289 1HG2 VAL 72 1HG2 VAL 72 -2.508 -4.087 -1.793 290 2HG2 VAL 72 2HG2 VAL 72 -1.385 -5.284 -1.150 291 3HG2 VAL 72 3HG2 VAL 72 -2.804 -4.814 -0.213 292 H SER 73 H SER 73 -5.583 -8.469 -1.386 293 HA SER 73 HA SER 73 -4.565 -10.273 -3.395 294 1HB SER 73 2HB SER 73 -3.941 -11.647 -1.582 295 2HB SER 73 1HB SER 73 -5.383 -11.232 -0.657 296 HG SER 73 HG SER 73 -5.148 -13.358 -1.976 297 H SER 74 H SER 74 -6.427 -11.855 -4.033 298 HA SER 74 HA SER 74 -8.698 -10.221 -4.644 299 1HB SER 74 2HB SER 74 -8.009 -13.098 -5.249 300 2HB SER 74 1HB SER 74 -9.527 -12.356 -5.756 301 HG SER 74 HG SER 74 -7.290 -12.285 -7.050 302 H ASP 75 H ASP 75 -7.936 -12.505 -2.176 303 HA ASP 75 HA ASP 75 -10.670 -13.128 -1.533 304 1HB ASP 75 2HB ASP 75 -8.018 -14.053 -0.787 305 2HB ASP 75 1HB ASP 75 -9.073 -13.891 0.605 306 H ARG 76 H ARG 76 -8.277 -10.796 -0.575 307 HA ARG 76 HA ARG 76 -9.800 -10.015 1.786 308 1HB ARG 76 2HB ARG 76 -7.071 -9.505 0.758 309 2HB ARG 76 1HB ARG 76 -7.809 -8.200 1.677 310 1HG ARG 76 2HG ARG 76 -8.164 -9.710 3.555 311 2HG ARG 76 1HG ARG 76 -7.449 -11.033 2.633 312 1HD ARG 76 2HD ARG 76 -5.559 -10.413 3.685 313 2HD ARG 76 1HD ARG 76 -5.497 -9.179 2.427 314 HE ARG 76 HE ARG 76 -5.955 -7.583 4.009 315 1HH1 ARG 76 1HH1 ARG 76 -6.597 -10.739 5.354 316 2HH1 ARG 76 2HH1 ARG 76 -6.823 -10.145 6.964 317 1HH2 ARG 76 1HH2 ARG 76 -6.253 -6.799 6.127 318 2HH2 ARG 76 2HH2 ARG 76 -6.629 -7.908 7.403 319 H PHE 77 H PHE 77 -8.878 -8.754 -1.379 320 HA PHE 77 HA PHE 77 -10.951 -6.692 -1.078 321 1HB PHE 77 2HB PHE 77 -8.310 -6.239 -2.471 322 2HB PHE 77 1HB PHE 77 -9.566 -5.047 -2.150 323 HD1 PHE 77 1HD PHE 77 -9.886 -4.145 0.082 324 HD2 PHE 77 2HD PHE 77 -6.796 -6.952 -0.744 325 HE1 PHE 77 1HE PHE 77 -8.805 -3.576 2.217 326 HE2 PHE 77 2HE PHE 77 -5.709 -6.388 1.390 327 HZ PHE 77 HZ PHE 77 -6.713 -4.698 2.874 328 H ARG 78 H ARG 78 -12.451 -6.872 -2.574 329 HA ARG 78 HA ARG 78 -12.288 -8.666 -4.729 330 1HB ARG 78 2HB ARG 78 -14.219 -6.835 -3.555 331 2HB ARG 78 1HB ARG 78 -14.346 -6.901 -5.300 332 1HG ARG 78 2HG ARG 78 -14.944 -9.129 -5.309 333 2HG ARG 78 1HG ARG 78 -14.215 -9.430 -3.730 334 1HD ARG 78 2HD ARG 78 -15.971 -8.141 -2.653 335 2HD ARG 78 1HD ARG 78 -16.681 -7.767 -4.222 336 HE ARG 78 HE ARG 78 -16.485 -10.569 -3.857 337 1HH1 ARG 78 1HH1 ARG 78 -18.341 -7.791 -2.851 338 2HH1 ARG 78 2HH1 ARG 78 -19.776 -8.707 -2.533 339 1HH2 ARG 78 1HH2 ARG 78 -18.372 -11.777 -3.440 340 2HH2 ARG 78 2HH2 ARG 78 -19.795 -10.969 -2.869 341 H SER 79 H SER 79 -11.532 -5.288 -4.384 342 HA SER 79 HA SER 79 -10.239 -5.236 -6.936 343 1HB SER 79 2HB SER 79 -12.532 -3.299 -6.667 344 2HB SER 79 1HB SER 79 -11.589 -3.690 -8.105 345 HG SER 79 HG SER 79 -12.589 -5.677 -8.201 346 H PHE 80 H PHE 80 -9.659 -2.796 -7.451 347 HA PHE 80 HA PHE 80 -7.981 -1.910 -5.390 348 1HB PHE 80 2HB PHE 80 -8.268 -1.354 -8.070 349 2HB PHE 80 1HB PHE 80 -8.761 0.160 -7.320 350 HD1 PHE 80 1HD PHE 80 -6.149 -2.327 -6.376 351 HD2 PHE 80 2HD PHE 80 -7.032 1.660 -7.566 352 HE1 PHE 80 1HE PHE 80 -3.787 -1.718 -6.073 353 HE2 PHE 80 2HE PHE 80 -4.673 2.278 -7.270 354 HZ PHE 80 HZ PHE 80 -3.045 0.587 -6.521 355 H ASP 81 H ASP 81 -11.257 -1.018 -6.269 356 HA ASP 81 HA ASP 81 -11.473 1.352 -4.780 357 1HB ASP 81 2HB ASP 81 -13.663 -0.659 -5.344 358 2HB ASP 81 1HB ASP 81 -13.880 1.040 -4.935 359 H ALA 82 H ALA 82 -11.974 -2.027 -3.910 360 HA ALA 82 HA ALA 82 -12.940 -1.532 -1.286 361 1HB ALA 82 1HB ALA 82 -12.259 -3.818 -2.913 362 2HB ALA 82 2HB ALA 82 -13.433 -3.672 -1.603 363 3HB ALA 82 3HB ALA 82 -11.744 -4.027 -1.239 364 H LEU 83 H LEU 83 -9.746 -2.157 -2.655 365 HA LEU 83 HA LEU 83 -8.350 -2.320 -0.198 366 1HB LEU 83 2HB LEU 83 -7.475 -3.049 -2.429 367 2HB LEU 83 1HB LEU 83 -7.315 -1.363 -2.870 368 HG LEU 83 HG LEU 83 -5.715 -1.057 -0.999 369 1HD1 LEU 83 1HD1 LEU 83 -6.400 -3.907 -0.561 370 2HD1 LEU 83 2HD1 LEU 83 -6.032 -2.636 0.604 371 3HD1 LEU 83 3HD1 LEU 83 -4.728 -3.414 -0.294 372 1HD2 LEU 83 1HD2 LEU 83 -4.430 -1.288 -2.821 373 2HD2 LEU 83 2HD2 LEU 83 -5.289 -2.727 -3.372 374 3HD2 LEU 83 3HD2 LEU 83 -4.042 -2.865 -2.133 375 H LEU 84 H LEU 84 -8.990 0.275 -2.482 376 HA LEU 84 HA LEU 84 -7.645 2.332 -1.142 377 1HB LEU 84 2HB LEU 84 -9.901 2.229 -3.105 378 2HB LEU 84 1HB LEU 84 -9.504 3.758 -2.338 379 HG LEU 84 HG LEU 84 -7.507 2.098 -3.871 380 1HD1 LEU 84 1HD1 LEU 84 -7.839 4.061 -5.535 381 2HD1 LEU 84 2HD1 LEU 84 -9.414 4.217 -4.760 382 3HD1 LEU 84 3HD1 LEU 84 -8.969 2.706 -5.551 383 1HD2 LEU 84 1HD2 LEU 84 -7.470 4.946 -2.889 384 2HD2 LEU 84 2HD2 LEU 84 -6.217 4.181 -3.865 385 3HD2 LEU 84 3HD2 LEU 84 -6.535 3.604 -2.227 386 H ALA 85 H ALA 85 -10.815 0.880 -0.675 387 HA ALA 85 HA ALA 85 -11.910 2.878 1.007 388 1HB ALA 85 1HB ALA 85 -13.169 1.011 -0.081 389 2HB ALA 85 2HB ALA 85 -13.529 1.231 1.632 390 3HB ALA 85 3HB ALA 85 -12.467 -0.079 1.115 391 H ASP 86 H ASP 86 -10.085 -0.079 1.698 392 HA ASP 86 HA ASP 86 -10.098 0.283 4.527 393 1HB ASP 86 2HB ASP 86 -8.667 -1.526 2.616 394 2HB ASP 86 1HB ASP 86 -8.087 -1.402 4.274 395 H LEU 87 H LEU 87 -7.992 1.164 1.890 396 HA LEU 87 HA LEU 87 -5.731 1.938 3.380 397 1HB LEU 87 2HB LEU 87 -6.788 2.874 0.710 398 2HB LEU 87 1HB LEU 87 -5.252 3.404 1.357 399 HG LEU 87 HG LEU 87 -5.936 0.945 -0.042 400 1HD1 LEU 87 1HD1 LEU 87 -3.212 1.946 0.706 401 2HD1 LEU 87 2HD1 LEU 87 -4.178 2.721 -0.550 402 3HD1 LEU 87 3HD1 LEU 87 -3.706 1.030 -0.718 403 1HD2 LEU 87 1HD2 LEU 87 -4.632 -0.603 1.226 404 2HD2 LEU 87 2HD2 LEU 87 -5.853 0.072 2.300 405 3HD2 LEU 87 3HD2 LEU 87 -4.186 0.639 2.393 406 H THR 88 H THR 88 -8.712 3.573 2.603 407 HA THR 88 HA THR 88 -8.014 6.187 3.322 408 HB THR 88 HB THR 88 -10.730 5.098 3.948 409 HG1 THR 88 1HG THR 88 -11.141 4.556 1.961 410 1HG2 THR 88 1HG2 THR 88 -9.948 7.508 2.345 411 2HG2 THR 88 2HG2 THR 88 -10.246 7.531 4.082 412 3HG2 THR 88 3HG2 THR 88 -11.544 7.097 2.968 413 H ARG 89 H ARG 89 -9.345 3.503 5.193 414 HA ARG 89 HA ARG 89 -9.490 4.893 7.652 415 1HB ARG 89 2HB ARG 89 -10.231 2.356 6.655 416 2HB ARG 89 1HB ARG 89 -9.215 2.071 8.061 417 1HG ARG 89 2HG ARG 89 -10.756 2.850 9.494 418 2HG ARG 89 1HG ARG 89 -11.264 4.145 8.409 419 1HD ARG 89 2HD ARG 89 -13.128 2.917 8.168 420 2HD ARG 89 1HD ARG 89 -12.144 1.951 7.070 421 HE ARG 89 HE ARG 89 -11.667 0.816 9.474 422 1HH1 ARG 89 1HH1 ARG 89 -14.599 1.625 7.764 423 2HH1 ARG 89 2HH1 ARG 89 -15.513 0.331 8.464 424 1HH2 ARG 89 1HH2 ARG 89 -12.867 -0.887 10.395 425 2HH2 ARG 89 2HH2 ARG 89 -14.530 -1.094 9.959 426 H SER 90 H SER 90 -7.024 2.649 6.325 427 HA SER 90 HA SER 90 -5.486 2.737 8.740 428 1HB SER 90 2HB SER 90 -5.571 1.018 6.649 429 2HB SER 90 1HB SER 90 -4.105 1.924 6.267 430 HG SER 90 HG SER 90 -4.559 0.091 8.237 431 H LEU 91 H LEU 91 -5.222 4.393 5.610 432 HA LEU 91 HA LEU 91 -2.836 5.743 6.557 433 1HB LEU 91 2HB LEU 91 -4.001 5.049 3.972 434 2HB LEU 91 1HB LEU 91 -3.318 6.653 4.030 435 HG LEU 91 HG LEU 91 -1.930 4.022 4.434 436 1HD1 LEU 91 1HD1 LEU 91 -1.623 4.418 2.254 437 2HD1 LEU 91 2HD1 LEU 91 -0.376 5.529 2.819 438 3HD1 LEU 91 3HD1 LEU 91 -1.979 6.138 2.406 439 1HD2 LEU 91 1HD2 LEU 91 -1.101 6.733 5.379 440 2HD2 LEU 91 2HD2 LEU 91 0.113 5.570 4.845 441 3HD2 LEU 91 3HD2 LEU 91 -0.962 5.171 6.186 442 H SER 92 H SER 92 -6.075 6.279 6.795 443 HA SER 92 HA SER 92 -6.753 8.740 5.948 444 1HB SER 92 2HB SER 92 -7.708 8.904 8.503 445 2HB SER 92 1HB SER 92 -8.477 7.995 7.203 446 HG SER 92 HG SER 92 -6.614 6.967 9.082 447 H ASP 93 H ASP 93 -6.043 10.735 6.092 448 HA ASP 93 HA ASP 93 -4.715 11.728 8.468 449 1HB ASP 93 2HB ASP 93 -3.318 11.794 5.792 450 2HB ASP 93 1HB ASP 93 -2.742 12.548 7.268 451 H ASN 94 H ASN 94 -5.697 13.587 8.845 452 HA ASN 94 HA ASN 94 -7.216 14.958 6.870 453 1HB ASN 94 2HB ASN 94 -6.404 16.047 9.564 454 2HB ASN 94 1HB ASN 94 -7.810 16.492 8.601 455 1HD2 ASN 94 1HD2 ASN 94 -9.200 14.488 8.031 456 2HD2 ASN 94 2HD2 ASN 94 -9.570 13.456 9.366 457 H ILE 95 H ILE 95 -3.914 15.006 7.538 458 HA ILE 95 HA ILE 95 -3.648 17.693 6.371 459 HB ILE 95 HB ILE 95 -1.958 16.221 8.369 460 1HG1 ILE 95 2HG1 ILE 95 -2.054 18.812 9.147 461 2HG1 ILE 95 1HG1 ILE 95 -3.570 18.699 8.259 462 1HG2 ILE 95 1HG2 ILE 95 -1.079 18.481 6.591 463 2HG2 ILE 95 2HG2 ILE 95 -0.350 16.883 6.754 464 3HG2 ILE 95 3HG2 ILE 95 -0.259 18.035 8.087 465 1HD1 ILE 95 1HD1 ILE 95 -4.498 17.816 10.055 466 2HD1 ILE 95 2HD1 ILE 95 -2.943 17.785 10.886 467 3HD1 ILE 95 3HD1 ILE 95 -3.437 16.418 9.887 468 H ASN 96 H ASN 96 -2.599 14.343 6.231 469 HA ASN 96 HA ASN 96 -0.824 14.925 3.991 470 1HB ASN 96 2HB ASN 96 -1.172 12.657 5.873 471 2HB ASN 96 1HB ASN 96 -0.596 12.269 4.255 472 1HD2 ASN 96 1HD2 ASN 96 0.034 14.254 7.089 473 2HD2 ASN 96 2HD2 ASN 96 1.738 14.393 6.840 474 H LEU 97 H LEU 97 -3.876 13.307 4.668 475 HA LEU 97 HA LEU 97 -4.322 13.118 1.780 476 1HB LEU 97 2HB LEU 97 -4.194 10.874 3.697 477 2HB LEU 97 1HB LEU 97 -5.514 10.835 2.544 478 HG LEU 97 HG LEU 97 -2.749 11.295 1.527 479 1HD1 LEU 97 1HD1 LEU 97 -2.050 9.428 2.558 480 2HD1 LEU 97 2HD1 LEU 97 -2.967 8.611 1.293 481 3HD1 LEU 97 3HD1 LEU 97 -3.690 8.867 2.882 482 1HD2 LEU 97 1HD2 LEU 97 -3.677 10.880 -0.455 483 2HD2 LEU 97 2HD2 LEU 97 -5.232 11.030 0.363 484 3HD2 LEU 97 3HD2 LEU 97 -4.502 9.440 0.142 485 HA PRO 98 HA PRO 98 -7.910 15.445 3.456 486 1HB PRO 98 2HB PRO 98 -8.493 14.847 0.571 487 2HB PRO 98 1HB PRO 98 -8.829 16.309 1.495 488 1HG PRO 98 2HG PRO 98 -6.724 16.200 -0.119 489 2HG PRO 98 1HG PRO 98 -6.610 17.002 1.458 490 1HD PRO 98 2HD PRO 98 -5.476 14.410 0.574 491 2HD PRO 98 1HD PRO 98 -4.912 15.517 1.840 492 H GLN 99 H GLN 99 -8.651 13.086 0.907 493 HA GLN 99 HA GLN 99 -10.781 12.002 2.598 494 1HB GLN 99 2HB GLN 99 -10.256 11.878 -0.365 495 2HB GLN 99 1HB GLN 99 -11.472 10.875 0.413 496 1HG GLN 99 2HG GLN 99 -12.914 12.533 0.189 497 2HG GLN 99 1HG GLN 99 -11.945 13.481 1.316 498 1HE2 GLN 99 1HE2 GLN 99 -11.450 12.430 -2.037 499 2HE2 GLN 99 2HE2 GLN 99 -11.169 14.012 -2.673 500 H GLY 100 H GLY 100 -8.204 11.244 3.338 501 1HA GLY 100 2HA GLY 100 -7.091 9.338 3.979 502 2HA GLY 100 1HA GLY 100 -8.472 8.425 3.397 503 H VAL 101 H VAL 101 -8.558 7.953 1.076 504 HA VAL 101 HA VAL 101 -6.215 8.290 -0.550 505 HB VAL 101 HB VAL 101 -6.855 5.447 0.259 506 1HG1 VAL 101 1HG1 VAL 101 -4.957 4.839 -1.022 507 2HG1 VAL 101 2HG1 VAL 101 -4.462 6.520 -1.211 508 3HG1 VAL 101 3HG1 VAL 101 -5.911 5.935 -2.019 509 1HG2 VAL 101 1HG2 VAL 101 -5.866 6.508 2.189 510 2HG2 VAL 101 2HG2 VAL 101 -4.575 7.190 1.194 511 3HG2 VAL 101 3HG2 VAL 101 -4.680 5.447 1.432 512 H ARG 102 H ARG 102 -7.086 8.632 -2.469 513 HA ARG 102 HA ARG 102 -9.534 7.202 -3.200 514 1HB ARG 102 2HB ARG 102 -8.573 9.902 -3.641 515 2HB ARG 102 1HB ARG 102 -9.067 9.134 -5.142 516 1HG ARG 102 2HG ARG 102 -10.845 8.976 -2.761 517 2HG ARG 102 1HG ARG 102 -10.789 10.455 -3.724 518 1HD ARG 102 2HD ARG 102 -12.493 8.539 -4.289 519 2HD ARG 102 1HD ARG 102 -11.709 9.461 -5.565 520 HE ARG 102 HE ARG 102 -10.070 7.520 -5.639 521 1HH1 ARG 102 1HH1 ARG 102 -13.418 7.120 -4.683 522 2HH1 ARG 102 2HH1 ARG 102 -13.474 5.457 -5.155 523 1HH2 ARG 102 1HH2 ARG 102 -10.162 5.340 -6.254 524 2HH2 ARG 102 2HH2 ARG 102 -11.632 4.448 -6.045 525 H TYR 103 H TYR 103 -6.224 7.785 -4.178 526 HA TYR 103 HA TYR 103 -6.513 5.590 -6.085 527 1HB TYR 103 2HB TYR 103 -5.019 8.057 -6.936 528 2HB TYR 103 1HB TYR 103 -5.554 6.699 -7.903 529 HD1 TYR 103 1HD TYR 103 -7.699 6.624 -8.876 530 HD2 TYR 103 2HD TYR 103 -6.692 9.752 -6.176 531 HE1 TYR 103 1HE TYR 103 -9.708 7.852 -9.565 532 HE2 TYR 103 2HE TYR 103 -8.709 10.990 -6.852 533 HH TYR 103 HH TYR 103 -10.571 10.116 -9.583 534 H ILE 104 H ILE 104 -4.463 4.735 -6.842 535 HA ILE 104 HA ILE 104 -2.280 5.168 -4.911 536 HB ILE 104 HB ILE 104 -3.071 2.552 -6.201 537 1HG1 ILE 104 2HG1 ILE 104 -3.451 3.659 -3.422 538 2HG1 ILE 104 1HG1 ILE 104 -4.675 3.027 -4.517 539 1HG2 ILE 104 1HG2 ILE 104 -0.615 2.934 -5.781 540 2HG2 ILE 104 2HG2 ILE 104 -1.319 1.523 -4.993 541 3HG2 ILE 104 3HG2 ILE 104 -1.005 2.989 -4.062 542 1HD1 ILE 104 1HD1 ILE 104 -4.382 1.392 -2.857 543 2HD1 ILE 104 2HD1 ILE 104 -2.624 1.502 -2.946 544 3HD1 ILE 104 3HD1 ILE 104 -3.531 0.782 -4.275 545 H TYR 105 H TYR 105 -0.480 5.869 -5.840 546 HA TYR 105 HA TYR 105 -0.138 5.491 -8.716 547 1HB TYR 105 2HB TYR 105 0.292 7.714 -6.906 548 2HB TYR 105 1HB TYR 105 1.709 7.389 -7.907 549 HD1 TYR 105 1HD TYR 105 1.440 7.271 -10.376 550 HD2 TYR 105 2HD TYR 105 -1.615 8.748 -7.826 551 HE1 TYR 105 1HE TYR 105 0.374 8.334 -12.293 552 HE2 TYR 105 2HE TYR 105 -2.697 9.829 -9.732 553 HH TYR 105 HH TYR 105 -1.338 10.545 -12.468 554 H THR 106 H THR 106 2.083 5.382 -9.532 555 HA THR 106 HA THR 106 3.467 3.228 -8.255 556 HB THR 106 HB THR 106 5.228 3.960 -10.114 557 HG1 THR 106 1HG THR 106 4.411 5.787 -10.889 558 1HG2 THR 106 1HG2 THR 106 4.048 2.651 -11.777 559 2HG2 THR 106 2HG2 THR 106 2.566 2.755 -10.827 560 3HG2 THR 106 3HG2 THR 106 3.960 1.879 -10.194 561 H ILE 107 H ILE 107 5.700 3.243 -7.589 562 HA ILE 107 HA ILE 107 6.328 4.997 -5.603 563 HB ILE 107 HB ILE 107 7.502 2.849 -6.066 564 1HG1 ILE 107 2HG1 ILE 107 9.739 3.655 -5.290 565 2HG1 ILE 107 1HG1 ILE 107 9.206 5.304 -5.608 566 1HG2 ILE 107 1HG2 ILE 107 9.123 4.467 -8.025 567 2HG2 ILE 107 2HG2 ILE 107 7.907 3.270 -8.471 568 3HG2 ILE 107 3HG2 ILE 107 9.357 2.772 -7.598 569 1HD1 ILE 107 1HD1 ILE 107 7.553 3.586 -3.832 570 2HD1 ILE 107 2HD1 ILE 107 7.787 5.334 -3.819 571 3HD1 ILE 107 3HD1 ILE 107 9.056 4.272 -3.212 572 H ASP 108 H ASP 108 6.766 5.477 -9.021 573 HA ASP 108 HA ASP 108 8.366 7.882 -8.578 574 1HB ASP 108 2HB ASP 108 8.734 6.055 -10.442 575 2HB ASP 108 1HB ASP 108 7.498 6.976 -11.294 576 H GLY 109 H GLY 109 5.146 6.877 -9.387 577 1HA GLY 109 2HA GLY 109 3.233 8.213 -9.242 578 2HA GLY 109 1HA GLY 109 4.257 9.640 -9.236 579 H SER 110 H SER 110 5.059 7.457 -11.706 580 HA SER 110 HA SER 110 4.364 9.286 -13.747 581 1HB SER 110 2HB SER 110 6.200 7.463 -13.740 582 2HB SER 110 1HB SER 110 4.914 6.371 -14.249 583 HG SER 110 HG SER 110 6.315 8.055 -15.739 584 H ARG 111 H ARG 111 2.875 6.269 -12.629 585 HA ARG 111 HA ARG 111 0.395 7.075 -13.912 586 1HB ARG 111 2HB ARG 111 0.096 4.689 -14.729 587 2HB ARG 111 1HB ARG 111 1.251 5.675 -15.613 588 1HG ARG 111 2HG ARG 111 2.921 4.284 -15.163 589 2HG ARG 111 1HG ARG 111 2.519 4.242 -13.445 590 1HD ARG 111 2HD ARG 111 1.166 2.402 -13.667 591 2HD ARG 111 1HD ARG 111 0.794 2.745 -15.355 592 HE ARG 111 HE ARG 111 3.542 2.044 -14.901 593 1HH1 ARG 111 1HH1 ARG 111 0.337 0.797 -15.493 594 2HH1 ARG 111 2HH1 ARG 111 0.904 -0.695 -16.162 595 1HH2 ARG 111 1HH2 ARG 111 4.291 0.082 -15.784 596 2HH2 ARG 111 2HH2 ARG 111 3.150 -1.101 -16.329 597 H LYS 112 H LYS 112 -1.426 6.293 -12.935 598 HA LYS 112 HA LYS 112 -1.032 5.220 -10.258 599 1HB LYS 112 2HB LYS 112 -2.685 6.598 -9.675 600 2HB LYS 112 1HB LYS 112 -2.766 7.163 -11.333 601 1HG LYS 112 2HG LYS 112 -4.359 5.236 -11.766 602 2HG LYS 112 1HG LYS 112 -4.417 5.029 -10.015 603 1HD LYS 112 2HD LYS 112 -6.281 6.409 -10.859 604 2HD LYS 112 1HD LYS 112 -5.241 7.293 -9.742 605 1HE LYS 112 2HE LYS 112 -4.423 8.670 -11.366 606 2HE LYS 112 1HE LYS 112 -4.610 7.462 -12.636 607 1HZ LYS 112 1HZ LYS 112 -7.079 8.425 -11.456 608 2HZ LYS 112 2HZ LYS 112 -6.697 8.124 -13.075 609 3HZ LYS 112 3HZ LYS 112 -6.211 9.572 -12.349 610 H ILE 113 H ILE 113 -1.899 3.331 -9.522 611 HA ILE 113 HA ILE 113 -2.425 1.315 -11.502 612 HB ILE 113 HB ILE 113 -2.461 1.146 -8.486 613 1HG1 ILE 113 2HG1 ILE 113 -0.283 1.811 -9.686 614 2HG1 ILE 113 1HG1 ILE 113 -0.222 0.469 -8.551 615 1HG2 ILE 113 1HG2 ILE 113 -1.895 -1.345 -9.262 616 2HG2 ILE 113 2HG2 ILE 113 -2.913 -0.848 -10.615 617 3HG2 ILE 113 3HG2 ILE 113 -3.538 -0.777 -8.967 618 1HD1 ILE 113 1HD1 ILE 113 0.685 0.489 -11.164 619 2HD1 ILE 113 2HD1 ILE 113 -0.808 -0.449 -11.218 620 3HD1 ILE 113 3HD1 ILE 113 0.490 -0.921 -10.119 621 H GLY 114 H GLY 114 -4.311 0.319 -11.960 622 1HA GLY 114 2HA GLY 114 -6.725 1.324 -10.585 623 2HA GLY 114 1HA GLY 114 -6.675 0.925 -12.297 624 H SER 115 H SER 115 -4.941 -1.462 -11.600 625 HA SER 115 HA SER 115 -7.079 -3.182 -10.532 626 1HB SER 115 2HB SER 115 -5.122 -4.378 -12.412 627 2HB SER 115 1HB SER 115 -6.852 -4.678 -12.240 628 HG SER 115 HG SER 115 -5.519 -2.704 -13.713 629 H MET 116 H MET 116 -6.503 -4.830 -9.172 630 HA MET 116 HA MET 116 -4.234 -4.481 -7.558 631 1HB MET 116 2HB MET 116 -6.590 -5.886 -7.373 632 2HB MET 116 1HB MET 116 -5.400 -7.171 -7.515 633 1HG MET 116 2HG MET 116 -5.408 -6.928 -5.265 634 2HG MET 116 1HG MET 116 -4.164 -5.746 -5.670 635 1HE MET 116 1HE MET 116 -8.399 -4.958 -4.141 636 2HE MET 116 2HE MET 116 -7.652 -6.512 -4.512 637 3HE MET 116 3HE MET 116 -8.252 -5.488 -5.817 638 H ASP 117 H ASP 117 -4.760 -6.303 -10.457 639 HA ASP 117 HA ASP 117 -2.741 -8.214 -10.232 640 1HB ASP 117 2HB ASP 117 -4.500 -7.150 -12.283 641 2HB ASP 117 1HB ASP 117 -2.927 -7.581 -12.927 642 H GLU 118 H GLU 118 -2.523 -4.819 -10.637 643 HA GLU 118 HA GLU 118 0.072 -4.912 -11.933 644 1HB GLU 118 2HB GLU 118 -1.287 -2.491 -10.760 645 2HB GLU 118 1HB GLU 118 -0.028 -2.530 -11.987 646 1HG GLU 118 2HG GLU 118 -2.741 -3.732 -12.427 647 2HG GLU 118 1HG GLU 118 -2.383 -2.040 -12.769 648 H LEU 119 H LEU 119 -1.116 -5.063 -8.756 649 HA LEU 119 HA LEU 119 1.153 -3.808 -7.496 650 1HB LEU 119 2HB LEU 119 -0.700 -5.622 -6.023 651 2HB LEU 119 1HB LEU 119 0.078 -4.148 -5.482 652 HG LEU 119 HG LEU 119 -2.268 -4.314 -7.373 653 1HD1 LEU 119 1HD1 LEU 119 -2.290 -3.052 -4.666 654 2HD1 LEU 119 2HD1 LEU 119 -2.531 -4.790 -4.841 655 3HD1 LEU 119 3HD1 LEU 119 -3.634 -3.664 -5.631 656 1HD2 LEU 119 1HD2 LEU 119 -0.669 -2.431 -7.795 657 2HD2 LEU 119 2HD2 LEU 119 -1.017 -1.858 -6.164 658 3HD2 LEU 119 3HD2 LEU 119 -2.306 -1.937 -7.365 659 H GLU 120 H GLU 120 3.074 -4.765 -7.436 660 HA GLU 120 HA GLU 120 3.226 -7.689 -7.433 661 1HB GLU 120 2HB GLU 120 5.530 -5.772 -7.727 662 2HB GLU 120 1HB GLU 120 5.456 -7.460 -8.194 663 1HG GLU 120 2HG GLU 120 3.856 -6.918 -9.950 664 2HG GLU 120 1HG GLU 120 3.918 -5.220 -9.480 665 H GLU 121 H GLU 121 4.649 -8.782 -5.951 666 HA GLU 121 HA GLU 121 4.326 -8.060 -3.291 667 1HB GLU 121 2HB GLU 121 6.310 -9.908 -4.598 668 2HB GLU 121 1HB GLU 121 6.211 -9.705 -2.853 669 1HG GLU 121 2HG GLU 121 4.185 -10.764 -2.704 670 2HG GLU 121 1HG GLU 121 3.736 -10.374 -4.364 671 H GLY 122 H GLY 122 5.931 -7.542 -1.673 672 1HA GLY 122 2HA GLY 122 7.302 -5.909 -0.826 673 2HA GLY 122 1HA GLY 122 8.471 -6.676 -1.875 674 H GLU 123 H GLU 123 5.623 -4.764 -2.757 675 HA GLU 123 HA GLU 123 7.376 -3.038 -4.350 676 1HB GLU 123 2HB GLU 123 4.483 -3.749 -4.451 677 2HB GLU 123 1HB GLU 123 4.988 -2.203 -5.117 678 1HG GLU 123 2HG GLU 123 6.317 -4.765 -5.917 679 2HG GLU 123 1HG GLU 123 4.841 -4.197 -6.698 680 H SER 124 H SER 124 6.553 -0.716 -4.567 681 HA SER 124 HA SER 124 5.794 0.364 -1.937 682 1HB SER 124 2HB SER 124 7.878 1.532 -3.804 683 2HB SER 124 1HB SER 124 7.375 2.209 -2.255 684 HG SER 124 HG SER 124 8.285 0.473 -1.214 685 H TYR 125 H TYR 125 3.976 1.509 -2.081 686 HA TYR 125 HA TYR 125 3.375 2.833 -4.639 687 1HB TYR 125 2HB TYR 125 1.578 1.285 -2.833 688 2HB TYR 125 1HB TYR 125 0.924 2.525 -3.881 689 HD1 TYR 125 1HD TYR 125 1.599 -0.894 -3.684 690 HD2 TYR 125 2HD TYR 125 1.838 2.392 -6.358 691 HE1 TYR 125 1HE TYR 125 1.596 -2.449 -5.586 692 HE2 TYR 125 2HE TYR 125 1.838 0.874 -8.258 693 HH TYR 125 HH TYR 125 2.619 -1.900 -8.409 694 H VAL 126 H VAL 126 1.981 4.629 -4.561 695 HA VAL 126 HA VAL 126 2.221 6.157 -2.040 696 HB VAL 126 HB VAL 126 2.868 6.953 -4.823 697 1HG1 VAL 126 1HG1 VAL 126 1.126 8.490 -4.672 698 2HG1 VAL 126 2HG1 VAL 126 2.515 9.403 -4.079 699 3HG1 VAL 126 3HG1 VAL 126 1.352 8.724 -2.939 700 1HG2 VAL 126 1HG2 VAL 126 3.924 8.419 -2.506 701 2HG2 VAL 126 2HG2 VAL 126 4.767 7.711 -3.885 702 3HG2 VAL 126 3HG2 VAL 126 4.281 6.692 -2.532 703 H CYS 127 H CYS 127 0.437 7.163 -1.269 704 HA CYS 127 HA CYS 127 -2.070 6.584 -2.631 705 1HB CYS 127 2HB CYS 127 -1.345 7.472 0.142 706 2HB CYS 127 1HB CYS 127 -3.001 7.616 -0.439 707 HG CYS 127 HG CYS 127 -1.522 4.929 0.024 708 H SER 128 H SER 128 -3.242 8.029 -3.697 709 HA SER 128 HA SER 128 -2.698 10.888 -3.308 710 1HB SER 128 2HB SER 128 -3.091 9.565 -6.005 711 2HB SER 128 1HB SER 128 -2.747 11.271 -5.704 712 HG SER 128 HG SER 128 -1.051 9.095 -5.712 713 H SER 129 H SER 129 -4.429 12.275 -4.232 714 HA SER 129 HA SER 129 -7.017 11.045 -4.645 715 1HB SER 129 2HB SER 129 -6.796 11.210 -2.156 716 2HB SER 129 1HB SER 129 -6.628 12.957 -2.329 717 HG SER 129 HG SER 129 -8.769 12.516 -1.925 718 H ASP 130 H ASP 130 -5.334 14.093 -3.963 719 HA ASP 130 HA ASP 130 -6.418 15.238 -6.408 720 1HB ASP 130 2HB ASP 130 -7.188 17.284 -5.257 721 2HB ASP 130 1HB ASP 130 -8.093 15.862 -4.748 722 H ASN 131 H ASN 131 -4.438 15.744 -3.519 723 HA ASN 131 HA ASN 131 -2.896 17.876 -4.254 724 1HB ASN 131 2HB ASN 131 -1.303 17.163 -2.661 725 2HB ASN 131 1HB ASN 131 -2.840 16.532 -2.084 726 1HD2 ASN 131 1HD2 ASN 131 -3.297 14.258 -3.177 727 2HD2 ASN 131 2HD2 ASN 131 -1.996 13.134 -3.013 728 H PHE 132 H PHE 132 -0.565 17.882 -4.923 729 HA PHE 132 HA PHE 132 -0.315 16.430 -7.425 730 1HB PHE 132 2HB PHE 132 1.579 18.464 -6.235 731 2HB PHE 132 1HB PHE 132 1.527 17.914 -7.907 732 HD1 PHE 132 1HD PHE 132 -0.811 18.268 -9.091 733 HD2 PHE 132 2HD PHE 132 0.577 20.460 -5.717 734 HE1 PHE 132 1HE PHE 132 -2.359 20.098 -9.647 735 HE2 PHE 132 2HE PHE 132 -0.969 22.292 -6.267 736 HZ PHE 132 HZ PHE 132 -2.440 22.112 -8.234 737 H PHE 133 H PHE 133 1.470 15.126 -7.981 738 HA PHE 133 HA PHE 133 2.428 13.498 -5.833 739 1HB PHE 133 2HB PHE 133 1.857 12.650 -8.129 740 2HB PHE 133 1HB PHE 133 3.314 13.442 -8.721 741 HD1 PHE 133 1HD PHE 133 5.541 12.708 -7.829 742 HD2 PHE 133 2HD PHE 133 1.949 10.545 -7.099 743 HE1 PHE 133 1HE PHE 133 6.863 10.720 -7.239 744 HE2 PHE 133 2HE PHE 133 3.265 8.552 -6.507 745 HZ PHE 133 HZ PHE 133 5.726 8.638 -6.577 746 H LYS 134 H LYS 134 4.158 13.842 -4.630 747 HA LYS 134 HA LYS 134 6.223 15.688 -5.606 748 1HB LYS 134 2HB LYS 134 5.577 14.754 -2.803 749 2HB LYS 134 1HB LYS 134 6.904 15.833 -3.215 750 1HG LYS 134 2HG LYS 134 5.032 17.287 -4.286 751 2HG LYS 134 1HG LYS 134 3.967 16.349 -3.237 752 1HD LYS 134 2HD LYS 134 5.135 17.071 -1.283 753 2HD LYS 134 1HD LYS 134 6.409 17.814 -2.253 754 1HE LYS 134 2HE LYS 134 3.686 18.769 -2.816 755 2HE LYS 134 1HE LYS 134 4.293 19.151 -1.206 756 1HZ LYS 134 1HZ LYS 134 5.139 20.911 -2.309 757 2HZ LYS 134 2HZ LYS 134 5.181 20.120 -3.803 758 3HZ LYS 134 3HZ LYS 134 6.394 19.830 -2.659 759 H LYS 135 H LYS 135 8.082 14.868 -6.287 760 HA LYS 135 HA LYS 135 8.677 12.077 -5.938 761 1HB LYS 135 2HB LYS 135 10.003 14.348 -7.386 762 2HB LYS 135 1HB LYS 135 10.831 12.810 -7.186 763 1HG LYS 135 2HG LYS 135 9.852 12.338 -9.150 764 2HG LYS 135 1HG LYS 135 8.466 11.946 -8.131 765 1HD LYS 135 2HD LYS 135 7.599 13.343 -9.807 766 2HD LYS 135 1HD LYS 135 7.792 14.395 -8.403 767 1HE LYS 135 2HE LYS 135 9.271 15.690 -9.462 768 2HE LYS 135 1HE LYS 135 10.182 14.301 -10.051 769 1HZ LYS 135 1HZ LYS 135 9.429 15.026 -12.025 770 2HZ LYS 135 2HZ LYS 135 8.107 15.849 -11.364 771 3HZ LYS 135 3HZ LYS 135 8.027 14.177 -11.604 772 H VAL 136 H VAL 136 9.222 11.572 -3.877 773 HA VAL 136 HA VAL 136 11.569 12.954 -2.751 774 HB VAL 136 HB VAL 136 10.407 11.747 -0.571 775 1HG1 VAL 136 1HG1 VAL 136 9.446 14.315 -0.463 776 2HG1 VAL 136 2HG1 VAL 136 10.790 14.437 -1.601 777 3HG1 VAL 136 3HG1 VAL 136 11.060 13.787 0.015 778 1HG2 VAL 136 1HG2 VAL 136 8.173 12.994 -2.171 779 2HG2 VAL 136 2HG2 VAL 136 8.070 12.356 -0.529 780 3HG2 VAL 136 3HG2 VAL 136 8.371 11.265 -1.882 781 H GLU 137 H GLU 137 12.522 11.441 -0.903 782 HA GLU 137 HA GLU 137 13.371 9.074 -2.291 783 1HB GLU 137 2HB GLU 137 14.137 10.409 0.281 784 2HB GLU 137 1HB GLU 137 14.618 8.741 0.005 785 1HG GLU 137 2HG GLU 137 16.375 9.474 -1.112 786 2HG GLU 137 1HG GLU 137 15.287 10.129 -2.334 787 H TYR 138 H TYR 138 11.043 8.447 -2.284 788 HA TYR 138 HA TYR 138 9.671 7.464 -0.091 789 1HB TYR 138 2HB TYR 138 9.731 6.833 -3.010 790 2HB TYR 138 1HB TYR 138 8.705 5.877 -1.934 791 HD1 TYR 138 1HD TYR 138 8.540 8.394 -4.190 792 HD2 TYR 138 2HD TYR 138 7.462 7.652 -0.143 793 HE1 TYR 138 1HE TYR 138 6.810 10.137 -4.337 794 HE2 TYR 138 2HE TYR 138 5.729 9.392 -0.277 795 HH TYR 138 HH TYR 138 4.770 10.803 -3.254 796 H THR 139 H THR 139 12.123 5.912 -2.108 797 HA THR 139 HA THR 139 12.533 3.903 -0.037 798 HB THR 139 HB THR 139 12.446 2.038 -1.589 799 HG1 THR 139 1HG THR 139 12.249 2.294 -3.682 800 1HG2 THR 139 1HG2 THR 139 9.995 3.756 -1.587 801 2HG2 THR 139 2HG2 THR 139 10.345 2.329 -0.614 802 3HG2 THR 139 3HG2 THR 139 10.031 2.163 -2.341 803 H LYS 140 H LYS 140 13.903 6.217 -1.708 804 HA LYS 140 HA LYS 140 16.175 4.906 -2.839 805 1HB LYS 140 2HB LYS 140 15.870 7.817 -2.112 806 2HB LYS 140 1HB LYS 140 17.076 7.133 -3.193 807 1HG LYS 140 2HG LYS 140 14.341 6.494 -3.970 808 2HG LYS 140 1HG LYS 140 14.679 8.226 -3.943 809 1HD LYS 140 2HD LYS 140 16.768 6.572 -5.185 810 2HD LYS 140 1HD LYS 140 15.221 6.578 -6.035 811 1HE LYS 140 2HE LYS 140 16.544 8.347 -6.933 812 2HE LYS 140 1HE LYS 140 15.275 9.076 -5.948 813 1HZ LYS 140 1HZ LYS 140 17.510 10.060 -5.620 814 2HZ LYS 140 2HZ LYS 140 18.039 8.585 -4.986 815 3HZ LYS 140 3HZ LYS 140 16.824 9.456 -4.196 816 H ASN 141 H ASN 141 15.283 5.429 0.276 817 HA ASN 141 HA ASN 141 17.912 4.723 1.158 818 1HB ASN 141 2HB ASN 141 16.699 7.385 1.843 819 2HB ASN 141 1HB ASN 141 17.867 6.617 2.913 820 1HD2 ASN 141 1HD2 ASN 141 17.657 8.931 0.752 821 2HD2 ASN 141 2HD2 ASN 141 19.208 8.837 -0.003 822 H VAL 142 H VAL 142 14.888 3.982 1.251 823 HA VAL 142 HA VAL 142 14.514 3.739 4.133 824 HB VAL 142 HB VAL 142 12.653 2.846 1.929 825 1HG1 VAL 142 1HG1 VAL 142 12.088 1.738 3.940 826 2HG1 VAL 142 2HG1 VAL 142 10.963 3.089 3.799 827 3HG1 VAL 142 3HG1 VAL 142 12.337 3.197 4.900 828 1HG2 VAL 142 1HG2 VAL 142 13.107 5.501 3.174 829 2HG2 VAL 142 2HG2 VAL 142 11.441 5.019 2.857 830 3HG2 VAL 142 3HG2 VAL 142 12.605 5.091 1.534 831 H ASN 143 H ASN 143 14.141 1.732 5.160 832 HA ASN 143 HA ASN 143 15.766 -0.404 4.144 833 1HB ASN 143 2HB ASN 143 15.111 0.411 6.653 834 2HB ASN 143 1HB ASN 143 14.012 -0.951 6.458 835 1HD2 ASN 143 1HD2 ASN 143 14.887 -2.524 7.618 836 2HD2 ASN 143 2HD2 ASN 143 16.510 -3.098 7.469 837 HA PRO 144 HA PRO 144 12.202 -2.299 2.160 838 1HB PRO 144 2HB PRO 144 13.528 -3.929 0.524 839 2HB PRO 144 1HB PRO 144 13.540 -2.179 0.270 840 1HG PRO 144 2HG PRO 144 15.638 -3.934 1.474 841 2HG PRO 144 1HG PRO 144 15.825 -2.553 0.379 842 1HD PRO 144 2HD PRO 144 16.139 -2.466 3.144 843 2HD PRO 144 1HD PRO 144 15.841 -1.061 2.103 844 H ASN 145 H ASN 145 13.433 -3.312 4.771 845 HA ASN 145 HA ASN 145 13.269 -6.192 4.439 846 1HB ASN 145 2HB ASN 145 13.931 -4.416 6.781 847 2HB ASN 145 1HB ASN 145 13.715 -6.156 6.955 848 1HD2 ASN 145 1HD2 ASN 145 15.496 -7.299 6.851 849 2HD2 ASN 145 2HD2 ASN 145 16.946 -6.862 6.019 850 H TRP 146 H TRP 146 10.919 -4.081 4.402 851 HA TRP 146 HA TRP 146 9.259 -4.930 6.568 852 1HB TRP 146 2HB TRP 146 7.431 -3.905 4.907 853 2HB TRP 146 1HB TRP 146 8.469 -2.902 5.908 854 HD1 TRP 146 HD TRP 146 10.437 -1.554 4.668 855 HE1 TRP 146 1HE TRP 146 10.706 -0.817 2.218 856 HE3 TRP 146 3HE TRP 146 6.963 -4.625 2.499 857 HZ2 TRP 146 2HZ TRP 146 9.592 -1.446 -0.296 858 HZ3 TRP 146 3HZ TRP 146 6.621 -4.481 0.076 859 HH2 TRP 146 HH TRP 146 7.911 -2.932 -1.295 860 H SER 147 H SER 147 9.889 -6.090 3.368 861 HA SER 147 HA SER 147 7.537 -7.762 3.267 862 1HB SER 147 2HB SER 147 9.137 -8.742 1.302 863 2HB SER 147 1HB SER 147 8.073 -7.352 1.096 864 HG SER 147 HG SER 147 10.351 -7.080 0.466 865 H VAL 148 H VAL 148 10.633 -7.954 4.659 866 HA VAL 148 HA VAL 148 10.725 -10.866 4.626 867 HB VAL 148 HB VAL 148 12.640 -8.989 6.010 868 1HG1 VAL 148 1HG1 VAL 148 13.693 -11.472 4.946 869 2HG1 VAL 148 2HG1 VAL 148 12.394 -11.749 6.105 870 3HG1 VAL 148 3HG1 VAL 148 13.807 -10.804 6.574 871 1HG2 VAL 148 1HG2 VAL 148 12.906 -10.133 3.232 872 2HG2 VAL 148 2HG2 VAL 148 14.032 -9.050 4.050 873 3HG2 VAL 148 3HG2 VAL 148 12.431 -8.472 3.587 874 H ASN 149 H ASN 149 8.565 -9.515 6.058 875 HA ASN 149 HA ASN 149 8.956 -10.806 8.637 876 1HB ASN 149 2HB ASN 149 8.570 -7.872 8.249 877 2HB ASN 149 1HB ASN 149 7.764 -8.642 9.613 878 1HD2 ASN 149 1HD2 ASN 149 10.556 -7.186 8.569 879 2HD2 ASN 149 2HD2 ASN 149 11.622 -7.708 9.824 880 H VAL 150 H VAL 150 7.472 -12.163 7.215 881 HA VAL 150 HA VAL 150 4.701 -11.194 7.309 882 HB VAL 150 HB VAL 150 4.221 -13.191 5.851 883 1HG1 VAL 150 1HG1 VAL 150 6.261 -11.384 4.592 884 2HG1 VAL 150 2HG1 VAL 150 4.670 -10.799 5.079 885 3HG1 VAL 150 3HG1 VAL 150 4.807 -12.079 3.874 886 1HG2 VAL 150 1HG2 VAL 150 6.501 -14.237 6.610 887 2HG2 VAL 150 2HG2 VAL 150 7.138 -13.320 5.245 888 3HG2 VAL 150 3HG2 VAL 150 5.880 -14.528 4.985 Start of MODEL 5 1 1H GLY 38 1HT GLY 38 19.256 -4.892 13.229 2 2H GLY 38 2HT GLY 38 19.696 -5.867 14.540 3 3H GLY 38 3HT GLY 38 19.215 -6.577 13.083 4 1HA GLY 38 1HA GLY 38 21.500 -4.753 13.023 5 2HA GLY 38 2HA GLY 38 21.741 -6.344 13.727 6 H ALA 39 H ALA 39 23.178 -6.901 12.046 7 HA ALA 39 HA ALA 39 21.834 -7.478 9.486 8 1HB ALA 39 1HB ALA 39 24.771 -7.155 9.466 9 2HB ALA 39 2HB ALA 39 23.819 -5.690 9.706 10 3HB ALA 39 3HB ALA 39 23.566 -6.680 8.269 11 H MET 40 H MET 40 21.295 -9.577 10.158 12 HA MET 40 HA MET 40 23.481 -11.475 9.914 13 1HB MET 40 2HB MET 40 22.519 -10.777 12.451 14 2HB MET 40 1HB MET 40 21.769 -12.325 12.089 15 1HG MET 40 2HG MET 40 24.268 -12.898 11.361 16 2HG MET 40 1HG MET 40 24.606 -11.647 12.556 17 1HE MET 40 1HE MET 40 25.426 -15.177 13.524 18 2HE MET 40 2HE MET 40 24.884 -14.771 11.895 19 3HE MET 40 3HE MET 40 23.923 -15.859 12.898 20 H ASP 41 H ASP 41 20.004 -11.017 10.441 21 HA ASP 41 HA ASP 41 19.343 -13.565 9.279 22 1HB ASP 41 2HB ASP 41 18.023 -11.687 10.907 23 2HB ASP 41 1HB ASP 41 17.098 -11.758 9.410 24 HA PRO 42 HA PRO 42 17.542 -10.831 5.686 25 1HB PRO 42 2HB PRO 42 18.489 -8.245 5.617 26 2HB PRO 42 1HB PRO 42 16.930 -8.719 6.295 27 1HG PRO 42 2HG PRO 42 19.521 -8.184 7.689 28 2HG PRO 42 1HG PRO 42 17.874 -7.726 8.165 29 1HD PRO 42 2HD PRO 42 19.136 -9.804 9.301 30 2HD PRO 42 1HD PRO 42 17.389 -9.842 8.988 31 H GLU 43 H GLU 43 18.661 -11.696 4.068 32 HA GLU 43 HA GLU 43 21.109 -10.500 3.172 33 1HB GLU 43 2HB GLU 43 21.694 -12.229 5.024 34 2HB GLU 43 1HB GLU 43 21.311 -13.429 3.797 35 1HG GLU 43 2HG GLU 43 22.972 -11.957 2.360 36 2HG GLU 43 1HG GLU 43 23.583 -11.532 3.959 37 H PHE 44 H PHE 44 18.941 -13.295 2.929 38 HA PHE 44 HA PHE 44 18.588 -12.812 0.107 39 1HB PHE 44 2HB PHE 44 20.682 -14.261 0.359 40 2HB PHE 44 1HB PHE 44 19.601 -15.535 0.911 41 HD1 PHE 44 1HD PHE 44 20.128 -13.195 -1.933 42 HD2 PHE 44 2HD PHE 44 18.620 -16.954 -0.625 43 HE1 PHE 44 1HE PHE 44 19.686 -13.825 -4.269 44 HE2 PHE 44 2HE PHE 44 18.175 -17.592 -2.960 45 HZ PHE 44 HZ PHE 44 18.709 -16.026 -4.785 46 H ALA 45 H ALA 45 18.074 -15.154 2.734 47 HA ALA 45 HA ALA 45 16.278 -16.470 3.267 48 1HB ALA 45 1HB ALA 45 14.567 -14.127 2.525 49 2HB ALA 45 2HB ALA 45 15.678 -14.045 3.893 50 3HB ALA 45 3HB ALA 45 14.392 -15.253 3.872 51 H LEU 46 H LEU 46 13.651 -16.548 2.402 52 HA LEU 46 HA LEU 46 13.550 -16.784 -0.451 53 1HB LEU 46 2HB LEU 46 13.455 -19.257 1.255 54 2HB LEU 46 1HB LEU 46 12.987 -19.204 -0.434 55 HG LEU 46 HG LEU 46 15.762 -18.626 0.607 56 1HD1 LEU 46 1HD1 LEU 46 15.212 -20.967 -1.100 57 2HD1 LEU 46 2HD1 LEU 46 14.635 -21.058 0.564 58 3HD1 LEU 46 3HD1 LEU 46 16.345 -20.773 0.238 59 1HD2 LEU 46 1HD2 LEU 46 14.850 -19.049 -2.231 60 2HD2 LEU 46 2HD2 LEU 46 16.446 -18.550 -1.671 61 3HD2 LEU 46 3HD2 LEU 46 15.073 -17.458 -1.504 62 H SER 47 H SER 47 12.090 -17.722 2.543 63 HA SER 47 HA SER 47 9.950 -17.699 3.331 64 1HB SER 47 2HB SER 47 10.386 -15.230 2.597 65 2HB SER 47 1HB SER 47 9.255 -15.603 1.298 66 HG SER 47 HG SER 47 8.656 -16.100 4.017 67 H ASN 48 H ASN 48 7.656 -18.105 2.786 68 HA ASN 48 HA ASN 48 7.494 -19.993 0.606 69 1HB ASN 48 2HB ASN 48 6.082 -19.513 3.081 70 2HB ASN 48 1HB ASN 48 4.942 -19.689 1.751 71 1HD2 ASN 48 1HD2 ASN 48 5.141 -21.494 3.860 72 2HD2 ASN 48 2HD2 ASN 48 5.703 -23.007 3.241 73 H GLU 49 H GLU 49 5.392 -17.290 1.611 74 HA GLU 49 HA GLU 49 4.289 -15.699 0.416 75 1HB GLU 49 2HB GLU 49 6.625 -16.055 -1.012 76 2HB GLU 49 1HB GLU 49 5.384 -16.301 -2.232 77 1HG GLU 49 2HG GLU 49 5.931 -14.016 -2.297 78 2HG GLU 49 1HG GLU 49 4.372 -14.122 -1.479 79 H LYS 50 H LYS 50 2.555 -17.324 0.866 80 HA LYS 50 HA LYS 50 1.642 -18.825 -1.455 81 1HB LYS 50 2HB LYS 50 -0.215 -19.514 0.141 82 2HB LYS 50 1HB LYS 50 1.412 -20.033 0.560 83 1HG LYS 50 2HG LYS 50 1.589 -18.442 2.282 84 2HG LYS 50 1HG LYS 50 0.178 -17.551 1.710 85 1HD LYS 50 2HD LYS 50 -0.128 -20.405 2.525 86 2HD LYS 50 1HD LYS 50 -0.007 -19.161 3.770 87 1HE LYS 50 2HE LYS 50 -1.945 -18.058 2.995 88 2HE LYS 50 1HE LYS 50 -1.951 -18.969 1.486 89 1HZ LYS 50 1HZ LYS 50 -3.609 -19.666 3.235 90 2HZ LYS 50 2HZ LYS 50 -2.303 -20.277 4.118 91 3HZ LYS 50 3HZ LYS 50 -2.653 -20.902 2.585 92 H LYS 51 H LYS 51 1.047 -17.188 -2.889 93 HA LYS 51 HA LYS 51 -0.407 -15.774 -3.917 94 1HB LYS 51 2HB LYS 51 -2.063 -17.176 -1.938 95 2HB LYS 51 1HB LYS 51 -2.703 -15.614 -2.429 96 1HG LYS 51 2HG LYS 51 -2.064 -16.663 -4.834 97 2HG LYS 51 1HG LYS 51 -2.476 -18.123 -3.934 98 1HD LYS 51 2HD LYS 51 -4.628 -17.138 -3.319 99 2HD LYS 51 1HD LYS 51 -4.214 -15.672 -4.208 100 1HE LYS 51 2HE LYS 51 -5.513 -16.810 -5.740 101 2HE LYS 51 1HE LYS 51 -3.884 -17.292 -6.210 102 1HZ LYS 51 1HZ LYS 51 -4.747 -19.343 -6.091 103 2HZ LYS 51 2HZ LYS 51 -6.028 -18.879 -5.089 104 3HZ LYS 51 3HZ LYS 51 -4.503 -19.184 -4.425 105 H ALA 52 H ALA 52 -1.983 -13.806 -3.321 106 HA ALA 52 HA ALA 52 -2.182 -11.712 -2.447 107 1HB ALA 52 1HB ALA 52 -2.422 -11.879 -0.247 108 2HB ALA 52 2HB ALA 52 -0.673 -11.740 -0.076 109 3HB ALA 52 3HB ALA 52 -1.422 -13.331 -0.211 110 H LYS 53 H LYS 53 -0.767 -9.812 -1.626 111 HA LYS 53 HA LYS 53 2.002 -10.034 -2.528 112 1HB LYS 53 2HB LYS 53 0.167 -7.872 -3.567 113 2HB LYS 53 1HB LYS 53 1.845 -8.149 -4.016 114 1HG LYS 53 2HG LYS 53 0.747 -10.543 -4.648 115 2HG LYS 53 1HG LYS 53 -0.607 -9.456 -4.960 116 1HD LYS 53 2HD LYS 53 0.320 -8.946 -6.915 117 2HD LYS 53 1HD LYS 53 1.658 -8.198 -6.041 118 1HE LYS 53 2HE LYS 53 2.686 -9.744 -7.463 119 2HE LYS 53 1HE LYS 53 2.643 -10.551 -5.897 120 1HZ LYS 53 1HZ LYS 53 0.665 -10.977 -8.071 121 2HZ LYS 53 2HZ LYS 53 0.738 -11.811 -6.601 122 3HZ LYS 53 3HZ LYS 53 1.972 -12.001 -7.743 123 H LYS 54 H LYS 54 3.359 -8.901 -1.284 124 HA LYS 54 HA LYS 54 2.252 -7.242 0.817 125 1HB LYS 54 2HB LYS 54 4.626 -8.918 0.495 126 2HB LYS 54 1HB LYS 54 4.986 -7.357 1.219 127 1HG LYS 54 2HG LYS 54 4.529 -9.105 2.883 128 2HG LYS 54 1HG LYS 54 3.399 -7.754 2.984 129 1HD LYS 54 2HD LYS 54 1.655 -8.994 2.032 130 2HD LYS 54 1HD LYS 54 2.756 -10.219 1.397 131 1HE LYS 54 2HE LYS 54 2.869 -11.331 3.365 132 2HE LYS 54 1HE LYS 54 2.756 -9.856 4.327 133 1HZ LYS 54 1HZ LYS 54 0.806 -11.463 4.401 134 2HZ LYS 54 2HZ LYS 54 0.428 -10.916 2.845 135 3HZ LYS 54 3HZ LYS 54 0.447 -9.829 4.142 136 H VAL 55 H VAL 55 2.257 -5.148 0.682 137 HA VAL 55 HA VAL 55 4.305 -3.818 -0.963 138 HB VAL 55 HB VAL 55 2.632 -2.123 -1.634 139 1HG1 VAL 55 1HG1 VAL 55 3.220 -4.320 -2.923 140 2HG1 VAL 55 2HG1 VAL 55 1.932 -3.253 -3.483 141 3HG1 VAL 55 3HG1 VAL 55 1.534 -4.716 -2.582 142 1HG2 VAL 55 1HG2 VAL 55 0.958 -2.219 -0.032 143 2HG2 VAL 55 2HG2 VAL 55 0.784 -3.971 -0.178 144 3HG2 VAL 55 3HG2 VAL 55 0.202 -2.917 -1.469 145 H ARG 56 H ARG 56 4.864 -1.733 -0.355 146 HA ARG 56 HA ARG 56 4.173 -1.027 2.409 147 1HB ARG 56 2HB ARG 56 6.581 -1.366 2.007 148 2HB ARG 56 1HB ARG 56 6.537 -0.180 0.710 149 1HG ARG 56 2HG ARG 56 7.462 0.885 2.613 150 2HG ARG 56 1HG ARG 56 5.830 1.521 2.401 151 1HD ARG 56 2HD ARG 56 5.201 0.787 4.406 152 2HD ARG 56 1HD ARG 56 5.835 -0.827 4.086 153 HE ARG 56 HE ARG 56 8.071 0.536 4.629 154 1HH1 ARG 56 1HH1 ARG 56 5.007 0.392 6.298 155 2HH1 ARG 56 2HH1 ARG 56 5.705 0.666 7.859 156 1HH2 ARG 56 1HH2 ARG 56 8.987 0.895 6.682 157 2HH2 ARG 56 2HH2 ARG 56 7.962 0.952 8.078 158 H PHE 57 H PHE 57 2.475 0.330 2.341 159 HA PHE 57 HA PHE 57 2.185 2.133 0.093 160 1HB PHE 57 2HB PHE 57 0.410 1.392 2.403 161 2HB PHE 57 1HB PHE 57 0.015 2.728 1.332 162 HD1 PHE 57 1HD PHE 57 -1.897 0.638 1.601 163 HD2 PHE 57 2HD PHE 57 1.522 0.765 -0.940 164 HE1 PHE 57 1HE PHE 57 -2.983 -0.928 0.046 165 HE2 PHE 57 2HE PHE 57 0.429 -0.785 -2.488 166 HZ PHE 57 HZ PHE 57 -1.824 -1.637 -2.000 167 H TYR 58 H TYR 58 2.623 4.158 0.048 168 HA TYR 58 HA TYR 58 3.308 5.594 2.521 169 1HB TYR 58 2HB TYR 58 4.334 6.193 -0.240 170 2HB TYR 58 1HB TYR 58 4.848 6.933 1.257 171 HD1 TYR 58 1HD TYR 58 6.812 6.197 2.216 172 HD2 TYR 58 2HD TYR 58 4.658 3.540 -0.313 173 HE1 TYR 58 1HE TYR 58 8.616 4.542 2.427 174 HE2 TYR 58 2HE TYR 58 6.455 1.877 -0.107 175 HH TYR 58 HH TYR 58 8.963 2.155 2.197 176 H ARG 59 H ARG 59 2.602 7.706 2.724 177 HA ARG 59 HA ARG 59 0.313 8.370 1.021 178 1HB ARG 59 2HB ARG 59 -0.262 9.999 2.790 179 2HB ARG 59 1HB ARG 59 -0.126 8.363 3.417 180 1HG ARG 59 2HG ARG 59 2.150 8.896 4.215 181 2HG ARG 59 1HG ARG 59 1.923 10.556 3.664 182 1HD ARG 59 2HD ARG 59 0.247 9.132 5.729 183 2HD ARG 59 1HD ARG 59 1.494 10.335 6.060 184 HE ARG 59 HE ARG 59 -0.624 11.213 4.300 185 1HH1 ARG 59 1HH1 ARG 59 0.520 11.015 7.594 186 2HH1 ARG 59 2HH1 ARG 59 -0.468 12.324 8.146 187 1HH2 ARG 59 1HH2 ARG 59 -1.925 12.933 5.027 188 2HH2 ARG 59 2HH2 ARG 59 -1.858 13.413 6.690 189 H ASN 60 H ASN 60 0.656 9.694 -0.611 190 HA ASN 60 HA ASN 60 2.915 10.952 -1.366 191 1HB ASN 60 2HB ASN 60 0.995 10.829 -2.823 192 2HB ASN 60 1HB ASN 60 0.088 11.920 -1.787 193 1HD2 ASN 60 1HD2 ASN 60 -0.265 13.472 -3.311 194 2HD2 ASN 60 2HD2 ASN 60 0.989 14.448 -3.986 195 H GLY 61 H GLY 61 4.178 12.484 -0.619 196 1HA GLY 61 2HA GLY 61 4.812 14.519 0.291 197 2HA GLY 61 1HA GLY 61 3.117 14.886 0.575 198 H ASP 62 H ASP 62 5.729 12.778 1.775 199 HA ASP 62 HA ASP 62 4.975 13.494 4.492 200 1HB ASP 62 2HB ASP 62 5.151 11.018 5.140 201 2HB ASP 62 1HB ASP 62 3.670 11.545 4.350 202 H ARG 63 H ARG 63 7.118 11.306 2.658 203 HA ARG 63 HA ARG 63 9.367 11.006 2.692 204 1HB ARG 63 2HB ARG 63 9.348 13.678 4.103 205 2HB ARG 63 1HB ARG 63 10.798 12.858 3.544 206 1HG ARG 63 2HG ARG 63 10.432 13.384 1.381 207 2HG ARG 63 1HG ARG 63 8.677 13.274 1.537 208 1HD ARG 63 2HD ARG 63 9.358 15.567 1.107 209 2HD ARG 63 1HD ARG 63 8.651 15.419 2.716 210 HE ARG 63 HE ARG 63 11.282 15.143 3.208 211 1HH1 ARG 63 1HH1 ARG 63 9.469 17.518 1.403 212 2HH1 ARG 63 2HH1 ARG 63 10.588 18.800 1.727 213 1HH2 ARG 63 1HH2 ARG 63 12.753 16.829 3.635 214 2HH2 ARG 63 2HH2 ARG 63 12.453 18.409 2.991 215 H TYR 64 H TYR 64 8.786 12.628 5.818 216 HA TYR 64 HA TYR 64 10.503 10.997 7.300 217 1HB TYR 64 2HB TYR 64 8.044 12.465 8.277 218 2HB TYR 64 1HB TYR 64 9.369 11.888 9.281 219 HD1 TYR 64 1HD TYR 64 8.333 14.405 6.822 220 HD2 TYR 64 2HD TYR 64 11.484 13.060 9.345 221 HE1 TYR 64 1HE TYR 64 9.500 16.544 6.494 222 HE2 TYR 64 2HE TYR 64 12.660 15.196 9.024 223 HH TYR 64 HH TYR 64 11.170 17.914 7.565 224 H PHE 65 H PHE 65 7.062 10.672 6.600 225 HA PHE 65 HA PHE 65 6.718 8.372 8.274 226 1HB PHE 65 2HB PHE 65 4.876 9.983 7.668 227 2HB PHE 65 1HB PHE 65 4.911 9.311 6.041 228 HD1 PHE 65 1HD PHE 65 3.122 7.947 5.642 229 HD2 PHE 65 2HD PHE 65 4.958 7.849 9.479 230 HE1 PHE 65 1HE PHE 65 1.567 6.172 6.334 231 HE2 PHE 65 2HE PHE 65 3.406 6.072 10.180 232 HZ PHE 65 HZ PHE 65 1.707 5.230 8.607 233 H LYS 66 H LYS 66 7.381 6.405 7.805 234 HA LYS 66 HA LYS 66 8.371 5.732 5.209 235 1HB LYS 66 2HB LYS 66 7.908 3.767 7.433 236 2HB LYS 66 1HB LYS 66 9.145 3.739 6.184 237 1HG LYS 66 2HG LYS 66 9.503 6.135 7.623 238 2HG LYS 66 1HG LYS 66 9.259 4.852 8.811 239 1HD LYS 66 2HD LYS 66 11.137 3.686 8.135 240 2HD LYS 66 1HD LYS 66 11.126 4.401 6.522 241 1HE LYS 66 2HE LYS 66 11.650 6.058 8.969 242 2HE LYS 66 1HE LYS 66 12.943 5.157 8.177 243 1HZ LYS 66 1HZ LYS 66 12.368 7.626 7.521 244 2HZ LYS 66 2HZ LYS 66 11.256 6.860 6.504 245 3HZ LYS 66 3HZ LYS 66 12.904 6.508 6.370 246 H GLY 67 H GLY 67 5.280 5.782 6.464 247 1HA GLY 67 2HA GLY 67 3.352 5.195 5.270 248 2HA GLY 67 1HA GLY 67 4.326 4.142 4.259 249 H ILE 68 H ILE 68 2.179 2.951 4.793 250 HA ILE 68 HA ILE 68 2.706 1.197 7.100 251 HB ILE 68 HB ILE 68 0.737 2.522 7.579 252 1HG1 ILE 68 2HG1 ILE 68 -0.317 -0.171 6.746 253 2HG1 ILE 68 1HG1 ILE 68 0.839 -0.004 8.064 254 1HG2 ILE 68 1HG2 ILE 68 0.295 2.549 4.885 255 2HG2 ILE 68 2HG2 ILE 68 -0.849 3.101 6.113 256 3HG2 ILE 68 3HG2 ILE 68 -0.972 1.465 5.460 257 1HD1 ILE 68 1HD1 ILE 68 -1.972 0.305 8.125 258 2HD1 ILE 68 2HD1 ILE 68 -1.241 1.870 8.487 259 3HD1 ILE 68 3HD1 ILE 68 -0.817 0.454 9.450 260 H VAL 69 H VAL 69 2.622 -0.984 6.738 261 HA VAL 69 HA VAL 69 2.637 -1.828 3.966 262 HB VAL 69 HB VAL 69 3.106 -3.478 6.455 263 1HG1 VAL 69 1HG1 VAL 69 3.074 -4.089 3.578 264 2HG1 VAL 69 2HG1 VAL 69 2.841 -5.149 4.968 265 3HG1 VAL 69 3HG1 VAL 69 4.471 -4.703 4.462 266 1HG2 VAL 69 1HG2 VAL 69 5.382 -2.798 4.738 267 2HG2 VAL 69 2HG2 VAL 69 5.251 -2.819 6.496 268 3HG2 VAL 69 3HG2 VAL 69 4.670 -1.425 5.586 269 H TYR 70 H TYR 70 1.130 -3.000 2.944 270 HA TYR 70 HA TYR 70 -1.066 -4.136 4.490 271 1HB TYR 70 2HB TYR 70 -1.215 -1.982 2.540 272 2HB TYR 70 1HB TYR 70 -2.231 -3.345 2.091 273 HD1 TYR 70 1HD TYR 70 -1.398 -1.720 5.364 274 HD2 TYR 70 2HD TYR 70 -4.416 -2.956 2.631 275 HE1 TYR 70 1HE TYR 70 -3.127 -0.989 6.952 276 HE2 TYR 70 2HE TYR 70 -6.153 -2.225 4.210 277 HH TYR 70 HH TYR 70 -6.443 -1.789 6.553 278 H ALA 71 H ALA 71 -2.124 -5.830 3.546 279 HA ALA 71 HA ALA 71 -0.556 -7.340 1.585 280 1HB ALA 71 1HB ALA 71 -1.650 -9.312 2.404 281 2HB ALA 71 2HB ALA 71 -2.794 -8.351 3.340 282 3HB ALA 71 3HB ALA 71 -1.093 -8.389 3.800 283 H VAL 72 H VAL 72 -1.559 -8.153 -0.304 284 HA VAL 72 HA VAL 72 -4.302 -7.248 -0.785 285 HB VAL 72 HB VAL 72 -2.322 -6.924 -2.991 286 1HG1 VAL 72 1HG1 VAL 72 -4.861 -6.697 -3.172 287 2HG1 VAL 72 2HG1 VAL 72 -3.876 -5.400 -3.842 288 3HG1 VAL 72 3HG1 VAL 72 -4.664 -5.188 -2.279 289 1HG2 VAL 72 1HG2 VAL 72 -2.586 -5.146 -0.596 290 2HG2 VAL 72 2HG2 VAL 72 -2.195 -4.463 -2.174 291 3HG2 VAL 72 3HG2 VAL 72 -1.131 -5.667 -1.447 292 H SER 73 H SER 73 -5.526 -8.655 -1.758 293 HA SER 73 HA SER 73 -4.535 -10.593 -3.636 294 1HB SER 73 2HB SER 73 -4.979 -12.576 -2.420 295 2HB SER 73 1HB SER 73 -4.081 -11.553 -1.299 296 HG SER 73 HG SER 73 -5.933 -12.493 -0.327 297 H SER 74 H SER 74 -6.703 -12.388 -3.492 298 HA SER 74 HA SER 74 -8.817 -10.664 -4.525 299 1HB SER 74 2HB SER 74 -7.781 -12.946 -5.534 300 2HB SER 74 1HB SER 74 -9.140 -13.607 -4.625 301 HG SER 74 HG SER 74 -10.380 -12.927 -6.164 302 H ASP 75 H ASP 75 -8.137 -12.763 -1.844 303 HA ASP 75 HA ASP 75 -10.889 -12.973 -1.017 304 1HB ASP 75 2HB ASP 75 -8.342 -14.199 -0.342 305 2HB ASP 75 1HB ASP 75 -9.276 -13.792 1.087 306 H ARG 76 H ARG 76 -8.236 -10.834 -0.495 307 HA ARG 76 HA ARG 76 -9.369 -9.757 1.963 308 1HB ARG 76 2HB ARG 76 -6.855 -10.087 1.490 309 2HB ARG 76 1HB ARG 76 -6.991 -8.641 0.499 310 1HG ARG 76 2HG ARG 76 -7.229 -7.267 2.286 311 2HG ARG 76 1HG ARG 76 -8.059 -8.487 3.254 312 1HD ARG 76 2HD ARG 76 -5.152 -8.749 2.566 313 2HD ARG 76 1HD ARG 76 -5.683 -7.787 3.944 314 HE ARG 76 HE ARG 76 -6.760 -10.452 3.906 315 1HH1 ARG 76 1HH1 ARG 76 -4.059 -8.471 4.884 316 2HH1 ARG 76 2HH1 ARG 76 -3.558 -9.554 6.139 317 1HH2 ARG 76 1HH2 ARG 76 -6.101 -11.879 5.555 318 2HH2 ARG 76 2HH2 ARG 76 -4.716 -11.490 6.519 319 H PHE 77 H PHE 77 -8.565 -8.607 -1.312 320 HA PHE 77 HA PHE 77 -10.611 -6.519 -0.969 321 1HB PHE 77 2HB PHE 77 -7.948 -6.254 -2.378 322 2HB PHE 77 1HB PHE 77 -9.213 -5.029 -2.372 323 HD1 PHE 77 1HD PHE 77 -6.206 -5.880 -0.941 324 HD2 PHE 77 2HD PHE 77 -10.094 -4.535 0.148 325 HE1 PHE 77 1HE PHE 77 -5.298 -4.959 1.151 326 HE2 PHE 77 2HE PHE 77 -9.192 -3.610 2.240 327 HZ PHE 77 HZ PHE 77 -6.791 -3.820 2.745 328 H ARG 78 H ARG 78 -12.228 -6.798 -2.321 329 HA ARG 78 HA ARG 78 -12.197 -8.628 -4.454 330 1HB ARG 78 2HB ARG 78 -14.073 -6.827 -3.157 331 2HB ARG 78 1HB ARG 78 -14.333 -6.913 -4.885 332 1HG ARG 78 2HG ARG 78 -14.691 -9.259 -4.803 333 2HG ARG 78 1HG ARG 78 -14.130 -9.342 -3.131 334 1HD ARG 78 2HD ARG 78 -16.172 -8.911 -2.371 335 2HD ARG 78 1HD ARG 78 -16.271 -7.446 -3.349 336 HE ARG 78 HE ARG 78 -16.751 -9.871 -4.823 337 1HH1 ARG 78 1HH1 ARG 78 -18.198 -7.373 -2.862 338 2HH1 ARG 78 2HH1 ARG 78 -19.787 -7.610 -3.509 339 1HH2 ARG 78 1HH2 ARG 78 -18.839 -10.185 -5.676 340 2HH2 ARG 78 2HH2 ARG 78 -20.151 -9.208 -5.106 341 H SER 79 H SER 79 -11.533 -5.216 -4.226 342 HA SER 79 HA SER 79 -10.421 -5.182 -6.860 343 1HB SER 79 2HB SER 79 -13.144 -4.682 -6.770 344 2HB SER 79 1HB SER 79 -12.435 -3.068 -6.797 345 HG SER 79 HG SER 79 -11.357 -3.605 -8.686 346 H PHE 80 H PHE 80 -10.061 -2.697 -7.469 347 HA PHE 80 HA PHE 80 -8.193 -1.691 -5.644 348 1HB PHE 80 2HB PHE 80 -8.420 -1.240 -8.150 349 2HB PHE 80 1HB PHE 80 -9.623 -0.038 -7.719 350 HD1 PHE 80 1HD PHE 80 -8.898 2.111 -7.660 351 HD2 PHE 80 2HD PHE 80 -6.175 -0.986 -6.605 352 HE1 PHE 80 1HE PHE 80 -7.139 3.787 -7.297 353 HE2 PHE 80 2HE PHE 80 -4.415 0.683 -6.236 354 HZ PHE 80 HZ PHE 80 -4.896 3.077 -6.583 355 H ASP 81 H ASP 81 -11.549 -0.839 -6.241 356 HA ASP 81 HA ASP 81 -11.683 1.455 -4.633 357 1HB ASP 81 2HB ASP 81 -13.778 -0.548 -5.471 358 2HB ASP 81 1HB ASP 81 -14.169 0.872 -4.504 359 H ALA 82 H ALA 82 -12.030 -1.956 -3.867 360 HA ALA 82 HA ALA 82 -12.925 -1.595 -1.193 361 1HB ALA 82 1HB ALA 82 -12.266 -3.781 -2.934 362 2HB ALA 82 2HB ALA 82 -13.320 -3.748 -1.521 363 3HB ALA 82 3HB ALA 82 -11.593 -4.038 -1.325 364 H LEU 83 H LEU 83 -9.761 -2.043 -2.691 365 HA LEU 83 HA LEU 83 -8.263 -2.238 -0.298 366 1HB LEU 83 2HB LEU 83 -7.334 -2.891 -2.447 367 2HB LEU 83 1HB LEU 83 -7.493 -1.259 -3.050 368 HG LEU 83 HG LEU 83 -5.834 -0.503 -1.377 369 1HD1 LEU 83 1HD1 LEU 83 -5.207 -3.388 -0.871 370 2HD1 LEU 83 2HD1 LEU 83 -6.336 -2.498 0.151 371 3HD1 LEU 83 3HD1 LEU 83 -4.663 -1.962 0.011 372 1HD2 LEU 83 1HD2 LEU 83 -4.405 -2.675 -2.756 373 2HD2 LEU 83 2HD2 LEU 83 -4.125 -0.933 -2.776 374 3HD2 LEU 83 3HD2 LEU 83 -5.394 -1.635 -3.781 375 H LEU 84 H LEU 84 -8.990 0.412 -2.492 376 HA LEU 84 HA LEU 84 -7.716 2.459 -1.073 377 1HB LEU 84 2HB LEU 84 -9.984 2.383 -3.033 378 2HB LEU 84 1HB LEU 84 -9.549 3.894 -2.255 379 HG LEU 84 HG LEU 84 -7.634 2.209 -3.864 380 1HD1 LEU 84 1HD1 LEU 84 -9.448 4.457 -4.618 381 2HD1 LEU 84 2HD1 LEU 84 -9.094 2.962 -5.483 382 3HD1 LEU 84 3HD1 LEU 84 -7.897 4.258 -5.433 383 1HD2 LEU 84 1HD2 LEU 84 -7.444 4.989 -2.721 384 2HD2 LEU 84 2HD2 LEU 84 -6.262 4.256 -3.804 385 3HD2 LEU 84 3HD2 LEU 84 -6.531 3.571 -2.199 386 H ALA 85 H ALA 85 -10.848 0.912 -0.680 387 HA ALA 85 HA ALA 85 -12.003 2.832 1.058 388 1HB ALA 85 1HB ALA 85 -13.589 1.128 1.614 389 2HB ALA 85 2HB ALA 85 -12.497 -0.137 1.052 390 3HB ALA 85 3HB ALA 85 -13.218 0.983 -0.104 391 H ASP 86 H ASP 86 -10.128 -0.111 1.646 392 HA ASP 86 HA ASP 86 -10.154 0.139 4.487 393 1HB ASP 86 2HB ASP 86 -8.950 -1.663 2.493 394 2HB ASP 86 1HB ASP 86 -7.987 -1.449 3.952 395 H LEU 87 H LEU 87 -8.047 1.166 1.900 396 HA LEU 87 HA LEU 87 -5.802 1.883 3.437 397 1HB LEU 87 2HB LEU 87 -6.866 2.803 0.780 398 2HB LEU 87 1HB LEU 87 -5.446 3.555 1.473 399 HG LEU 87 HG LEU 87 -5.772 0.856 0.273 400 1HD1 LEU 87 1HD1 LEU 87 -3.471 2.797 0.372 401 2HD1 LEU 87 2HD1 LEU 87 -4.686 2.722 -0.903 402 3HD1 LEU 87 3HD1 LEU 87 -3.596 1.360 -0.642 403 1HD2 LEU 87 1HD2 LEU 87 -3.800 1.433 2.486 404 2HD2 LEU 87 2HD2 LEU 87 -3.780 0.015 1.441 405 3HD2 LEU 87 3HD2 LEU 87 -5.126 0.273 2.545 406 H THR 88 H THR 88 -8.780 3.557 2.726 407 HA THR 88 HA THR 88 -8.078 6.120 3.615 408 HB THR 88 HB THR 88 -10.814 5.227 4.265 409 HG1 THR 88 1HG THR 88 -11.393 4.836 2.142 410 1HG2 THR 88 1HG2 THR 88 -11.474 7.086 2.854 411 2HG2 THR 88 2HG2 THR 88 -9.794 7.336 2.385 412 3HG2 THR 88 3HG2 THR 88 -10.287 7.588 4.058 413 H ARG 89 H ARG 89 -9.385 3.307 5.297 414 HA ARG 89 HA ARG 89 -9.584 4.526 7.842 415 1HB ARG 89 2HB ARG 89 -10.082 1.935 6.673 416 2HB ARG 89 1HB ARG 89 -9.305 1.768 8.241 417 1HG ARG 89 2HG ARG 89 -11.298 2.034 9.166 418 2HG ARG 89 1HG ARG 89 -11.266 3.711 8.618 419 1HD ARG 89 2HD ARG 89 -12.035 2.370 6.359 420 2HD ARG 89 1HD ARG 89 -12.817 1.434 7.633 421 HE ARG 89 HE ARG 89 -13.353 4.072 8.205 422 1HH1 ARG 89 1HH1 ARG 89 -13.952 1.895 5.545 423 2HH1 ARG 89 2HH1 ARG 89 -15.416 2.685 5.064 424 1HH2 ARG 89 1HH2 ARG 89 -15.278 5.114 7.574 425 2HH2 ARG 89 2HH2 ARG 89 -16.169 4.513 6.215 426 H SER 90 H SER 90 -7.070 2.399 6.416 427 HA SER 90 HA SER 90 -5.534 2.390 8.832 428 1HB SER 90 2HB SER 90 -5.488 1.012 6.351 429 2HB SER 90 1HB SER 90 -3.894 1.726 6.592 430 HG SER 90 HG SER 90 -5.142 -0.308 7.958 431 H LEU 91 H LEU 91 -5.334 4.230 5.811 432 HA LEU 91 HA LEU 91 -2.995 5.625 6.820 433 1HB LEU 91 2HB LEU 91 -4.140 5.015 4.214 434 2HB LEU 91 1HB LEU 91 -3.611 6.672 4.351 435 HG LEU 91 HG LEU 91 -1.981 4.162 4.525 436 1HD1 LEU 91 1HD1 LEU 91 -1.358 4.759 2.493 437 2HD1 LEU 91 2HD1 LEU 91 -0.785 6.312 3.098 438 3HD1 LEU 91 3HD1 LEU 91 -2.458 6.135 2.569 439 1HD2 LEU 91 1HD2 LEU 91 -1.018 5.165 6.341 440 2HD2 LEU 91 2HD2 LEU 91 -1.419 6.795 5.795 441 3HD2 LEU 91 3HD2 LEU 91 -0.089 5.914 5.043 442 H SER 92 H SER 92 -6.250 5.951 7.121 443 HA SER 92 HA SER 92 -7.201 8.334 6.452 444 1HB SER 92 2HB SER 92 -8.028 8.444 8.997 445 2HB SER 92 1HB SER 92 -8.681 7.287 7.841 446 HG SER 92 HG SER 92 -6.938 6.887 9.981 447 H ASP 93 H ASP 93 -6.659 10.370 6.528 448 HA ASP 93 HA ASP 93 -5.267 11.501 8.802 449 1HB ASP 93 2HB ASP 93 -3.923 10.870 6.290 450 2HB ASP 93 1HB ASP 93 -3.793 12.576 6.701 451 H ASN 94 H ASN 94 -4.601 13.966 7.652 452 HA ASN 94 HA ASN 94 -6.795 15.005 6.138 453 1HB ASN 94 2HB ASN 94 -7.834 14.776 8.383 454 2HB ASN 94 1HB ASN 94 -6.598 15.847 9.036 455 1HD2 ASN 94 1HD2 ASN 94 -7.024 17.937 9.075 456 2HD2 ASN 94 2HD2 ASN 94 -8.279 18.729 8.190 457 H ILE 95 H ILE 95 -3.859 14.961 6.163 458 HA ILE 95 HA ILE 95 -3.362 17.859 6.166 459 HB ILE 95 HB ILE 95 -1.569 15.568 6.931 460 1HG1 ILE 95 2HG1 ILE 95 -1.105 17.741 8.586 461 2HG1 ILE 95 1HG1 ILE 95 -2.831 17.846 8.253 462 1HG2 ILE 95 1HG2 ILE 95 0.320 17.201 6.931 463 2HG2 ILE 95 2HG2 ILE 95 -0.711 18.300 6.015 464 3HG2 ILE 95 3HG2 ILE 95 -0.260 16.740 5.331 465 1HD1 ILE 95 1HD1 ILE 95 -2.692 15.257 8.830 466 2HD1 ILE 95 2HD1 ILE 95 -2.905 16.499 10.063 467 3HD1 ILE 95 3HD1 ILE 95 -1.306 15.818 9.764 468 H ASN 96 H ASN 96 -1.856 14.916 4.844 469 HA ASN 96 HA ASN 96 -1.533 16.274 2.273 470 1HB ASN 96 2HB ASN 96 -0.230 13.901 3.564 471 2HB ASN 96 1HB ASN 96 -0.180 14.080 1.812 472 1HD2 ASN 96 1HD2 ASN 96 1.038 15.157 4.821 473 2HD2 ASN 96 2HD2 ASN 96 2.179 16.301 4.207 474 H LEU 97 H LEU 97 -3.299 13.731 3.825 475 HA LEU 97 HA LEU 97 -4.423 12.902 1.233 476 1HB LEU 97 2HB LEU 97 -3.847 11.446 3.755 477 2HB LEU 97 1HB LEU 97 -5.280 10.968 2.866 478 HG LEU 97 HG LEU 97 -2.501 11.035 1.695 479 1HD1 LEU 97 1HD1 LEU 97 -3.943 9.004 3.260 480 2HD1 LEU 97 2HD1 LEU 97 -2.211 9.245 3.024 481 3HD1 LEU 97 3HD1 LEU 97 -3.164 8.430 1.784 482 1HD2 LEU 97 1HD2 LEU 97 -4.054 9.319 0.220 483 2HD2 LEU 97 2HD2 LEU 97 -3.632 10.972 -0.226 484 3HD2 LEU 97 3HD2 LEU 97 -5.162 10.641 0.585 485 HA PRO 98 HA PRO 98 -7.699 15.637 3.093 486 1HB PRO 98 2HB PRO 98 -8.591 14.940 0.315 487 2HB PRO 98 1HB PRO 98 -8.743 16.461 1.188 488 1HG PRO 98 2HG PRO 98 -6.843 16.160 -0.633 489 2HG PRO 98 1HG PRO 98 -6.499 17.009 0.887 490 1HD PRO 98 2HD PRO 98 -5.686 14.283 0.015 491 2HD PRO 98 1HD PRO 98 -4.847 15.426 1.083 492 H GLN 99 H GLN 99 -8.751 13.202 0.732 493 HA GLN 99 HA GLN 99 -10.755 12.284 2.655 494 1HB GLN 99 2HB GLN 99 -10.518 12.219 -0.318 495 2HB GLN 99 1HB GLN 99 -11.506 10.997 0.472 496 1HG GLN 99 2HG GLN 99 -12.967 12.612 1.367 497 2HG GLN 99 1HG GLN 99 -11.867 13.933 0.976 498 1HE2 GLN 99 1HE2 GLN 99 -11.269 13.829 -1.506 499 2HE2 GLN 99 2HE2 GLN 99 -12.642 13.766 -2.551 500 H GLY 100 H GLY 100 -8.207 11.431 3.279 501 1HA GLY 100 2HA GLY 100 -7.218 9.480 4.002 502 2HA GLY 100 1HA GLY 100 -8.603 8.607 3.370 503 H VAL 101 H VAL 101 -8.615 8.090 1.071 504 HA VAL 101 HA VAL 101 -6.218 8.381 -0.495 505 HB VAL 101 HB VAL 101 -6.940 5.561 0.333 506 1HG1 VAL 101 1HG1 VAL 101 -4.478 6.557 -1.074 507 2HG1 VAL 101 2HG1 VAL 101 -5.913 5.988 -1.919 508 3HG1 VAL 101 3HG1 VAL 101 -5.013 4.890 -0.872 509 1HG2 VAL 101 1HG2 VAL 101 -4.797 5.536 1.570 510 2HG2 VAL 101 2HG2 VAL 101 -5.997 6.613 2.281 511 3HG2 VAL 101 3HG2 VAL 101 -4.668 7.277 1.324 512 H ARG 102 H ARG 102 -7.103 8.762 -2.429 513 HA ARG 102 HA ARG 102 -9.500 7.268 -3.202 514 1HB ARG 102 2HB ARG 102 -8.653 10.009 -3.585 515 2HB ARG 102 1HB ARG 102 -9.093 9.250 -5.109 516 1HG ARG 102 2HG ARG 102 -10.889 8.963 -2.753 517 2HG ARG 102 1HG ARG 102 -10.886 10.467 -3.680 518 1HD ARG 102 2HD ARG 102 -12.498 8.488 -4.305 519 2HD ARG 102 1HD ARG 102 -11.749 9.480 -5.549 520 HE ARG 102 HE ARG 102 -10.015 7.606 -5.643 521 1HH1 ARG 102 1HH1 ARG 102 -13.373 7.062 -4.796 522 2HH1 ARG 102 2HH1 ARG 102 -13.367 5.425 -5.354 523 1HH2 ARG 102 1HH2 ARG 102 -10.028 5.461 -6.376 524 2HH2 ARG 102 2HH2 ARG 102 -11.476 4.517 -6.252 525 H TYR 103 H TYR 103 -6.196 7.931 -4.126 526 HA TYR 103 HA TYR 103 -6.460 5.811 -6.121 527 1HB TYR 103 2HB TYR 103 -4.973 8.334 -6.821 528 2HB TYR 103 1HB TYR 103 -5.423 7.003 -7.864 529 HD1 TYR 103 1HD TYR 103 -6.717 9.961 -6.089 530 HD2 TYR 103 2HD TYR 103 -7.550 6.870 -8.889 531 HE1 TYR 103 1HE TYR 103 -8.751 11.153 -6.792 532 HE2 TYR 103 2HE TYR 103 -9.582 8.048 -9.599 533 HH TYR 103 HH TYR 103 -10.210 11.240 -8.869 534 H ILE 104 H ILE 104 -4.404 4.965 -6.872 535 HA ILE 104 HA ILE 104 -2.257 5.280 -4.877 536 HB ILE 104 HB ILE 104 -3.094 2.725 -6.260 537 1HG1 ILE 104 2HG1 ILE 104 -3.502 3.762 -3.459 538 2HG1 ILE 104 1HG1 ILE 104 -4.722 3.211 -4.602 539 1HG2 ILE 104 1HG2 ILE 104 -0.634 3.032 -5.755 540 2HG2 ILE 104 2HG2 ILE 104 -1.407 1.603 -5.071 541 3HG2 ILE 104 3HG2 ILE 104 -1.082 3.006 -4.050 542 1HD1 ILE 104 1HD1 ILE 104 -3.669 0.919 -4.407 543 2HD1 ILE 104 2HD1 ILE 104 -4.527 1.517 -2.986 544 3HD1 ILE 104 3HD1 ILE 104 -2.765 1.563 -3.036 545 H TYR 105 H TYR 105 -0.414 5.957 -5.745 546 HA TYR 105 HA TYR 105 -0.010 5.635 -8.620 547 1HB TYR 105 2HB TYR 105 0.431 7.814 -6.759 548 2HB TYR 105 1HB TYR 105 1.864 7.469 -7.729 549 HD1 TYR 105 1HD TYR 105 -1.347 9.010 -7.673 550 HD2 TYR 105 2HD TYR 105 1.576 7.302 -10.232 551 HE1 TYR 105 1HE TYR 105 -2.366 10.148 -9.579 552 HE2 TYR 105 2HE TYR 105 0.580 8.430 -12.148 553 HH TYR 105 HH TYR 105 -1.055 10.827 -12.242 554 H THR 106 H THR 106 2.195 5.427 -9.405 555 HA THR 106 HA THR 106 3.499 3.234 -8.117 556 HB THR 106 HB THR 106 5.302 3.853 -9.938 557 HG1 THR 106 1HG THR 106 4.310 4.997 -11.660 558 1HG2 THR 106 1HG2 THR 106 4.415 2.141 -11.008 559 2HG2 THR 106 2HG2 THR 106 3.051 3.130 -11.526 560 3HG2 THR 106 3HG2 THR 106 2.983 2.270 -9.988 561 H ILE 107 H ILE 107 5.720 3.177 -7.407 562 HA ILE 107 HA ILE 107 6.367 4.911 -5.409 563 HB ILE 107 HB ILE 107 7.492 2.732 -5.847 564 1HG1 ILE 107 2HG1 ILE 107 9.673 3.424 -4.953 565 2HG1 ILE 107 1HG1 ILE 107 9.337 5.090 -5.422 566 1HG2 ILE 107 1HG2 ILE 107 9.293 2.535 -7.377 567 2HG2 ILE 107 2HG2 ILE 107 9.269 4.263 -7.731 568 3HG2 ILE 107 3HG2 ILE 107 7.940 3.234 -8.270 569 1HD1 ILE 107 1HD1 ILE 107 7.274 3.886 -3.740 570 2HD1 ILE 107 2HD1 ILE 107 8.065 5.458 -3.627 571 3HD1 ILE 107 3HD1 ILE 107 8.854 4.025 -2.972 572 H ASP 108 H ASP 108 6.865 5.383 -8.816 573 HA ASP 108 HA ASP 108 8.538 7.732 -8.356 574 1HB ASP 108 2HB ASP 108 8.932 5.950 -10.204 575 2HB ASP 108 1HB ASP 108 7.627 6.770 -11.055 576 H GLY 109 H GLY 109 5.302 6.823 -9.268 577 1HA GLY 109 2HA GLY 109 3.422 8.216 -9.087 578 2HA GLY 109 1HA GLY 109 4.488 9.612 -9.062 579 H SER 110 H SER 110 5.244 7.433 -11.547 580 HA SER 110 HA SER 110 4.614 9.302 -13.571 581 1HB SER 110 2HB SER 110 6.408 7.453 -13.589 582 2HB SER 110 1HB SER 110 5.101 6.373 -14.077 583 HG SER 110 HG SER 110 5.667 8.789 -15.435 584 H ARG 111 H ARG 111 3.030 6.327 -12.478 585 HA ARG 111 HA ARG 111 0.582 7.203 -13.777 586 1HB ARG 111 2HB ARG 111 0.251 4.783 -14.564 587 2HB ARG 111 1HB ARG 111 1.349 5.797 -15.491 588 1HG ARG 111 2HG ARG 111 3.250 4.732 -14.597 589 2HG ARG 111 1HG ARG 111 2.307 3.944 -13.331 590 1HD ARG 111 2HD ARG 111 1.566 3.379 -16.148 591 2HD ARG 111 1HD ARG 111 3.069 2.683 -15.549 592 HE ARG 111 HE ARG 111 1.854 1.368 -14.053 593 1HH1 ARG 111 1HH1 ARG 111 -0.259 3.445 -15.909 594 2HH1 ARG 111 2HH1 ARG 111 -1.690 2.566 -15.488 595 1HH2 ARG 111 1HH2 ARG 111 -0.029 0.220 -13.505 596 2HH2 ARG 111 2HH2 ARG 111 -1.561 0.740 -14.125 597 H LYS 112 H LYS 112 -1.263 6.490 -12.799 598 HA LYS 112 HA LYS 112 -0.905 5.333 -10.149 599 1HB LYS 112 2HB LYS 112 -2.516 6.734 -9.491 600 2HB LYS 112 1HB LYS 112 -2.510 7.419 -11.104 601 1HG LYS 112 2HG LYS 112 -4.199 5.588 -11.692 602 2HG LYS 112 1HG LYS 112 -4.353 5.357 -9.950 603 1HD LYS 112 2HD LYS 112 -6.074 6.879 -10.812 604 2HD LYS 112 1HD LYS 112 -4.993 7.693 -9.679 605 1HE LYS 112 2HE LYS 112 -4.100 9.033 -11.277 606 2HE LYS 112 1HE LYS 112 -4.244 7.807 -12.537 607 1HZ LYS 112 1HZ LYS 112 -6.301 8.494 -13.095 608 2HZ LYS 112 2HZ LYS 112 -5.786 9.956 -12.420 609 3HZ LYS 112 3HZ LYS 112 -6.738 8.895 -11.510 610 H ILE 113 H ILE 113 -1.862 3.464 -9.470 611 HA ILE 113 HA ILE 113 -2.526 1.565 -11.532 612 HB ILE 113 HB ILE 113 -2.489 1.231 -8.531 613 1HG1 ILE 113 2HG1 ILE 113 -0.310 1.891 -9.709 614 2HG1 ILE 113 1HG1 ILE 113 -0.283 0.453 -8.696 615 1HG2 ILE 113 1HG2 ILE 113 -1.980 -1.220 -9.642 616 2HG2 ILE 113 2HG2 ILE 113 -3.215 -0.556 -10.711 617 3HG2 ILE 113 3HG2 ILE 113 -3.526 -0.688 -8.980 618 1HD1 ILE 113 1HD1 ILE 113 -0.955 -0.247 -11.395 619 2HD1 ILE 113 2HD1 ILE 113 0.387 -0.797 -10.389 620 3HD1 ILE 113 3HD1 ILE 113 0.546 0.680 -11.342 621 H GLY 114 H GLY 114 -4.470 0.736 -12.015 622 1HA GLY 114 2HA GLY 114 -6.793 1.794 -10.534 623 2HA GLY 114 1HA GLY 114 -6.809 1.379 -12.242 624 H SER 115 H SER 115 -5.182 -1.073 -11.649 625 HA SER 115 HA SER 115 -7.321 -2.693 -10.435 626 1HB SER 115 2HB SER 115 -5.551 -3.935 -12.480 627 2HB SER 115 1HB SER 115 -7.257 -4.228 -12.137 628 HG SER 115 HG SER 115 -7.058 -3.155 -14.103 629 H MET 116 H MET 116 -6.729 -4.418 -9.172 630 HA MET 116 HA MET 116 -4.364 -4.183 -7.679 631 1HB MET 116 2HB MET 116 -6.763 -5.495 -7.389 632 2HB MET 116 1HB MET 116 -5.634 -6.824 -7.613 633 1HG MET 116 2HG MET 116 -5.842 -6.422 -5.285 634 2HG MET 116 1HG MET 116 -4.246 -5.866 -5.789 635 1HE MET 116 1HE MET 116 -7.848 -4.975 -5.074 636 2HE MET 116 2HE MET 116 -7.767 -3.398 -4.289 637 3HE MET 116 3HE MET 116 -7.132 -4.827 -3.468 638 H ASP 117 H ASP 117 -5.121 -5.944 -10.568 639 HA ASP 117 HA ASP 117 -3.166 -7.933 -10.464 640 1HB ASP 117 2HB ASP 117 -5.001 -6.798 -12.406 641 2HB ASP 117 1HB ASP 117 -3.486 -7.283 -13.142 642 H GLU 118 H GLU 118 -2.834 -4.552 -10.847 643 HA GLU 118 HA GLU 118 -0.328 -4.739 -12.303 644 1HB GLU 118 2HB GLU 118 -1.992 -2.462 -11.270 645 2HB GLU 118 1HB GLU 118 -0.342 -2.197 -11.815 646 1HG GLU 118 2HG GLU 118 -2.289 -3.615 -13.575 647 2HG GLU 118 1HG GLU 118 -2.311 -1.856 -13.456 648 H LEU 119 H LEU 119 -1.329 -4.865 -9.058 649 HA LEU 119 HA LEU 119 1.049 -3.689 -7.935 650 1HB LEU 119 2HB LEU 119 -0.777 -5.460 -6.375 651 2HB LEU 119 1HB LEU 119 0.095 -4.030 -5.857 652 HG LEU 119 HG LEU 119 -2.382 -4.089 -7.579 653 1HD1 LEU 119 1HD1 LEU 119 -3.331 -2.836 -5.638 654 2HD1 LEU 119 2HD1 LEU 119 -1.866 -3.235 -4.741 655 3HD1 LEU 119 3HD1 LEU 119 -2.932 -4.521 -5.307 656 1HD2 LEU 119 1HD2 LEU 119 -0.813 -2.301 -8.235 657 2HD2 LEU 119 2HD2 LEU 119 -0.830 -1.709 -6.573 658 3HD2 LEU 119 3HD2 LEU 119 -2.309 -1.680 -7.535 659 H GLU 120 H GLU 120 2.934 -4.667 -7.712 660 HA GLU 120 HA GLU 120 3.064 -7.589 -7.894 661 1HB GLU 120 2HB GLU 120 5.344 -5.617 -8.069 662 2HB GLU 120 1HB GLU 120 5.361 -7.312 -8.518 663 1HG GLU 120 2HG GLU 120 4.231 -6.956 -10.478 664 2HG GLU 120 1HG GLU 120 3.463 -5.483 -9.889 665 H GLU 121 H GLU 121 4.695 -8.685 -6.486 666 HA GLU 121 HA GLU 121 4.198 -8.234 -3.787 667 1HB GLU 121 2HB GLU 121 6.414 -9.729 -5.165 668 2HB GLU 121 1HB GLU 121 6.293 -9.644 -3.411 669 1HG GLU 121 2HG GLU 121 4.956 -11.403 -3.487 670 2HG GLU 121 1HG GLU 121 3.751 -10.391 -4.283 671 H GLY 122 H GLY 122 5.690 -7.667 -2.072 672 1HA GLY 122 2HA GLY 122 6.727 -5.850 -1.095 673 2HA GLY 122 1HA GLY 122 8.079 -6.519 -1.978 674 H GLU 123 H GLU 123 5.186 -4.682 -2.906 675 HA GLU 123 HA GLU 123 6.906 -2.944 -4.533 676 1HB GLU 123 2HB GLU 123 4.086 -3.820 -4.683 677 2HB GLU 123 1HB GLU 123 4.411 -2.173 -5.205 678 1HG GLU 123 2HG GLU 123 6.279 -4.144 -6.276 679 2HG GLU 123 1HG GLU 123 4.606 -4.395 -6.764 680 H SER 124 H SER 124 6.708 -0.684 -4.505 681 HA SER 124 HA SER 124 5.715 0.391 -1.950 682 1HB SER 124 2HB SER 124 7.764 1.609 -3.823 683 2HB SER 124 1HB SER 124 7.322 2.198 -2.220 684 HG SER 124 HG SER 124 8.354 -0.401 -2.640 685 H TYR 125 H TYR 125 3.879 1.503 -2.082 686 HA TYR 125 HA TYR 125 3.282 2.888 -4.606 687 1HB TYR 125 2HB TYR 125 1.490 1.289 -2.844 688 2HB TYR 125 1HB TYR 125 0.831 2.549 -3.864 689 HD1 TYR 125 1HD TYR 125 1.810 -0.863 -3.747 690 HD2 TYR 125 2HD TYR 125 1.485 2.479 -6.341 691 HE1 TYR 125 1HE TYR 125 1.841 -2.371 -5.685 692 HE2 TYR 125 2HE TYR 125 1.524 1.009 -8.275 693 HH TYR 125 HH TYR 125 2.256 -1.230 -8.885 694 H VAL 126 H VAL 126 1.873 4.667 -4.496 695 HA VAL 126 HA VAL 126 2.136 6.167 -1.961 696 HB VAL 126 HB VAL 126 2.606 7.052 -4.777 697 1HG1 VAL 126 1HG1 VAL 126 1.098 8.733 -4.398 698 2HG1 VAL 126 2HG1 VAL 126 2.534 9.450 -3.667 699 3HG1 VAL 126 3HG1 VAL 126 1.316 8.684 -2.648 700 1HG2 VAL 126 1HG2 VAL 126 4.647 7.625 -4.022 701 2HG2 VAL 126 2HG2 VAL 126 4.256 6.524 -2.700 702 3HG2 VAL 126 3HG2 VAL 126 4.019 8.262 -2.502 703 H CYS 127 H CYS 127 0.372 7.150 -1.141 704 HA CYS 127 HA CYS 127 -2.170 6.632 -2.462 705 1HB CYS 127 2HB CYS 127 -1.370 7.436 0.320 706 2HB CYS 127 1HB CYS 127 -3.038 7.605 -0.218 707 HG CYS 127 HG CYS 127 -1.788 4.796 -0.459 708 H SER 128 H SER 128 -3.169 8.125 -3.625 709 HA SER 128 HA SER 128 -2.649 10.963 -3.054 710 1HB SER 128 2HB SER 128 -2.934 9.743 -5.813 711 2HB SER 128 1HB SER 128 -2.637 11.444 -5.444 712 HG SER 128 HG SER 128 -0.882 9.376 -5.594 713 H SER 129 H SER 129 -4.449 12.043 -2.615 714 HA SER 129 HA SER 129 -7.024 10.844 -3.226 715 1HB SER 129 2HB SER 129 -6.103 13.086 -1.459 716 2HB SER 129 1HB SER 129 -7.801 12.978 -1.918 717 HG SER 129 HG SER 129 -7.452 11.859 0.008 718 H ASP 130 H ASP 130 -5.460 14.004 -3.658 719 HA ASP 130 HA ASP 130 -6.701 14.281 -6.272 720 1HB ASP 130 2HB ASP 130 -8.034 15.385 -4.177 721 2HB ASP 130 1HB ASP 130 -6.961 16.712 -4.609 722 H ASN 131 H ASN 131 -4.649 15.681 -3.769 723 HA ASN 131 HA ASN 131 -3.272 17.617 -5.100 724 1HB ASN 131 2HB ASN 131 -1.241 16.697 -3.676 725 2HB ASN 131 1HB ASN 131 -2.622 17.463 -2.901 726 1HD2 ASN 131 1HD2 ASN 131 -2.315 14.202 -4.260 727 2HD2 ASN 131 2HD2 ASN 131 -2.634 13.370 -2.781 728 H PHE 132 H PHE 132 -0.904 17.497 -5.795 729 HA PHE 132 HA PHE 132 -0.732 15.575 -7.965 730 1HB PHE 132 2HB PHE 132 0.358 18.216 -7.392 731 2HB PHE 132 1HB PHE 132 1.585 17.116 -8.012 732 HD1 PHE 132 1HD PHE 132 0.576 15.599 -10.049 733 HD2 PHE 132 2HD PHE 132 -0.643 19.531 -8.968 734 HE1 PHE 132 1HE PHE 132 -0.245 15.970 -12.339 735 HE2 PHE 132 2HE PHE 132 -1.465 19.909 -11.256 736 HZ PHE 132 HZ PHE 132 -1.267 18.127 -12.945 737 H PHE 133 H PHE 133 1.200 14.316 -8.354 738 HA PHE 133 HA PHE 133 2.117 13.017 -5.976 739 1HB PHE 133 2HB PHE 133 1.693 11.818 -8.114 740 2HB PHE 133 1HB PHE 133 3.072 12.651 -8.824 741 HD1 PHE 133 1HD PHE 133 5.333 12.365 -7.563 742 HD2 PHE 133 2HD PHE 133 1.997 9.760 -7.126 743 HE1 PHE 133 1HE PHE 133 6.828 10.594 -6.736 744 HE2 PHE 133 2HE PHE 133 3.486 7.985 -6.298 745 HZ PHE 133 HZ PHE 133 5.906 8.402 -6.103 746 H LYS 134 H LYS 134 3.867 13.436 -4.808 747 HA LYS 134 HA LYS 134 5.827 15.350 -5.868 748 1HB LYS 134 2HB LYS 134 5.107 14.553 -3.047 749 2HB LYS 134 1HB LYS 134 6.504 15.548 -3.433 750 1HG LYS 134 2HG LYS 134 5.035 17.210 -3.029 751 2HG LYS 134 1HG LYS 134 4.631 16.942 -4.726 752 1HD LYS 134 2HD LYS 134 2.882 15.299 -3.899 753 2HD LYS 134 1HD LYS 134 3.174 15.953 -2.287 754 1HE LYS 134 2HE LYS 134 2.567 17.792 -4.564 755 2HE LYS 134 1HE LYS 134 1.259 16.930 -3.756 756 1HZ LYS 134 1HZ LYS 134 2.243 17.868 -1.626 757 2HZ LYS 134 2HZ LYS 134 1.427 18.951 -2.637 758 3HZ LYS 134 3HZ LYS 134 3.118 18.925 -2.616 759 H LYS 135 H LYS 135 7.709 14.581 -6.543 760 HA LYS 135 HA LYS 135 8.483 11.864 -6.004 761 1HB LYS 135 2HB LYS 135 10.040 14.015 -7.445 762 2HB LYS 135 1HB LYS 135 10.327 12.282 -7.516 763 1HG LYS 135 2HG LYS 135 9.153 12.456 -9.425 764 2HG LYS 135 1HG LYS 135 7.773 12.344 -8.330 765 1HD LYS 135 2HD LYS 135 7.158 14.476 -8.696 766 2HD LYS 135 1HD LYS 135 8.823 15.059 -8.678 767 1HE LYS 135 2HE LYS 135 8.572 15.354 -10.879 768 2HE LYS 135 1HE LYS 135 8.721 13.603 -11.002 769 1HZ LYS 135 1HZ LYS 135 6.749 14.576 -12.142 770 2HZ LYS 135 2HZ LYS 135 6.130 14.996 -10.625 771 3HZ LYS 135 3HZ LYS 135 6.376 13.368 -11.017 772 H VAL 136 H VAL 136 9.041 11.604 -3.887 773 HA VAL 136 HA VAL 136 11.352 13.173 -2.940 774 HB VAL 136 HB VAL 136 10.263 12.140 -0.636 775 1HG1 VAL 136 1HG1 VAL 136 10.932 14.258 -0.348 776 2HG1 VAL 136 2HG1 VAL 136 9.234 14.631 -0.641 777 3HG1 VAL 136 3HG1 VAL 136 10.405 14.759 -1.954 778 1HG2 VAL 136 1HG2 VAL 136 7.926 12.518 -0.593 779 2HG2 VAL 136 2HG2 VAL 136 8.236 11.506 -2.004 780 3HG2 VAL 136 3HG2 VAL 136 7.939 13.232 -2.206 781 H GLU 137 H GLU 137 12.226 11.815 -0.848 782 HA GLU 137 HA GLU 137 13.303 9.431 -2.039 783 1HB GLU 137 2HB GLU 137 13.742 10.810 0.607 784 2HB GLU 137 1HB GLU 137 14.475 9.254 0.241 785 1HG GLU 137 2HG GLU 137 15.291 10.532 -1.913 786 2HG GLU 137 1HG GLU 137 15.060 11.940 -0.878 787 H TYR 138 H TYR 138 10.977 8.726 -2.162 788 HA TYR 138 HA TYR 138 9.488 7.777 -0.045 789 1HB TYR 138 2HB TYR 138 9.823 7.004 -2.906 790 2HB TYR 138 1HB TYR 138 8.784 6.023 -1.866 791 HD1 TYR 138 1HD TYR 138 8.669 8.481 -4.222 792 HD2 TYR 138 2HD TYR 138 7.231 7.712 -0.293 793 HE1 TYR 138 1HE TYR 138 6.836 10.081 -4.586 794 HE2 TYR 138 2HE TYR 138 5.394 9.310 -0.645 795 HH TYR 138 HH TYR 138 4.137 10.229 -2.780 796 H THR 139 H THR 139 12.329 6.391 -1.555 797 HA THR 139 HA THR 139 12.476 4.417 0.580 798 HB THR 139 HB THR 139 12.555 2.513 -0.762 799 HG1 THR 139 1HG THR 139 12.784 4.146 -3.065 800 1HG2 THR 139 1HG2 THR 139 10.672 2.614 -2.393 801 2HG2 THR 139 2HG2 THR 139 10.555 4.342 -2.059 802 3HG2 THR 139 3HG2 THR 139 10.274 3.174 -0.768 803 H LYS 140 H LYS 140 13.977 6.816 -0.869 804 HA LYS 140 HA LYS 140 16.525 5.677 -1.505 805 1HB LYS 140 2HB LYS 140 15.375 8.408 -1.328 806 2HB LYS 140 1HB LYS 140 17.118 8.269 -1.140 807 1HG LYS 140 2HG LYS 140 16.825 8.649 -3.411 808 2HG LYS 140 1HG LYS 140 17.046 6.902 -3.305 809 1HD LYS 140 2HD LYS 140 14.269 7.901 -3.114 810 2HD LYS 140 1HD LYS 140 15.054 8.047 -4.688 811 1HE LYS 140 2HE LYS 140 15.637 5.628 -4.541 812 2HE LYS 140 1HE LYS 140 14.672 5.533 -3.068 813 1HZ LYS 140 1HZ LYS 140 13.463 4.829 -5.079 814 2HZ LYS 140 2HZ LYS 140 13.620 6.391 -5.708 815 3HZ LYS 140 3HZ LYS 140 12.723 6.136 -4.297 816 H ASN 141 H ASN 141 17.930 4.952 -0.145 817 HA ASN 141 HA ASN 141 19.212 4.655 1.682 818 1HB ASN 141 2HB ASN 141 18.449 7.520 1.933 819 2HB ASN 141 1HB ASN 141 19.168 6.742 3.340 820 1HD2 ASN 141 1HD2 ASN 141 19.651 7.491 -0.056 821 2HD2 ASN 141 2HD2 ASN 141 21.377 7.448 -0.011 822 H VAL 142 H VAL 142 16.097 4.379 1.681 823 HA VAL 142 HA VAL 142 15.606 4.358 4.555 824 HB VAL 142 HB VAL 142 13.717 3.621 2.314 825 1HG1 VAL 142 1HG1 VAL 142 11.970 3.945 4.005 826 2HG1 VAL 142 2HG1 VAL 142 13.210 4.255 5.221 827 3HG1 VAL 142 3HG1 VAL 142 13.093 2.664 4.467 828 1HG2 VAL 142 1HG2 VAL 142 12.799 5.981 3.254 829 2HG2 VAL 142 2HG2 VAL 142 13.856 5.824 1.852 830 3HG2 VAL 142 3HG2 VAL 142 14.538 6.220 3.430 831 H ASN 143 H ASN 143 14.927 2.481 5.675 832 HA ASN 143 HA ASN 143 16.285 0.094 4.847 833 1HB ASN 143 2HB ASN 143 15.381 -0.839 6.982 834 2HB ASN 143 1HB ASN 143 16.288 0.655 7.190 835 1HD2 ASN 143 1HD2 ASN 143 14.003 -0.760 8.641 836 2HD2 ASN 143 2HD2 ASN 143 12.853 0.502 8.911 837 HA PRO 144 HA PRO 144 12.502 -1.436 2.918 838 1HB PRO 144 2HB PRO 144 13.651 -3.003 1.103 839 2HB PRO 144 1HB PRO 144 13.745 -1.243 0.962 840 1HG PRO 144 2HG PRO 144 15.818 -3.187 1.854 841 2HG PRO 144 1HG PRO 144 16.008 -1.684 0.935 842 1HD PRO 144 2HD PRO 144 16.403 -2.020 3.710 843 2HD PRO 144 1HD PRO 144 16.306 -0.480 2.836 844 H ASN 145 H ASN 145 13.541 -2.560 5.426 845 HA ASN 145 HA ASN 145 13.526 -5.434 5.005 846 1HB ASN 145 2HB ASN 145 13.792 -3.787 7.526 847 2HB ASN 145 1HB ASN 145 13.891 -5.545 7.462 848 1HD2 ASN 145 1HD2 ASN 145 15.961 -5.864 8.011 849 2HD2 ASN 145 2HD2 ASN 145 17.317 -5.252 7.132 850 H TRP 146 H TRP 146 11.099 -3.471 4.772 851 HA TRP 146 HA TRP 146 9.287 -4.360 6.787 852 1HB TRP 146 2HB TRP 146 7.559 -3.433 5.047 853 2HB TRP 146 1HB TRP 146 8.605 -2.329 5.930 854 HD1 TRP 146 HD TRP 146 10.330 -0.924 4.556 855 HE1 TRP 146 1HE TRP 146 10.714 -0.562 2.035 856 HE3 TRP 146 3HE TRP 146 7.445 -4.735 2.733 857 HZ2 TRP 146 2HZ TRP 146 9.900 -1.739 -0.399 858 HZ3 TRP 146 3HZ TRP 146 7.301 -5.042 0.314 859 HH2 TRP 146 HH TRP 146 8.499 -3.582 -1.226 860 H SER 147 H SER 147 10.107 -5.414 3.551 861 HA SER 147 HA SER 147 7.931 -7.307 3.415 862 1HB SER 147 2HB SER 147 9.508 -8.072 1.383 863 2HB SER 147 1HB SER 147 8.420 -6.688 1.267 864 HG SER 147 HG SER 147 10.080 -5.382 1.235 865 H VAL 148 H VAL 148 11.107 -7.249 4.685 866 HA VAL 148 HA VAL 148 11.428 -10.144 4.583 867 HB VAL 148 HB VAL 148 13.252 -8.187 5.968 868 1HG1 VAL 148 1HG1 VAL 148 13.441 -11.031 5.073 869 2HG1 VAL 148 2HG1 VAL 148 13.903 -10.305 6.613 870 3HG1 VAL 148 3HG1 VAL 148 14.901 -10.047 5.182 871 1HG2 VAL 148 1HG2 VAL 148 14.526 -8.673 3.643 872 2HG2 VAL 148 2HG2 VAL 148 13.502 -7.264 3.919 873 3HG2 VAL 148 3HG2 VAL 148 12.852 -8.677 3.086 874 H ASN 149 H ASN 149 9.195 -9.310 6.061 875 HA ASN 149 HA ASN 149 9.904 -10.385 8.673 876 1HB ASN 149 2HB ASN 149 8.779 -7.652 8.197 877 2HB ASN 149 1HB ASN 149 8.281 -8.543 9.632 878 1HD2 ASN 149 1HD2 ASN 149 9.988 -9.312 11.057 879 2HD2 ASN 149 2HD2 ASN 149 11.430 -8.372 11.214 880 H VAL 150 H VAL 150 8.578 -11.620 6.553 881 HA VAL 150 HA VAL 150 5.934 -12.027 7.761 882 HB VAL 150 HB VAL 150 4.979 -12.338 5.458 883 1HG1 VAL 150 1HG1 VAL 150 5.231 -9.697 5.011 884 2HG1 VAL 150 2HG1 VAL 150 5.787 -9.780 6.683 885 3HG1 VAL 150 3HG1 VAL 150 4.185 -10.381 6.255 886 1HG2 VAL 150 1HG2 VAL 150 6.635 -12.577 3.918 887 2HG2 VAL 150 2HG2 VAL 150 7.723 -11.467 4.751 888 3HG2 VAL 150 3HG2 VAL 150 6.396 -10.835 3.776 Start of MODEL 6 1 1H GLY 38 1HT GLY 38 6.701 -16.078 17.475 2 2H GLY 38 2HT GLY 38 5.850 -17.508 17.777 3 3H GLY 38 3HT GLY 38 5.021 -16.037 17.673 4 1HA GLY 38 1HA GLY 38 5.558 -15.828 15.346 5 2HA GLY 38 2HA GLY 38 6.503 -17.306 15.437 6 H ALA 39 H ALA 39 4.731 -17.388 13.539 7 HA ALA 39 HA ALA 39 2.188 -18.412 14.499 8 1HB ALA 39 1HB ALA 39 2.830 -18.630 11.633 9 2HB ALA 39 2HB ALA 39 2.821 -16.995 12.294 10 3HB ALA 39 3HB ALA 39 1.385 -18.010 12.432 11 H MET 40 H MET 40 1.357 -20.494 13.747 12 HA MET 40 HA MET 40 3.417 -22.545 13.949 13 1HB MET 40 2HB MET 40 1.582 -24.087 14.376 14 2HB MET 40 1HB MET 40 1.453 -22.680 15.423 15 1HG MET 40 2HG MET 40 -0.251 -21.737 13.953 16 2HG MET 40 1HG MET 40 -0.119 -23.143 12.898 17 1HE MET 40 1HE MET 40 -3.542 -24.019 14.337 18 2HE MET 40 2HE MET 40 -2.546 -23.706 12.917 19 3HE MET 40 3HE MET 40 -3.026 -22.374 13.968 20 H ASP 41 H ASP 41 3.416 -21.187 11.501 21 HA ASP 41 HA ASP 41 1.983 -22.767 9.558 22 1HB ASP 41 2HB ASP 41 3.742 -20.371 9.498 23 2HB ASP 41 1HB ASP 41 3.668 -21.346 8.033 24 HA PRO 42 HA PRO 42 5.046 -25.899 8.986 25 1HB PRO 42 2HB PRO 42 4.577 -26.546 6.376 26 2HB PRO 42 1HB PRO 42 3.540 -27.062 7.710 27 1HG PRO 42 2HG PRO 42 3.176 -24.796 5.792 28 2HG PRO 42 1HG PRO 42 1.976 -25.947 6.408 29 1HD PRO 42 2HD PRO 42 2.201 -23.432 7.378 30 2HD PRO 42 1HD PRO 42 1.713 -24.803 8.396 31 H GLU 43 H GLU 43 4.768 -23.725 6.169 32 HA GLU 43 HA GLU 43 6.332 -22.466 5.085 33 1HB GLU 43 2HB GLU 43 7.438 -22.696 7.603 34 2HB GLU 43 1HB GLU 43 8.713 -23.305 6.558 35 1HG GLU 43 2HG GLU 43 9.289 -21.151 6.414 36 2HG GLU 43 1HG GLU 43 8.000 -21.078 5.213 37 H PHE 44 H PHE 44 6.241 -25.747 5.277 38 HA PHE 44 HA PHE 44 7.725 -26.036 2.830 39 1HB PHE 44 2HB PHE 44 8.949 -26.711 5.361 40 2HB PHE 44 1HB PHE 44 8.793 -28.141 4.345 41 HD1 PHE 44 1HD PHE 44 9.399 -27.546 1.749 42 HD2 PHE 44 2HD PHE 44 10.959 -25.639 5.218 43 HE1 PHE 44 1HE PHE 44 11.386 -26.858 0.471 44 HE2 PHE 44 2HE PHE 44 12.949 -24.946 3.947 45 HZ PHE 44 HZ PHE 44 13.164 -25.555 1.571 46 H ALA 45 H ALA 45 4.986 -26.427 3.920 47 HA ALA 45 HA ALA 45 4.514 -29.256 3.981 48 1HB ALA 45 1HB ALA 45 2.873 -26.807 4.175 49 2HB ALA 45 2HB ALA 45 2.844 -28.275 5.151 50 3HB ALA 45 3HB ALA 45 2.060 -28.250 3.572 51 H LEU 46 H LEU 46 2.464 -29.860 2.430 52 HA LEU 46 HA LEU 46 3.618 -29.870 -0.217 53 1HB LEU 46 2HB LEU 46 1.029 -31.085 0.747 54 2HB LEU 46 1HB LEU 46 1.831 -31.425 -0.775 55 HG LEU 46 HG LEU 46 3.808 -32.076 0.951 56 1HD1 LEU 46 1HD1 LEU 46 1.205 -32.465 2.386 57 2HD1 LEU 46 2HD1 LEU 46 2.709 -31.767 2.985 58 3HD1 LEU 46 3HD1 LEU 46 2.596 -33.503 2.697 59 1HD2 LEU 46 1HD2 LEU 46 1.666 -33.569 -0.434 60 2HD2 LEU 46 2HD2 LEU 46 2.589 -34.451 0.782 61 3HD2 LEU 46 3HD2 LEU 46 3.419 -33.697 -0.579 62 H SER 47 H SER 47 3.046 -27.296 0.272 63 HA SER 47 HA SER 47 1.141 -26.684 -1.779 64 1HB SER 47 2HB SER 47 -0.168 -26.984 0.457 65 2HB SER 47 1HB SER 47 0.526 -25.417 0.875 66 HG SER 47 HG SER 47 -1.614 -25.515 -0.270 67 H ASN 48 H ASN 48 1.083 -24.357 -2.268 68 HA ASN 48 HA ASN 48 3.714 -23.209 -1.949 69 1HB ASN 48 2HB ASN 48 1.260 -22.386 -3.500 70 2HB ASN 48 1HB ASN 48 2.700 -21.375 -3.415 71 1HD2 ASN 48 1HD2 ASN 48 1.721 -24.704 -4.137 72 2HD2 ASN 48 2HD2 ASN 48 2.839 -24.933 -5.434 73 H GLU 49 H GLU 49 3.473 -20.579 -1.803 74 HA GLU 49 HA GLU 49 1.621 -19.724 0.220 75 1HB GLU 49 2HB GLU 49 4.445 -20.397 0.900 76 2HB GLU 49 1HB GLU 49 3.723 -18.987 1.662 77 1HG GLU 49 2HG GLU 49 1.788 -20.895 1.995 78 2HG GLU 49 1HG GLU 49 3.279 -21.822 2.158 79 H LYS 50 H LYS 50 2.708 -19.005 -2.503 80 HA LYS 50 HA LYS 50 3.827 -16.356 -1.987 81 1HB LYS 50 2HB LYS 50 4.092 -16.264 -4.465 82 2HB LYS 50 1HB LYS 50 4.953 -17.596 -3.708 83 1HG LYS 50 2HG LYS 50 2.384 -18.545 -4.406 84 2HG LYS 50 1HG LYS 50 3.026 -17.670 -5.797 85 1HD LYS 50 2HD LYS 50 4.649 -19.714 -4.307 86 2HD LYS 50 1HD LYS 50 3.569 -20.159 -5.629 87 1HE LYS 50 2HE LYS 50 4.860 -18.228 -6.876 88 2HE LYS 50 1HE LYS 50 6.104 -18.598 -5.682 89 1HZ LYS 50 1HZ LYS 50 5.868 -19.861 -8.014 90 2HZ LYS 50 2HZ LYS 50 4.944 -20.887 -7.037 91 3HZ LYS 50 3HZ LYS 50 6.556 -20.566 -6.639 92 H LYS 51 H LYS 51 1.056 -16.984 -1.309 93 HA LYS 51 HA LYS 51 -0.595 -15.709 -3.293 94 1HB LYS 51 2HB LYS 51 -1.001 -17.313 -0.956 95 2HB LYS 51 1HB LYS 51 -1.947 -15.839 -0.802 96 1HG LYS 51 2HG LYS 51 -3.428 -17.227 -1.864 97 2HG LYS 51 1HG LYS 51 -2.694 -16.390 -3.234 98 1HD LYS 51 2HD LYS 51 -1.478 -18.238 -3.883 99 2HD LYS 51 1HD LYS 51 -1.486 -18.942 -2.265 100 1HE LYS 51 2HE LYS 51 -4.015 -19.203 -2.607 101 2HE LYS 51 1HE LYS 51 -3.679 -18.912 -4.313 102 1HZ LYS 51 1HZ LYS 51 -1.877 -20.786 -3.778 103 2HZ LYS 51 2HZ LYS 51 -3.439 -21.135 -4.325 104 3HZ LYS 51 3HZ LYS 51 -3.080 -21.235 -2.675 105 H ALA 52 H ALA 52 -1.930 -13.817 -2.805 106 HA ALA 52 HA ALA 52 -2.184 -11.628 -2.246 107 1HB ALA 52 1HB ALA 52 -0.548 -11.749 0.194 108 2HB ALA 52 2HB ALA 52 -1.873 -12.911 0.114 109 3HB ALA 52 3HB ALA 52 -2.203 -11.185 -0.039 110 H LYS 53 H LYS 53 -0.738 -9.647 -1.339 111 HA LYS 53 HA LYS 53 1.987 -9.857 -2.365 112 1HB LYS 53 2HB LYS 53 -0.152 -8.064 -3.480 113 2HB LYS 53 1HB LYS 53 1.546 -7.619 -3.587 114 1HG LYS 53 2HG LYS 53 1.869 -8.969 -5.315 115 2HG LYS 53 1HG LYS 53 1.141 -10.333 -4.465 116 1HD LYS 53 2HD LYS 53 -0.587 -8.190 -5.639 117 2HD LYS 53 1HD LYS 53 0.058 -9.475 -6.663 118 1HE LYS 53 2HE LYS 53 -1.312 -10.175 -4.104 119 2HE LYS 53 1HE LYS 53 -2.278 -9.738 -5.511 120 1HZ LYS 53 1HZ LYS 53 -0.607 -11.489 -6.600 121 2HZ LYS 53 2HZ LYS 53 -2.095 -11.929 -5.927 122 3HZ LYS 53 3HZ LYS 53 -0.674 -12.112 -5.028 123 H LYS 54 H LYS 54 3.389 -8.742 -1.156 124 HA LYS 54 HA LYS 54 2.350 -7.078 0.976 125 1HB LYS 54 2HB LYS 54 4.578 -8.862 0.681 126 2HB LYS 54 1HB LYS 54 5.174 -7.270 1.127 127 1HG LYS 54 2HG LYS 54 4.810 -8.047 3.208 128 2HG LYS 54 1HG LYS 54 3.168 -7.486 2.883 129 1HD LYS 54 2HD LYS 54 3.598 -10.171 1.882 130 2HD LYS 54 1HD LYS 54 3.942 -10.057 3.609 131 1HE LYS 54 2HE LYS 54 1.424 -8.983 2.361 132 2HE LYS 54 1HE LYS 54 1.561 -10.627 2.983 133 1HZ LYS 54 1HZ LYS 54 1.932 -9.818 5.158 134 2HZ LYS 54 2HZ LYS 54 0.607 -8.955 4.559 135 3HZ LYS 54 3HZ LYS 54 2.131 -8.225 4.624 136 H VAL 55 H VAL 55 2.336 -4.994 0.823 137 HA VAL 55 HA VAL 55 4.280 -3.648 -0.939 138 HB VAL 55 HB VAL 55 2.543 -1.929 -1.413 139 1HG1 VAL 55 1HG1 VAL 55 3.058 -4.049 -2.834 140 2HG1 VAL 55 2HG1 VAL 55 1.687 -3.010 -3.228 141 3HG1 VAL 55 3HG1 VAL 55 1.427 -4.521 -2.353 142 1HG2 VAL 55 1HG2 VAL 55 0.983 -2.078 0.283 143 2HG2 VAL 55 2HG2 VAL 55 0.867 -3.835 0.158 144 3HG2 VAL 55 3HG2 VAL 55 0.142 -2.817 -1.083 145 H ARG 56 H ARG 56 4.819 -1.517 -0.394 146 HA ARG 56 HA ARG 56 4.408 -0.850 2.438 147 1HB ARG 56 2HB ARG 56 6.768 -0.979 0.914 148 2HB ARG 56 1HB ARG 56 6.433 0.737 1.090 149 1HG ARG 56 2HG ARG 56 6.372 -1.075 3.468 150 2HG ARG 56 1HG ARG 56 7.899 -0.448 2.847 151 1HD ARG 56 2HD ARG 56 7.529 1.578 3.708 152 2HD ARG 56 1HD ARG 56 5.878 1.622 3.092 153 HE ARG 56 HE ARG 56 5.156 1.076 5.179 154 1HH1 ARG 56 1HH1 ARG 56 8.484 0.070 4.886 155 2HH1 ARG 56 2HH1 ARG 56 8.607 -0.438 6.537 156 1HH2 ARG 56 1HH2 ARG 56 5.315 0.408 7.351 157 2HH2 ARG 56 2HH2 ARG 56 6.808 -0.246 7.937 158 H PHE 57 H PHE 57 2.686 0.477 2.541 159 HA PHE 57 HA PHE 57 2.138 2.268 0.335 160 1HB PHE 57 2HB PHE 57 0.626 1.552 2.836 161 2HB PHE 57 1HB PHE 57 0.094 2.833 1.754 162 HD1 PHE 57 1HD PHE 57 -1.571 0.498 2.426 163 HD2 PHE 57 2HD PHE 57 1.274 1.025 -0.704 164 HE1 PHE 57 1HE PHE 57 -2.761 -1.158 1.055 165 HE2 PHE 57 2HE PHE 57 0.079 -0.613 -2.072 166 HZ PHE 57 HZ PHE 57 -1.943 -1.712 -1.197 167 H TYR 58 H TYR 58 2.527 4.297 0.231 168 HA TYR 58 HA TYR 58 3.361 5.786 2.626 169 1HB TYR 58 2HB TYR 58 4.374 6.251 -0.166 170 2HB TYR 58 1HB TYR 58 4.925 7.030 1.297 171 HD1 TYR 58 1HD TYR 58 6.361 5.840 2.884 172 HD2 TYR 58 2HD TYR 58 5.121 4.014 -0.751 173 HE1 TYR 58 1HE TYR 58 8.101 4.125 3.159 174 HE2 TYR 58 2HE TYR 58 6.854 2.292 -0.485 175 HH TYR 58 HH TYR 58 9.369 2.554 1.802 176 H ARG 59 H ARG 59 2.713 7.915 2.757 177 HA ARG 59 HA ARG 59 0.397 8.569 1.088 178 1HB ARG 59 2HB ARG 59 1.280 10.159 3.478 179 2HB ARG 59 1HB ARG 59 -0.335 9.990 2.807 180 1HG ARG 59 2HG ARG 59 -0.347 7.629 3.569 181 2HG ARG 59 1HG ARG 59 1.210 7.917 4.348 182 1HD ARG 59 2HD ARG 59 -1.464 9.122 5.003 183 2HD ARG 59 1HD ARG 59 -0.406 8.168 6.038 184 HE ARG 59 HE ARG 59 0.543 10.772 5.106 185 1HH1 ARG 59 1HH1 ARG 59 -0.663 8.802 7.734 186 2HH1 ARG 59 2HH1 ARG 59 -0.139 9.907 8.957 187 1HH2 ARG 59 1HH2 ARG 59 1.222 12.214 6.716 188 2HH2 ARG 59 2HH2 ARG 59 0.928 11.842 8.382 189 H ASN 60 H ASN 60 0.716 9.825 -0.601 190 HA ASN 60 HA ASN 60 3.012 11.057 -1.384 191 1HB ASN 60 2HB ASN 60 1.162 10.777 -2.900 192 2HB ASN 60 1HB ASN 60 0.168 11.879 -1.962 193 1HD2 ASN 60 1HD2 ASN 60 -0.058 12.877 -4.107 194 2HD2 ASN 60 2HD2 ASN 60 1.115 14.052 -4.586 195 H GLY 61 H GLY 61 4.053 12.937 -1.074 196 1HA GLY 61 2HA GLY 61 4.696 14.876 -0.025 197 2HA GLY 61 1HA GLY 61 2.994 15.315 -0.066 198 H ASP 62 H ASP 62 5.417 13.516 1.790 199 HA ASP 62 HA ASP 62 4.088 14.375 4.242 200 1HB ASP 62 2HB ASP 62 4.143 12.118 5.211 201 2HB ASP 62 1HB ASP 62 3.112 12.177 3.784 202 H ARG 63 H ARG 63 6.822 12.621 2.822 203 HA ARG 63 HA ARG 63 8.950 12.252 3.621 204 1HB ARG 63 2HB ARG 63 10.236 14.323 3.692 205 2HB ARG 63 1HB ARG 63 9.098 14.329 2.354 206 1HG ARG 63 2HG ARG 63 7.559 15.612 3.996 207 2HG ARG 63 1HG ARG 63 9.055 15.921 4.878 208 1HD ARG 63 2HD ARG 63 9.575 16.422 2.150 209 2HD ARG 63 1HD ARG 63 8.041 17.200 2.534 210 HE ARG 63 HE ARG 63 10.120 17.713 4.455 211 1HH1 ARG 63 1HH1 ARG 63 8.679 18.744 1.447 212 2HH1 ARG 63 2HH1 ARG 63 9.256 20.371 1.585 213 1HH2 ARG 63 1HH2 ARG 63 10.879 19.853 4.635 214 2HH2 ARG 63 2HH2 ARG 63 10.505 21.000 3.393 215 H TYR 64 H TYR 64 7.056 11.941 5.738 216 HA TYR 64 HA TYR 64 8.843 12.296 7.976 217 1HB TYR 64 2HB TYR 64 6.504 14.006 7.549 218 2HB TYR 64 1HB TYR 64 6.514 13.210 9.116 219 HD1 TYR 64 1HD TYR 64 8.070 15.736 7.021 220 HD2 TYR 64 2HD TYR 64 8.348 13.648 10.717 221 HE1 TYR 64 1HE TYR 64 9.645 17.430 7.851 222 HE2 TYR 64 2HE TYR 64 9.923 15.338 11.561 223 HH TYR 64 HH TYR 64 11.348 17.706 9.515 224 H PHE 65 H PHE 65 7.594 10.119 6.443 225 HA PHE 65 HA PHE 65 6.780 8.494 8.659 226 1HB PHE 65 2HB PHE 65 4.654 9.620 8.168 227 2HB PHE 65 1HB PHE 65 4.760 9.104 6.488 228 HD1 PHE 65 1HD PHE 65 5.258 7.320 9.730 229 HD2 PHE 65 2HD PHE 65 3.132 7.558 6.051 230 HE1 PHE 65 1HE PHE 65 4.056 5.249 10.295 231 HE2 PHE 65 2HE PHE 65 1.928 5.487 6.606 232 HZ PHE 65 HZ PHE 65 2.387 4.330 8.733 233 H LYS 66 H LYS 66 7.354 6.429 8.295 234 HA LYS 66 HA LYS 66 8.648 5.769 5.825 235 1HB LYS 66 2HB LYS 66 8.109 4.188 8.336 236 2HB LYS 66 1HB LYS 66 8.966 3.524 6.950 237 1HG LYS 66 2HG LYS 66 9.841 6.008 8.401 238 2HG LYS 66 1HG LYS 66 10.415 4.387 8.800 239 1HD LYS 66 2HD LYS 66 10.965 4.282 6.242 240 2HD LYS 66 1HD LYS 66 10.928 6.041 6.367 241 1HE LYS 66 2HE LYS 66 12.439 5.268 8.546 242 2HE LYS 66 1HE LYS 66 12.936 4.145 7.281 243 1HZ LYS 66 1HZ LYS 66 13.354 7.011 7.484 244 2HZ LYS 66 2HZ LYS 66 12.970 6.438 5.941 245 3HZ LYS 66 3HZ LYS 66 14.317 5.823 6.759 246 H GLY 67 H GLY 67 5.440 5.772 6.632 247 1HA GLY 67 2HA GLY 67 3.690 5.035 5.266 248 2HA GLY 67 1HA GLY 67 4.822 3.993 4.422 249 H ILE 68 H ILE 68 2.512 2.853 4.891 250 HA ILE 68 HA ILE 68 3.005 1.106 7.212 251 HB ILE 68 HB ILE 68 1.044 2.434 7.693 252 1HG1 ILE 68 2HG1 ILE 68 -0.041 -0.235 6.825 253 2HG1 ILE 68 1HG1 ILE 68 1.125 -0.109 8.137 254 1HG2 ILE 68 1HG2 ILE 68 0.611 2.705 5.103 255 2HG2 ILE 68 2HG2 ILE 68 -0.694 2.872 6.279 256 3HG2 ILE 68 3HG2 ILE 68 -0.493 1.361 5.390 257 1HD1 ILE 68 1HD1 ILE 68 -1.413 -0.154 8.652 258 2HD1 ILE 68 2HD1 ILE 68 -1.351 1.549 8.195 259 3HD1 ILE 68 3HD1 ILE 68 -0.362 0.957 9.530 260 H VAL 69 H VAL 69 2.890 -1.070 6.879 261 HA VAL 69 HA VAL 69 2.867 -1.948 4.113 262 HB VAL 69 HB VAL 69 3.349 -3.589 6.605 263 1HG1 VAL 69 1HG1 VAL 69 2.822 -4.464 4.061 264 2HG1 VAL 69 2HG1 VAL 69 3.704 -5.367 5.291 265 3HG1 VAL 69 3HG1 VAL 69 4.584 -4.420 4.090 266 1HG2 VAL 69 1HG2 VAL 69 4.910 -1.548 5.892 267 2HG2 VAL 69 2HG2 VAL 69 5.575 -2.785 4.824 268 3HG2 VAL 69 3HG2 VAL 69 5.554 -3.044 6.568 269 H TYR 70 H TYR 70 1.324 -3.109 3.142 270 HA TYR 70 HA TYR 70 -0.823 -4.263 4.735 271 1HB TYR 70 2HB TYR 70 -1.056 -1.999 2.919 272 2HB TYR 70 1HB TYR 70 -2.114 -3.327 2.456 273 HD1 TYR 70 1HD TYR 70 -4.250 -3.174 3.248 274 HD2 TYR 70 2HD TYR 70 -1.083 -1.659 5.652 275 HE1 TYR 70 1HE TYR 70 -5.880 -2.508 4.965 276 HE2 TYR 70 2HE TYR 70 -2.704 -0.990 7.377 277 HH TYR 70 HH TYR 70 -6.112 -1.043 6.817 278 H ALA 71 H ALA 71 -1.913 -5.935 3.757 279 HA ALA 71 HA ALA 71 -0.441 -7.264 1.596 280 1HB ALA 71 1HB ALA 71 -0.912 -9.247 2.571 281 2HB ALA 71 2HB ALA 71 -2.549 -8.761 3.009 282 3HB ALA 71 3HB ALA 71 -1.183 -8.260 4.007 283 H VAL 72 H VAL 72 -1.537 -7.993 -0.261 284 HA VAL 72 HA VAL 72 -4.364 -7.275 -0.479 285 HB VAL 72 HB VAL 72 -2.600 -6.542 -2.773 286 1HG1 VAL 72 1HG1 VAL 72 -5.211 -6.554 -2.613 287 2HG1 VAL 72 2HG1 VAL 72 -4.375 -5.239 -3.439 288 3HG1 VAL 72 3HG1 VAL 72 -4.964 -5.013 -1.792 289 1HG2 VAL 72 1HG2 VAL 72 -2.873 -5.014 -0.208 290 2HG2 VAL 72 2HG2 VAL 72 -2.619 -4.176 -1.738 291 3HG2 VAL 72 3HG2 VAL 72 -1.425 -5.338 -1.159 292 H SER 73 H SER 73 -5.523 -8.716 -1.484 293 HA SER 73 HA SER 73 -4.509 -10.350 -3.623 294 1HB SER 73 2HB SER 73 -3.985 -11.380 -1.183 295 2HB SER 73 1HB SER 73 -5.614 -12.011 -1.426 296 HG SER 73 HG SER 73 -4.386 -13.504 -2.381 297 H SER 74 H SER 74 -6.207 -11.689 -4.586 298 HA SER 74 HA SER 74 -8.611 -10.322 -4.901 299 1HB SER 74 2HB SER 74 -7.755 -11.898 -6.569 300 2HB SER 74 1HB SER 74 -8.025 -13.239 -5.457 301 HG SER 74 HG SER 74 -9.717 -12.318 -7.188 302 H ASP 75 H ASP 75 -7.659 -12.572 -2.466 303 HA ASP 75 HA ASP 75 -10.344 -13.267 -1.692 304 1HB ASP 75 2HB ASP 75 -7.638 -14.139 -1.091 305 2HB ASP 75 1HB ASP 75 -8.621 -14.004 0.356 306 H ARG 76 H ARG 76 -8.024 -10.822 -0.918 307 HA ARG 76 HA ARG 76 -9.355 -10.135 1.582 308 1HB ARG 76 2HB ARG 76 -6.826 -10.088 1.251 309 2HB ARG 76 1HB ARG 76 -7.083 -8.641 0.287 310 1HG ARG 76 2HG ARG 76 -7.809 -7.400 2.117 311 2HG ARG 76 1HG ARG 76 -8.147 -8.843 3.077 312 1HD ARG 76 2HD ARG 76 -5.471 -9.098 2.554 313 2HD ARG 76 1HD ARG 76 -5.655 -7.353 2.727 314 HE ARG 76 HE ARG 76 -5.815 -9.313 4.800 315 1HH1 ARG 76 1HH1 ARG 76 -6.955 -6.171 3.800 316 2HH1 ARG 76 2HH1 ARG 76 -7.267 -5.631 5.415 317 1HH2 ARG 76 1HH2 ARG 76 -6.226 -8.606 6.926 318 2HH2 ARG 76 2HH2 ARG 76 -6.852 -7.013 7.191 319 H PHE 77 H PHE 77 -8.615 -8.583 -1.537 320 HA PHE 77 HA PHE 77 -10.941 -6.836 -1.103 321 1HB PHE 77 2HB PHE 77 -8.332 -6.048 -2.417 322 2HB PHE 77 1HB PHE 77 -9.745 -5.014 -2.224 323 HD1 PHE 77 1HD PHE 77 -10.483 -4.397 0.097 324 HD2 PHE 77 2HD PHE 77 -6.743 -6.258 -0.709 325 HE1 PHE 77 1HE PHE 77 -9.648 -3.660 2.290 326 HE2 PHE 77 2HE PHE 77 -5.901 -5.523 1.483 327 HZ PHE 77 HZ PHE 77 -7.354 -4.222 2.986 328 H ARG 78 H ARG 78 -12.447 -7.167 -2.573 329 HA ARG 78 HA ARG 78 -12.069 -8.778 -4.847 330 1HB ARG 78 2HB ARG 78 -14.241 -7.413 -3.488 331 2HB ARG 78 1HB ARG 78 -14.426 -7.367 -5.228 332 1HG ARG 78 2HG ARG 78 -14.111 -9.818 -3.516 333 2HG ARG 78 1HG ARG 78 -15.574 -9.284 -4.343 334 1HD ARG 78 2HD ARG 78 -13.834 -9.389 -6.413 335 2HD ARG 78 1HD ARG 78 -13.204 -10.680 -5.392 336 HE ARG 78 HE ARG 78 -16.041 -10.832 -5.753 337 1HH1 ARG 78 1HH1 ARG 78 -12.959 -11.634 -7.181 338 2HH1 ARG 78 2HH1 ARG 78 -13.592 -12.948 -8.113 339 1HH2 ARG 78 1HH2 ARG 78 -16.875 -12.560 -6.977 340 2HH2 ARG 78 2HH2 ARG 78 -15.815 -13.476 -7.997 341 H SER 79 H SER 79 -11.540 -5.422 -4.329 342 HA SER 79 HA SER 79 -10.679 -5.082 -7.034 343 1HB SER 79 2HB SER 79 -13.075 -4.786 -7.391 344 2HB SER 79 1HB SER 79 -13.130 -3.557 -6.126 345 HG SER 79 HG SER 79 -12.359 -2.140 -7.479 346 H PHE 80 H PHE 80 -10.125 -2.709 -7.455 347 HA PHE 80 HA PHE 80 -8.219 -1.849 -5.594 348 1HB PHE 80 2HB PHE 80 -8.322 -1.336 -8.057 349 2HB PHE 80 1HB PHE 80 -9.569 -0.159 -7.700 350 HD1 PHE 80 1HD PHE 80 -6.073 -1.021 -6.681 351 HD2 PHE 80 2HD PHE 80 -8.980 2.016 -7.354 352 HE1 PHE 80 1HE PHE 80 -4.371 0.701 -6.258 353 HE2 PHE 80 2HE PHE 80 -7.281 3.741 -6.934 354 HZ PHE 80 HZ PHE 80 -4.977 3.084 -6.385 355 H ASP 81 H ASP 81 -11.509 -0.809 -6.213 356 HA ASP 81 HA ASP 81 -11.551 1.461 -4.567 357 1HB ASP 81 2HB ASP 81 -13.303 0.731 -6.271 358 2HB ASP 81 1HB ASP 81 -13.922 -0.349 -5.024 359 H ALA 82 H ALA 82 -12.079 -1.940 -3.860 360 HA ALA 82 HA ALA 82 -12.996 -1.578 -1.195 361 1HB ALA 82 1HB ALA 82 -11.695 -4.077 -1.446 362 2HB ALA 82 2HB ALA 82 -12.526 -3.740 -2.966 363 3HB ALA 82 3HB ALA 82 -13.424 -3.731 -1.447 364 H LEU 83 H LEU 83 -9.835 -2.109 -2.663 365 HA LEU 83 HA LEU 83 -8.366 -2.425 -0.268 366 1HB LEU 83 2HB LEU 83 -7.521 -3.013 -2.514 367 2HB LEU 83 1HB LEU 83 -7.494 -1.319 -2.941 368 HG LEU 83 HG LEU 83 -5.745 -0.875 -1.349 369 1HD1 LEU 83 1HD1 LEU 83 -4.749 -2.618 0.015 370 2HD1 LEU 83 2HD1 LEU 83 -5.915 -3.787 -0.599 371 3HD1 LEU 83 3HD1 LEU 83 -6.461 -2.438 0.395 372 1HD2 LEU 83 1HD2 LEU 83 -5.129 -3.344 -2.960 373 2HD2 LEU 83 2HD2 LEU 83 -3.949 -2.202 -2.318 374 3HD2 LEU 83 3HD2 LEU 83 -5.094 -1.686 -3.557 375 H LEU 84 H LEU 84 -9.096 0.304 -2.345 376 HA LEU 84 HA LEU 84 -7.718 2.289 -0.940 377 1HB LEU 84 2HB LEU 84 -10.095 2.310 -2.770 378 2HB LEU 84 1HB LEU 84 -9.571 3.790 -1.987 379 HG LEU 84 HG LEU 84 -7.782 2.096 -3.726 380 1HD1 LEU 84 1HD1 LEU 84 -8.145 4.196 -5.248 381 2HD1 LEU 84 2HD1 LEU 84 -9.675 4.298 -4.379 382 3HD1 LEU 84 3HD1 LEU 84 -9.276 2.845 -5.294 383 1HD2 LEU 84 1HD2 LEU 84 -6.372 4.089 -3.741 384 2HD2 LEU 84 2HD2 LEU 84 -6.617 3.491 -2.098 385 3HD2 LEU 84 3HD2 LEU 84 -7.509 4.903 -2.666 386 H ALA 85 H ALA 85 -10.867 0.797 -0.418 387 HA ALA 85 HA ALA 85 -11.883 2.710 1.409 388 1HB ALA 85 1HB ALA 85 -13.469 1.025 2.034 389 2HB ALA 85 2HB ALA 85 -12.437 -0.250 1.384 390 3HB ALA 85 3HB ALA 85 -13.202 0.908 0.294 391 H ASP 86 H ASP 86 -10.055 -0.292 1.884 392 HA ASP 86 HA ASP 86 -9.914 -0.023 4.724 393 1HB ASP 86 2HB ASP 86 -8.877 -1.883 2.683 394 2HB ASP 86 1HB ASP 86 -7.849 -1.697 4.101 395 H LEU 87 H LEU 87 -7.910 0.840 2.000 396 HA LEU 87 HA LEU 87 -5.569 1.537 3.399 397 1HB LEU 87 2HB LEU 87 -6.698 2.489 0.768 398 2HB LEU 87 1HB LEU 87 -5.135 3.004 1.361 399 HG LEU 87 HG LEU 87 -5.888 0.554 -0.011 400 1HD1 LEU 87 1HD1 LEU 87 -4.150 2.236 -0.656 401 2HD1 LEU 87 2HD1 LEU 87 -3.608 0.559 -0.656 402 3HD1 LEU 87 3HD1 LEU 87 -3.166 1.627 0.675 403 1HD2 LEU 87 1HD2 LEU 87 -4.033 0.195 2.330 404 2HD2 LEU 87 2HD2 LEU 87 -4.640 -1.032 1.217 405 3HD2 LEU 87 3HD2 LEU 87 -5.733 -0.276 2.372 406 H THR 88 H THR 88 -8.407 3.431 2.493 407 HA THR 88 HA THR 88 -7.485 5.921 3.362 408 HB THR 88 HB THR 88 -10.232 4.707 3.085 409 HG1 THR 88 1HG THR 88 -9.944 5.342 1.130 410 1HG2 THR 88 1HG2 THR 88 -11.173 6.343 4.206 411 2HG2 THR 88 2HG2 THR 88 -10.492 7.485 3.047 412 3HG2 THR 88 3HG2 THR 88 -9.608 7.090 4.521 413 H ARG 89 H ARG 89 -9.023 3.239 5.021 414 HA ARG 89 HA ARG 89 -9.418 4.554 7.500 415 1HB ARG 89 2HB ARG 89 -10.678 2.556 6.869 416 2HB ARG 89 1HB ARG 89 -9.199 1.606 6.878 417 1HG ARG 89 2HG ARG 89 -9.736 3.037 9.379 418 2HG ARG 89 1HG ARG 89 -10.931 1.808 8.956 419 1HD ARG 89 2HD ARG 89 -9.470 0.099 9.225 420 2HD ARG 89 1HD ARG 89 -8.097 1.040 8.645 421 HE ARG 89 HE ARG 89 -8.992 1.969 11.178 422 1HH1 ARG 89 1HH1 ARG 89 -7.165 -0.579 9.645 423 2HH1 ARG 89 2HH1 ARG 89 -6.189 -0.891 11.041 424 1HH2 ARG 89 1HH2 ARG 89 -7.709 1.559 13.017 425 2HH2 ARG 89 2HH2 ARG 89 -6.500 0.320 12.957 426 H SER 90 H SER 90 -6.837 2.369 6.318 427 HA SER 90 HA SER 90 -5.427 2.478 8.815 428 1HB SER 90 2HB SER 90 -5.363 0.803 6.629 429 2HB SER 90 1HB SER 90 -3.838 1.682 6.490 430 HG SER 90 HG SER 90 -3.285 1.001 8.541 431 H LEU 91 H LEU 91 -5.087 4.116 5.703 432 HA LEU 91 HA LEU 91 -2.756 5.536 6.683 433 1HB LEU 91 2HB LEU 91 -3.884 4.818 4.080 434 2HB LEU 91 1HB LEU 91 -3.218 6.428 4.150 435 HG LEU 91 HG LEU 91 -1.801 3.816 4.599 436 1HD1 LEU 91 1HD1 LEU 91 -1.742 4.275 2.345 437 2HD1 LEU 91 2HD1 LEU 91 -0.243 5.014 2.910 438 3HD1 LEU 91 3HD1 LEU 91 -1.657 6.020 2.592 439 1HD2 LEU 91 1HD2 LEU 91 -0.568 4.828 6.158 440 2HD2 LEU 91 2HD2 LEU 91 -1.206 6.422 5.759 441 3HD2 LEU 91 3HD2 LEU 91 0.133 5.750 4.827 442 H SER 92 H SER 92 -6.005 5.950 6.888 443 HA SER 92 HA SER 92 -6.893 8.302 6.045 444 1HB SER 92 2HB SER 92 -7.724 8.573 8.604 445 2HB SER 92 1HB SER 92 -8.437 7.431 7.465 446 HG SER 92 HG SER 92 -6.666 6.968 9.587 447 H ASP 93 H ASP 93 -6.664 10.434 6.324 448 HA ASP 93 HA ASP 93 -4.981 11.547 8.393 449 1HB ASP 93 2HB ASP 93 -4.012 11.063 5.693 450 2HB ASP 93 1HB ASP 93 -3.903 12.762 6.118 451 H ASN 94 H ASN 94 -4.634 14.090 7.021 452 HA ASN 94 HA ASN 94 -7.214 14.980 6.141 453 1HB ASN 94 2HB ASN 94 -6.328 15.433 8.953 454 2HB ASN 94 1HB ASN 94 -7.208 16.718 8.133 455 1HD2 ASN 94 1HD2 ASN 94 -8.060 15.206 10.405 456 2HD2 ASN 94 2HD2 ASN 94 -9.508 14.380 9.951 457 H ILE 95 H ILE 95 -3.905 15.703 7.061 458 HA ILE 95 HA ILE 95 -4.052 18.296 5.731 459 HB ILE 95 HB ILE 95 -1.953 16.994 7.460 460 1HG1 ILE 95 2HG1 ILE 95 -2.856 19.704 8.084 461 2HG1 ILE 95 1HG1 ILE 95 -4.168 18.529 8.085 462 1HG2 ILE 95 1HG2 ILE 95 -1.745 19.423 5.726 463 2HG2 ILE 95 2HG2 ILE 95 -0.623 18.074 5.896 464 3HG2 ILE 95 3HG2 ILE 95 -0.780 19.258 7.193 465 1HD1 ILE 95 1HD1 ILE 95 -3.541 17.773 10.063 466 2HD1 ILE 95 2HD1 ILE 95 -2.325 19.049 10.120 467 3HD1 ILE 95 3HD1 ILE 95 -1.908 17.460 9.477 468 H ASN 96 H ASN 96 -2.463 15.150 5.531 469 HA ASN 96 HA ASN 96 -1.126 15.917 3.054 470 1HB ASN 96 2HB ASN 96 -0.963 13.425 4.757 471 2HB ASN 96 1HB ASN 96 -0.091 13.638 3.244 472 1HD2 ASN 96 1HD2 ASN 96 0.148 13.870 6.503 473 2HD2 ASN 96 2HD2 ASN 96 1.468 14.978 6.621 474 H LEU 97 H LEU 97 -3.486 13.571 4.267 475 HA LEU 97 HA LEU 97 -4.295 13.044 1.481 476 1HB LEU 97 2HB LEU 97 -4.012 11.279 3.846 477 2HB LEU 97 1HB LEU 97 -5.371 10.966 2.789 478 HG LEU 97 HG LEU 97 -2.562 11.151 1.736 479 1HD1 LEU 97 1HD1 LEU 97 -3.858 8.957 3.233 480 2HD1 LEU 97 2HD1 LEU 97 -2.154 9.376 3.077 481 3HD1 LEU 97 3HD1 LEU 97 -2.971 8.513 1.774 482 1HD2 LEU 97 1HD2 LEU 97 -3.447 10.622 -0.235 483 2HD2 LEU 97 2HD2 LEU 97 -5.015 10.994 0.480 484 3HD2 LEU 97 3HD2 LEU 97 -4.426 9.332 0.461 485 HA PRO 98 HA PRO 98 -7.781 15.613 2.973 486 1HB PRO 98 2HB PRO 98 -8.599 14.692 0.239 487 2HB PRO 98 1HB PRO 98 -8.779 16.276 0.987 488 1HG PRO 98 2HG PRO 98 -6.840 15.857 -0.762 489 2HG PRO 98 1HG PRO 98 -6.530 16.812 0.699 490 1HD PRO 98 2HD PRO 98 -5.714 14.020 0.052 491 2HD PRO 98 1HD PRO 98 -4.870 15.249 1.014 492 H GLN 99 H GLN 99 -8.803 13.010 0.778 493 HA GLN 99 HA GLN 99 -10.753 12.172 2.796 494 1HB GLN 99 2HB GLN 99 -10.644 11.367 -0.112 495 2HB GLN 99 1HB GLN 99 -11.987 11.153 1.003 496 1HG GLN 99 2HG GLN 99 -12.570 13.384 0.940 497 2HG GLN 99 1HG GLN 99 -10.968 13.894 0.410 498 1HE2 GLN 99 1HE2 GLN 99 -10.434 12.488 -1.748 499 2HE2 GLN 99 2HE2 GLN 99 -11.610 12.734 -2.990 500 H GLY 100 H GLY 100 -8.258 11.356 3.457 501 1HA GLY 100 2HA GLY 100 -7.212 9.442 4.196 502 2HA GLY 100 1HA GLY 100 -8.576 8.527 3.575 503 H VAL 101 H VAL 101 -8.589 8.008 1.283 504 HA VAL 101 HA VAL 101 -6.224 8.351 -0.308 505 HB VAL 101 HB VAL 101 -6.828 5.547 0.673 506 1HG1 VAL 101 1HG1 VAL 101 -6.035 5.789 -1.688 507 2HG1 VAL 101 2HG1 VAL 101 -4.976 4.834 -0.652 508 3HG1 VAL 101 3HG1 VAL 101 -4.552 6.497 -1.056 509 1HG2 VAL 101 1HG2 VAL 101 -5.718 6.707 2.447 510 2HG2 VAL 101 2HG2 VAL 101 -4.537 7.392 1.330 511 3HG2 VAL 101 3HG2 VAL 101 -4.538 5.660 1.660 512 H ARG 102 H ARG 102 -7.166 8.730 -2.202 513 HA ARG 102 HA ARG 102 -9.548 7.199 -2.938 514 1HB ARG 102 2HB ARG 102 -8.700 9.938 -3.359 515 2HB ARG 102 1HB ARG 102 -9.178 9.166 -4.863 516 1HG ARG 102 2HG ARG 102 -10.928 8.889 -2.477 517 2HG ARG 102 1HG ARG 102 -10.933 10.398 -3.392 518 1HD ARG 102 2HD ARG 102 -12.575 8.451 -4.006 519 2HD ARG 102 1HD ARG 102 -11.824 9.428 -5.262 520 HE ARG 102 HE ARG 102 -10.118 7.513 -5.348 521 1HH1 ARG 102 1HH1 ARG 102 -13.502 7.067 -4.552 522 2HH1 ARG 102 2HH1 ARG 102 -13.541 5.437 -5.128 523 1HH2 ARG 102 1HH2 ARG 102 -10.189 5.375 -6.102 524 2HH2 ARG 102 2HH2 ARG 102 -11.668 4.478 -6.006 525 H TYR 103 H TYR 103 -6.264 7.879 -3.944 526 HA TYR 103 HA TYR 103 -6.553 5.728 -5.905 527 1HB TYR 103 2HB TYR 103 -5.098 8.239 -6.695 528 2HB TYR 103 1HB TYR 103 -5.603 6.896 -7.699 529 HD1 TYR 103 1HD TYR 103 -6.826 9.854 -5.867 530 HD2 TYR 103 2HD TYR 103 -7.726 6.815 -8.701 531 HE1 TYR 103 1HE TYR 103 -8.865 11.070 -6.516 532 HE2 TYR 103 2HE TYR 103 -9.763 8.016 -9.358 533 HH TYR 103 HH TYR 103 -10.350 11.187 -8.613 534 H ILE 104 H ILE 104 -4.512 4.915 -6.714 535 HA ILE 104 HA ILE 104 -2.309 5.276 -4.792 536 HB ILE 104 HB ILE 104 -3.130 2.707 -6.159 537 1HG1 ILE 104 2HG1 ILE 104 -3.430 3.677 -3.314 538 2HG1 ILE 104 1HG1 ILE 104 -4.710 3.211 -4.429 539 1HG2 ILE 104 1HG2 ILE 104 -0.666 3.065 -5.733 540 2HG2 ILE 104 2HG2 ILE 104 -1.382 1.624 -5.011 541 3HG2 ILE 104 3HG2 ILE 104 -1.056 3.043 -4.013 542 1HD1 ILE 104 1HD1 ILE 104 -3.692 0.889 -4.390 543 2HD1 ILE 104 2HD1 ILE 104 -4.504 1.431 -2.921 544 3HD1 ILE 104 3HD1 ILE 104 -2.742 1.448 -3.014 545 H TYR 105 H TYR 105 -0.453 5.901 -5.697 546 HA TYR 105 HA TYR 105 -0.187 5.679 -8.597 547 1HB TYR 105 2HB TYR 105 0.387 7.777 -6.683 548 2HB TYR 105 1HB TYR 105 1.766 7.439 -7.730 549 HD1 TYR 105 1HD TYR 105 1.418 7.426 -10.206 550 HD2 TYR 105 2HD TYR 105 -1.460 8.975 -7.497 551 HE1 TYR 105 1HE TYR 105 0.360 8.630 -12.043 552 HE2 TYR 105 2HE TYR 105 -2.534 10.197 -9.321 553 HH TYR 105 HH TYR 105 -1.156 10.855 -12.167 554 H THR 106 H THR 106 1.976 5.466 -9.490 555 HA THR 106 HA THR 106 3.291 3.199 -8.343 556 HB THR 106 HB THR 106 5.010 3.910 -10.256 557 HG1 THR 106 1HG THR 106 4.204 5.268 -11.688 558 1HG2 THR 106 1HG2 THR 106 2.282 2.743 -10.711 559 2HG2 THR 106 2HG2 THR 106 3.801 1.884 -10.459 560 3HG2 THR 106 3HG2 THR 106 3.542 2.802 -11.942 561 H ILE 107 H ILE 107 5.476 3.055 -7.656 562 HA ILE 107 HA ILE 107 6.281 4.793 -5.716 563 HB ILE 107 HB ILE 107 7.240 2.523 -6.161 564 1HG1 ILE 107 2HG1 ILE 107 9.471 3.087 -5.277 565 2HG1 ILE 107 1HG1 ILE 107 9.213 4.772 -5.719 566 1HG2 ILE 107 1HG2 ILE 107 9.054 2.232 -7.676 567 2HG2 ILE 107 2HG2 ILE 107 9.089 3.954 -8.058 568 3HG2 ILE 107 3HG2 ILE 107 7.724 2.962 -8.574 569 1HD1 ILE 107 1HD1 ILE 107 7.097 3.657 -4.049 570 2HD1 ILE 107 2HD1 ILE 107 7.986 5.174 -3.903 571 3HD1 ILE 107 3HD1 ILE 107 8.686 3.679 -3.284 572 H ASP 108 H ASP 108 6.707 5.156 -9.146 573 HA ASP 108 HA ASP 108 8.549 7.397 -8.781 574 1HB ASP 108 2HB ASP 108 7.986 5.511 -10.917 575 2HB ASP 108 1HB ASP 108 7.958 7.171 -11.505 576 H GLY 109 H GLY 109 5.232 6.698 -9.549 577 1HA GLY 109 2HA GLY 109 3.473 8.244 -9.331 578 2HA GLY 109 1HA GLY 109 4.639 9.553 -9.449 579 H SER 110 H SER 110 4.982 7.108 -11.815 580 HA SER 110 HA SER 110 4.457 8.905 -13.938 581 1HB SER 110 2HB SER 110 4.784 5.895 -13.943 582 2HB SER 110 1HB SER 110 4.741 6.900 -15.392 583 HG SER 110 HG SER 110 6.557 8.063 -14.340 584 H ARG 111 H ARG 111 2.676 6.069 -12.734 585 HA ARG 111 HA ARG 111 0.206 7.245 -13.700 586 1HB ARG 111 2HB ARG 111 -0.448 4.956 -14.616 587 2HB ARG 111 1HB ARG 111 0.694 5.892 -15.569 588 1HG ARG 111 2HG ARG 111 1.755 3.896 -15.631 589 2HG ARG 111 1HG ARG 111 2.443 4.507 -14.125 590 1HD ARG 111 2HD ARG 111 1.295 3.033 -12.846 591 2HD ARG 111 1HD ARG 111 -0.118 3.054 -13.900 592 HE ARG 111 HE ARG 111 1.951 1.144 -13.920 593 1HH1 ARG 111 1HH1 ARG 111 -0.058 2.976 -16.109 594 2HH1 ARG 111 2HH1 ARG 111 0.014 1.789 -17.367 595 1HH2 ARG 111 1HH2 ARG 111 2.048 -0.418 -15.575 596 2HH2 ARG 111 2HH2 ARG 111 1.209 -0.138 -17.064 597 H LYS 112 H LYS 112 -1.646 6.374 -12.710 598 HA LYS 112 HA LYS 112 -1.101 5.253 -10.080 599 1HB LYS 112 2HB LYS 112 -2.769 6.533 -9.323 600 2HB LYS 112 1HB LYS 112 -2.760 7.300 -10.900 601 1HG LYS 112 2HG LYS 112 -4.429 5.445 -11.563 602 2HG LYS 112 1HG LYS 112 -4.620 5.219 -9.822 603 1HD LYS 112 2HD LYS 112 -6.312 6.751 -10.769 604 2HD LYS 112 1HD LYS 112 -5.292 7.529 -9.558 605 1HE LYS 112 2HE LYS 112 -4.292 8.896 -11.072 606 2HE LYS 112 1HE LYS 112 -4.401 7.712 -12.374 607 1HZ LYS 112 1HZ LYS 112 -6.785 8.195 -12.527 608 2HZ LYS 112 2HZ LYS 112 -5.844 9.568 -12.822 609 3HZ LYS 112 3HZ LYS 112 -6.624 9.384 -11.333 610 H ILE 113 H ILE 113 -1.950 3.369 -9.316 611 HA ILE 113 HA ILE 113 -2.638 1.401 -11.298 612 HB ILE 113 HB ILE 113 -2.458 1.159 -8.292 613 1HG1 ILE 113 2HG1 ILE 113 -0.362 1.841 -9.605 614 2HG1 ILE 113 1HG1 ILE 113 -0.236 0.444 -8.543 615 1HG2 ILE 113 1HG2 ILE 113 -1.984 -1.315 -9.136 616 2HG2 ILE 113 2HG2 ILE 113 -3.044 -0.787 -10.442 617 3HG2 ILE 113 3HG2 ILE 113 -3.607 -0.733 -8.772 618 1HD1 ILE 113 1HD1 ILE 113 -1.026 -0.340 -11.199 619 2HD1 ILE 113 2HD1 ILE 113 0.348 -0.869 -10.225 620 3HD1 ILE 113 3HD1 ILE 113 0.475 0.587 -11.216 621 H GLY 114 H GLY 114 -4.573 0.512 -11.697 622 1HA GLY 114 2HA GLY 114 -6.859 1.454 -10.081 623 2HA GLY 114 1HA GLY 114 -6.941 1.172 -11.815 624 H SER 115 H SER 115 -5.167 -1.287 -11.303 625 HA SER 115 HA SER 115 -7.306 -3.034 -10.282 626 1HB SER 115 2HB SER 115 -6.507 -4.744 -11.922 627 2HB SER 115 1HB SER 115 -7.182 -3.304 -12.682 628 HG SER 115 HG SER 115 -4.966 -2.558 -12.865 629 H MET 116 H MET 116 -6.713 -4.832 -9.103 630 HA MET 116 HA MET 116 -4.441 -4.598 -7.466 631 1HB MET 116 2HB MET 116 -6.791 -6.007 -7.368 632 2HB MET 116 1HB MET 116 -5.615 -7.283 -7.645 633 1HG MET 116 2HG MET 116 -4.689 -7.065 -5.602 634 2HG MET 116 1HG MET 116 -4.931 -5.320 -5.558 635 1HE MET 116 1HE MET 116 -8.153 -4.595 -4.179 636 2HE MET 116 2HE MET 116 -6.576 -4.129 -4.819 637 3HE MET 116 3HE MET 116 -6.718 -4.712 -3.161 638 H ASP 117 H ASP 117 -4.992 -6.238 -10.480 639 HA ASP 117 HA ASP 117 -2.965 -8.142 -10.399 640 1HB ASP 117 2HB ASP 117 -4.740 -6.952 -12.363 641 2HB ASP 117 1HB ASP 117 -3.172 -7.339 -13.047 642 H GLU 118 H GLU 118 -2.759 -4.721 -10.632 643 HA GLU 118 HA GLU 118 -0.154 -4.762 -11.914 644 1HB GLU 118 2HB GLU 118 -1.719 -2.459 -10.745 645 2HB GLU 118 1HB GLU 118 -0.246 -2.321 -11.695 646 1HG GLU 118 2HG GLU 118 -1.733 -3.727 -13.411 647 2HG GLU 118 1HG GLU 118 -3.015 -2.874 -12.550 648 H LEU 119 H LEU 119 -1.368 -5.039 -8.758 649 HA LEU 119 HA LEU 119 0.871 -3.801 -7.429 650 1HB LEU 119 2HB LEU 119 -0.989 -5.702 -6.070 651 2HB LEU 119 1HB LEU 119 -0.207 -4.270 -5.432 652 HG LEU 119 HG LEU 119 -2.531 -4.305 -7.356 653 1HD1 LEU 119 1HD1 LEU 119 -2.435 -3.388 -4.492 654 2HD1 LEU 119 2HD1 LEU 119 -3.020 -4.970 -5.003 655 3HD1 LEU 119 3HD1 LEU 119 -3.851 -3.508 -5.537 656 1HD2 LEU 119 1HD2 LEU 119 -1.213 -1.952 -6.014 657 2HD2 LEU 119 2HD2 LEU 119 -2.563 -1.915 -7.147 658 3HD2 LEU 119 3HD2 LEU 119 -0.964 -2.415 -7.696 659 H GLU 120 H GLU 120 2.807 -4.732 -7.463 660 HA GLU 120 HA GLU 120 2.998 -7.652 -7.505 661 1HB GLU 120 2HB GLU 120 5.274 -5.707 -7.814 662 2HB GLU 120 1HB GLU 120 5.203 -7.386 -8.315 663 1HG GLU 120 2HG GLU 120 3.568 -6.824 -10.027 664 2HG GLU 120 1HG GLU 120 3.611 -5.137 -9.517 665 H GLU 121 H GLU 121 4.426 -8.751 -6.059 666 HA GLU 121 HA GLU 121 4.167 -8.039 -3.386 667 1HB GLU 121 2HB GLU 121 6.201 -9.866 -4.663 668 2HB GLU 121 1HB GLU 121 5.907 -9.753 -2.932 669 1HG GLU 121 2HG GLU 121 3.440 -10.281 -3.625 670 2HG GLU 121 1HG GLU 121 4.204 -10.925 -5.078 671 H GLY 122 H GLY 122 5.776 -7.507 -1.803 672 1HA GLY 122 2HA GLY 122 7.238 -5.954 -0.977 673 2HA GLY 122 1HA GLY 122 8.348 -6.703 -2.102 674 H GLU 123 H GLU 123 5.482 -4.782 -2.851 675 HA GLU 123 HA GLU 123 7.186 -2.995 -4.432 676 1HB GLU 123 2HB GLU 123 4.292 -3.724 -4.485 677 2HB GLU 123 1HB GLU 123 4.777 -2.161 -5.128 678 1HG GLU 123 2HG GLU 123 6.159 -4.655 -6.019 679 2HG GLU 123 1HG GLU 123 4.605 -4.192 -6.711 680 H SER 124 H SER 124 6.530 -0.670 -4.502 681 HA SER 124 HA SER 124 5.729 0.298 -1.835 682 1HB SER 124 2HB SER 124 7.998 1.182 -3.605 683 2HB SER 124 1HB SER 124 7.287 2.289 -2.431 684 HG SER 124 HG SER 124 7.693 0.513 -0.873 685 H TYR 125 H TYR 125 3.843 1.339 -1.988 686 HA TYR 125 HA TYR 125 3.277 2.786 -4.484 687 1HB TYR 125 2HB TYR 125 1.470 1.267 -2.663 688 2HB TYR 125 1HB TYR 125 0.832 2.527 -3.700 689 HD1 TYR 125 1HD TYR 125 1.329 -0.897 -3.526 690 HD2 TYR 125 2HD TYR 125 1.826 2.376 -6.182 691 HE1 TYR 125 1HE TYR 125 1.282 -2.444 -5.433 692 HE2 TYR 125 2HE TYR 125 1.778 0.863 -8.087 693 HH TYR 125 HH TYR 125 0.684 -1.631 -8.444 694 H VAL 126 H VAL 126 1.935 4.600 -4.383 695 HA VAL 126 HA VAL 126 2.213 6.125 -1.864 696 HB VAL 126 HB VAL 126 2.795 6.950 -4.676 697 1HG1 VAL 126 1HG1 VAL 126 1.283 8.650 -4.385 698 2HG1 VAL 126 2HG1 VAL 126 2.716 9.376 -3.654 699 3HG1 VAL 126 3HG1 VAL 126 1.468 8.664 -2.631 700 1HG2 VAL 126 1HG2 VAL 126 4.210 8.313 -2.568 701 2HG2 VAL 126 2HG2 VAL 126 4.832 7.273 -3.853 702 3HG2 VAL 126 3HG2 VAL 126 4.268 6.564 -2.339 703 H CYS 127 H CYS 127 0.472 7.242 -1.138 704 HA CYS 127 HA CYS 127 -2.056 6.695 -2.485 705 1HB CYS 127 2HB CYS 127 -1.322 7.630 0.274 706 2HB CYS 127 1HB CYS 127 -2.975 7.770 -0.319 707 HG CYS 127 HG CYS 127 -1.590 4.991 -0.173 708 H SER 128 H SER 128 -3.205 8.154 -3.561 709 HA SER 128 HA SER 128 -2.596 11.008 -3.199 710 1HB SER 128 2HB SER 128 -2.969 9.648 -5.880 711 2HB SER 128 1HB SER 128 -2.674 11.368 -5.611 712 HG SER 128 HG SER 128 -0.918 9.204 -5.100 713 H SER 129 H SER 129 -4.280 12.419 -4.147 714 HA SER 129 HA SER 129 -6.900 11.250 -4.537 715 1HB SER 129 2HB SER 129 -6.558 13.272 -2.321 716 2HB SER 129 1HB SER 129 -7.985 12.311 -2.705 717 HG SER 129 HG SER 129 -7.163 10.658 -1.666 718 H ASP 130 H ASP 130 -5.181 14.287 -3.878 719 HA ASP 130 HA ASP 130 -6.110 15.386 -6.393 720 1HB ASP 130 2HB ASP 130 -6.877 17.514 -5.143 721 2HB ASP 130 1HB ASP 130 -7.967 16.132 -5.175 722 H ASN 131 H ASN 131 -3.558 14.647 -5.272 723 HA ASN 131 HA ASN 131 -2.258 17.264 -4.951 724 1HB ASN 131 2HB ASN 131 -0.988 14.587 -4.420 725 2HB ASN 131 1HB ASN 131 -0.471 16.167 -3.842 726 1HD2 ASN 131 1HD2 ASN 131 -2.321 13.407 -3.208 727 2HD2 ASN 131 2HD2 ASN 131 -3.073 13.947 -1.750 728 H PHE 132 H PHE 132 -0.193 17.603 -6.012 729 HA PHE 132 HA PHE 132 -0.238 16.564 -8.731 730 1HB PHE 132 2HB PHE 132 1.505 18.328 -9.126 731 2HB PHE 132 1HB PHE 132 -0.042 18.945 -8.558 732 HD1 PHE 132 1HD PHE 132 3.449 18.278 -7.632 733 HD2 PHE 132 2HD PHE 132 -0.246 20.020 -6.439 734 HE1 PHE 132 1HE PHE 132 4.594 19.433 -5.785 735 HE2 PHE 132 2HE PHE 132 0.892 21.179 -4.591 736 HZ PHE 132 HZ PHE 132 3.315 20.887 -4.263 737 H PHE 133 H PHE 133 0.787 15.029 -6.296 738 HA PHE 133 HA PHE 133 2.397 13.481 -5.884 739 1HB PHE 133 2HB PHE 133 2.099 12.961 -8.301 740 2HB PHE 133 1HB PHE 133 3.380 14.108 -8.669 741 HD1 PHE 133 1HD PHE 133 2.640 10.947 -6.901 742 HD2 PHE 133 2HD PHE 133 5.638 13.477 -8.549 743 HE1 PHE 133 1HE PHE 133 4.308 9.166 -6.588 744 HE2 PHE 133 2HE PHE 133 7.313 11.701 -8.240 745 HZ PHE 133 HZ PHE 133 6.648 9.541 -7.258 746 H LYS 134 H LYS 134 4.482 13.368 -5.050 747 HA LYS 134 HA LYS 134 6.222 15.693 -5.444 748 1HB LYS 134 2HB LYS 134 5.224 14.658 -2.791 749 2HB LYS 134 1HB LYS 134 6.647 15.681 -2.940 750 1HG LYS 134 2HG LYS 134 5.075 17.297 -4.193 751 2HG LYS 134 1HG LYS 134 3.780 16.355 -3.451 752 1HD LYS 134 2HD LYS 134 5.100 16.749 -1.251 753 2HD LYS 134 1HD LYS 134 5.869 18.060 -2.149 754 1HE LYS 134 2HE LYS 134 3.496 18.823 -2.713 755 2HE LYS 134 1HE LYS 134 2.969 17.719 -1.443 756 1HZ LYS 134 1HZ LYS 134 3.204 19.816 -0.441 757 2HZ LYS 134 2HZ LYS 134 4.701 20.106 -1.173 758 3HZ LYS 134 3HZ LYS 134 4.568 18.940 0.046 759 H LYS 135 H LYS 135 8.187 15.019 -5.960 760 HA LYS 135 HA LYS 135 8.956 12.272 -5.577 761 1HB LYS 135 2HB LYS 135 11.127 13.095 -6.654 762 2HB LYS 135 1HB LYS 135 9.665 13.164 -7.629 763 1HG LYS 135 2HG LYS 135 10.299 15.591 -6.082 764 2HG LYS 135 1HG LYS 135 11.404 15.192 -7.399 765 1HD LYS 135 2HD LYS 135 8.502 15.031 -7.978 766 2HD LYS 135 1HD LYS 135 9.187 16.642 -7.756 767 1HE LYS 135 2HE LYS 135 9.735 16.515 -9.921 768 2HE LYS 135 1HE LYS 135 11.030 15.444 -9.388 769 1HZ LYS 135 1HZ LYS 135 9.237 14.764 -11.218 770 2HZ LYS 135 2HZ LYS 135 8.442 14.199 -9.837 771 3HZ LYS 135 3HZ LYS 135 9.993 13.637 -10.208 772 H VAL 136 H VAL 136 9.408 11.735 -3.529 773 HA VAL 136 HA VAL 136 11.531 13.257 -2.167 774 HB VAL 136 HB VAL 136 10.178 12.046 -0.092 775 1HG1 VAL 136 1HG1 VAL 136 10.955 14.157 0.304 776 2HG1 VAL 136 2HG1 VAL 136 9.225 14.470 0.162 777 3HG1 VAL 136 3HG1 VAL 136 10.297 14.804 -1.198 778 1HG2 VAL 136 1HG2 VAL 136 7.896 12.225 -0.310 779 2HG2 VAL 136 2HG2 VAL 136 8.346 11.699 -1.930 780 3HG2 VAL 136 3HG2 VAL 136 8.003 13.400 -1.621 781 H GLU 137 H GLU 137 12.073 11.664 -0.058 782 HA GLU 137 HA GLU 137 13.391 9.449 -1.319 783 1HB GLU 137 2HB GLU 137 14.260 8.986 0.981 784 2HB GLU 137 1HB GLU 137 14.585 10.620 0.418 785 1HG GLU 137 2HG GLU 137 12.146 10.808 1.732 786 2HG GLU 137 1HG GLU 137 13.109 9.717 2.728 787 H TYR 138 H TYR 138 11.136 8.786 -1.959 788 HA TYR 138 HA TYR 138 9.334 7.532 -0.276 789 1HB TYR 138 2HB TYR 138 10.102 7.301 -3.141 790 2HB TYR 138 1HB TYR 138 8.972 6.119 -2.479 791 HD1 TYR 138 1HD TYR 138 7.891 7.492 -4.611 792 HD2 TYR 138 2HD TYR 138 8.286 8.944 -0.628 793 HE1 TYR 138 1HE TYR 138 6.049 9.069 -5.006 794 HE2 TYR 138 2HE TYR 138 6.441 10.519 -1.013 795 HH TYR 138 HH TYR 138 4.643 10.944 -2.431 796 H THR 139 H THR 139 12.277 6.241 -1.768 797 HA THR 139 HA THR 139 12.147 3.989 0.094 798 HB THR 139 HB THR 139 12.687 2.378 -1.701 799 HG1 THR 139 1HG THR 139 12.335 4.659 -3.326 800 1HG2 THR 139 1HG2 THR 139 10.476 2.482 -2.930 801 2HG2 THR 139 2HG2 THR 139 10.130 3.913 -1.961 802 3HG2 THR 139 3HG2 THR 139 10.411 2.362 -1.171 803 H LYS 140 H LYS 140 13.983 6.403 -1.309 804 HA LYS 140 HA LYS 140 16.498 5.045 -1.451 805 1HB LYS 140 2HB LYS 140 17.471 7.260 -1.716 806 2HB LYS 140 1HB LYS 140 16.053 7.098 -2.742 807 1HG LYS 140 2HG LYS 140 14.807 8.210 -0.759 808 2HG LYS 140 1HG LYS 140 16.421 8.727 -0.270 809 1HD LYS 140 2HD LYS 140 15.279 9.202 -3.017 810 2HD LYS 140 1HD LYS 140 15.162 10.368 -1.697 811 1HE LYS 140 2HE LYS 140 17.565 10.525 -1.564 812 2HE LYS 140 1HE LYS 140 17.749 9.248 -2.767 813 1HZ LYS 140 1HZ LYS 140 18.063 11.425 -3.751 814 2HZ LYS 140 2HZ LYS 140 16.526 11.913 -3.242 815 3HZ LYS 140 3HZ LYS 140 16.683 10.688 -4.397 816 H ASN 141 H ASN 141 17.578 4.316 0.181 817 HA ASN 141 HA ASN 141 18.651 4.206 2.170 818 1HB ASN 141 2HB ASN 141 18.797 6.787 1.787 819 2HB ASN 141 1HB ASN 141 17.560 6.857 3.038 820 1HD2 ASN 141 1HD2 ASN 141 20.697 7.244 2.607 821 2HD2 ASN 141 2HD2 ASN 141 21.313 6.696 4.126 822 H VAL 142 H VAL 142 15.622 3.793 1.665 823 HA VAL 142 HA VAL 142 14.595 3.923 4.387 824 HB VAL 142 HB VAL 142 13.242 2.932 1.872 825 1HG1 VAL 142 1HG1 VAL 142 12.051 1.965 3.618 826 2HG1 VAL 142 2HG1 VAL 142 11.179 3.472 3.336 827 3HG1 VAL 142 3HG1 VAL 142 12.304 3.346 4.688 828 1HG2 VAL 142 1HG2 VAL 142 12.106 5.074 1.824 829 2HG2 VAL 142 2HG2 VAL 142 13.852 5.315 1.762 830 3HG2 VAL 142 3HG2 VAL 142 12.975 5.593 3.267 831 H ASN 143 H ASN 143 15.718 1.570 2.047 832 HA ASN 143 HA ASN 143 16.312 -0.617 2.272 833 1HB ASN 143 2HB ASN 143 16.380 0.383 4.990 834 2HB ASN 143 1HB ASN 143 15.874 -1.303 4.954 835 1HD2 ASN 143 1HD2 ASN 143 17.405 -2.783 4.870 836 2HD2 ASN 143 2HD2 ASN 143 19.052 -2.512 4.424 837 HA PRO 144 HA PRO 144 12.061 -2.079 1.854 838 1HB PRO 144 2HB PRO 144 13.335 -4.409 0.592 839 2HB PRO 144 1HB PRO 144 12.166 -3.270 -0.079 840 1HG PRO 144 2HG PRO 144 14.733 -3.291 -0.867 841 2HG PRO 144 1HG PRO 144 13.800 -1.786 -0.752 842 1HD PRO 144 2HD PRO 144 15.823 -2.912 1.155 843 2HD PRO 144 1HD PRO 144 15.601 -1.235 0.606 844 H ASN 145 H ASN 145 12.936 -2.407 4.380 845 HA ASN 145 HA ASN 145 12.999 -5.261 4.965 846 1HB ASN 145 2HB ASN 145 13.064 -3.015 6.978 847 2HB ASN 145 1HB ASN 145 13.596 -4.681 7.190 848 1HD2 ASN 145 1HD2 ASN 145 15.374 -2.974 7.953 849 2HD2 ASN 145 2HD2 ASN 145 16.644 -2.758 6.803 850 H TRP 146 H TRP 146 10.786 -5.446 4.082 851 HA TRP 146 HA TRP 146 8.890 -5.499 6.226 852 1HB TRP 146 2HB TRP 146 7.178 -4.169 4.757 853 2HB TRP 146 1HB TRP 146 8.296 -3.306 5.805 854 HD1 TRP 146 HD TRP 146 10.210 -1.864 4.646 855 HE1 TRP 146 1HE TRP 146 10.495 -0.984 2.244 856 HE3 TRP 146 3HE TRP 146 6.740 -4.790 2.284 857 HZ2 TRP 146 2HZ TRP 146 9.396 -1.465 -0.310 858 HZ3 TRP 146 3HZ TRP 146 6.414 -4.508 -0.131 859 HH2 TRP 146 HH TRP 146 7.718 -2.887 -1.404 860 H SER 147 H SER 147 9.630 -5.947 2.826 861 HA SER 147 HA SER 147 7.363 -7.685 2.391 862 1HB SER 147 2HB SER 147 8.380 -6.190 0.615 863 2HB SER 147 1HB SER 147 9.749 -7.301 0.576 864 HG SER 147 HG SER 147 8.567 -8.364 -0.794 865 H VAL 148 H VAL 148 9.842 -8.202 4.274 866 HA VAL 148 HA VAL 148 10.783 -10.736 3.226 867 HB VAL 148 HB VAL 148 12.101 -10.803 5.368 868 1HG1 VAL 148 1HG1 VAL 148 12.366 -8.888 3.166 869 2HG1 VAL 148 2HG1 VAL 148 13.533 -10.040 3.814 870 3HG1 VAL 148 3HG1 VAL 148 13.304 -8.478 4.602 871 1HG2 VAL 148 1HG2 VAL 148 11.711 -9.372 7.030 872 2HG2 VAL 148 2HG2 VAL 148 10.305 -8.797 6.134 873 3HG2 VAL 148 3HG2 VAL 148 11.861 -7.988 5.946 874 H ASN 149 H ASN 149 8.151 -9.686 5.036 875 HA ASN 149 HA ASN 149 7.971 -12.116 6.640 876 1HB ASN 149 2HB ASN 149 6.830 -9.427 6.770 877 2HB ASN 149 1HB ASN 149 5.634 -10.687 7.061 878 1HD2 ASN 149 1HD2 ASN 149 8.906 -9.715 8.002 879 2HD2 ASN 149 2HD2 ASN 149 8.770 -10.221 9.648 880 H VAL 150 H VAL 150 7.870 -12.607 3.915 881 HA VAL 150 HA VAL 150 5.030 -13.066 3.333 882 HB VAL 150 HB VAL 150 5.814 -13.642 1.036 883 1HG1 VAL 150 1HG1 VAL 150 5.651 -11.488 0.393 884 2HG1 VAL 150 2HG1 VAL 150 6.946 -10.957 1.466 885 3HG1 VAL 150 3HG1 VAL 150 5.322 -11.215 2.104 886 1HG2 VAL 150 1HG2 VAL 150 8.481 -12.627 2.017 887 2HG2 VAL 150 2HG2 VAL 150 8.082 -13.110 0.368 888 3HG2 VAL 150 3HG2 VAL 150 8.103 -14.312 1.658 Start of MODEL 7 1 1H GLY 38 1HT GLY 38 -2.903 -40.201 -1.185 2 2H GLY 38 2HT GLY 38 -3.781 -40.066 0.254 3 3H GLY 38 3HT GLY 38 -2.581 -38.931 -0.113 4 1HA GLY 38 1HA GLY 38 -4.978 -39.325 -1.805 5 2HA GLY 38 2HA GLY 38 -4.945 -38.182 -0.471 6 H ALA 39 H ALA 39 -4.567 -38.473 -3.723 7 HA ALA 39 HA ALA 39 -2.670 -36.229 -3.891 8 1HB ALA 39 1HB ALA 39 -1.876 -38.047 -5.183 9 2HB ALA 39 2HB ALA 39 -2.536 -36.878 -6.327 10 3HB ALA 39 3HB ALA 39 -3.462 -38.319 -5.906 11 H MET 40 H MET 40 -5.530 -36.027 -3.201 12 HA MET 40 HA MET 40 -6.719 -34.782 -5.548 13 1HB MET 40 2HB MET 40 -7.911 -34.917 -2.784 14 2HB MET 40 1HB MET 40 -8.748 -34.693 -4.314 15 1HG MET 40 2HG MET 40 -7.562 -37.083 -4.737 16 2HG MET 40 1HG MET 40 -7.833 -37.150 -2.997 17 1HE MET 40 1HE MET 40 -10.615 -36.126 -2.172 18 2HE MET 40 2HE MET 40 -9.816 -37.674 -1.897 19 3HE MET 40 3HE MET 40 -11.468 -37.631 -2.511 20 H ASP 41 H ASP 41 -5.173 -33.908 -2.561 21 HA ASP 41 HA ASP 41 -6.046 -31.166 -2.625 22 1HB ASP 41 2HB ASP 41 -4.304 -32.819 -0.871 23 2HB ASP 41 1HB ASP 41 -4.022 -31.081 -0.876 24 HA PRO 42 HA PRO 42 -1.400 -30.307 -3.787 25 1HB PRO 42 2HB PRO 42 -0.059 -32.520 -4.768 26 2HB PRO 42 1HB PRO 42 0.101 -31.884 -3.128 27 1HG PRO 42 2HG PRO 42 -1.546 -34.165 -4.128 28 2HG PRO 42 1HG PRO 42 -0.630 -34.017 -2.617 29 1HD PRO 42 2HD PRO 42 -3.301 -33.737 -2.684 30 2HD PRO 42 1HD PRO 42 -2.291 -32.775 -1.585 31 H GLU 43 H GLU 43 -1.830 -33.194 -5.804 32 HA GLU 43 HA GLU 43 -1.991 -33.413 -8.071 33 1HB GLU 43 2HB GLU 43 -4.330 -32.700 -7.222 34 2HB GLU 43 1HB GLU 43 -3.970 -31.154 -7.978 35 1HG GLU 43 2HG GLU 43 -5.212 -32.387 -9.549 36 2HG GLU 43 1HG GLU 43 -3.539 -32.423 -10.107 37 H PHE 44 H PHE 44 0.252 -32.220 -7.832 38 HA PHE 44 HA PHE 44 1.790 -30.887 -8.846 39 1HB PHE 44 2HB PHE 44 0.326 -31.622 -10.867 40 2HB PHE 44 1HB PHE 44 -0.289 -29.973 -10.812 41 HD1 PHE 44 1HD PHE 44 1.405 -28.074 -10.955 42 HD2 PHE 44 2HD PHE 44 2.324 -32.108 -11.949 43 HE1 PHE 44 1HE PHE 44 3.345 -27.306 -12.259 44 HE2 PHE 44 2HE PHE 44 4.267 -31.347 -13.255 45 HZ PHE 44 HZ PHE 44 4.780 -28.944 -13.410 46 H ALA 45 H ALA 45 2.509 -29.061 -7.993 47 HA ALA 45 HA ALA 45 0.709 -27.121 -6.893 48 1HB ALA 45 1HB ALA 45 3.702 -27.320 -7.042 49 2HB ALA 45 2HB ALA 45 2.654 -27.491 -5.634 50 3HB ALA 45 3HB ALA 45 2.889 -25.906 -6.370 51 H LEU 46 H LEU 46 -0.211 -25.532 -7.987 52 HA LEU 46 HA LEU 46 0.732 -24.765 -10.600 53 1HB LEU 46 2HB LEU 46 -1.212 -23.184 -10.516 54 2HB LEU 46 1HB LEU 46 -1.622 -24.877 -10.330 55 HG LEU 46 HG LEU 46 -1.184 -23.583 -7.762 56 1HD1 LEU 46 1HD1 LEU 46 -1.994 -21.587 -8.775 57 2HD1 LEU 46 2HD1 LEU 46 -3.324 -22.289 -7.852 58 3HD1 LEU 46 3HD1 LEU 46 -3.281 -22.460 -9.606 59 1HD2 LEU 46 1HD2 LEU 46 -2.480 -25.770 -8.660 60 2HD2 LEU 46 2HD2 LEU 46 -3.825 -24.638 -8.524 61 3HD2 LEU 46 3HD2 LEU 46 -2.822 -24.988 -7.117 62 H SER 47 H SER 47 0.327 -22.110 -10.825 63 HA SER 47 HA SER 47 1.668 -20.651 -8.735 64 1HB SER 47 2HB SER 47 3.071 -20.658 -11.396 65 2HB SER 47 1HB SER 47 3.677 -20.131 -9.825 66 HG SER 47 HG SER 47 4.583 -22.111 -10.268 67 H ASN 48 H ASN 48 -0.853 -20.544 -10.186 68 HA ASN 48 HA ASN 48 -0.692 -18.256 -11.941 69 1HB ASN 48 2HB ASN 48 -2.423 -20.301 -11.855 70 2HB ASN 48 1HB ASN 48 -3.311 -19.155 -10.855 71 1HD2 ASN 48 1HD2 ASN 48 -4.423 -19.959 -13.160 72 2HD2 ASN 48 2HD2 ASN 48 -4.396 -18.688 -14.329 73 H GLU 49 H GLU 49 -1.792 -18.946 -8.657 74 HA GLU 49 HA GLU 49 -1.347 -16.231 -7.856 75 1HB GLU 49 2HB GLU 49 -4.145 -17.279 -8.177 76 2HB GLU 49 1HB GLU 49 -3.776 -16.053 -6.972 77 1HG GLU 49 2HG GLU 49 -2.736 -14.741 -8.910 78 2HG GLU 49 1HG GLU 49 -3.608 -15.862 -9.953 79 H LYS 50 H LYS 50 -0.566 -16.327 -5.856 80 HA LYS 50 HA LYS 50 -1.712 -18.154 -3.911 81 1HB LYS 50 2HB LYS 50 0.403 -19.190 -3.326 82 2HB LYS 50 1HB LYS 50 0.044 -19.484 -5.022 83 1HG LYS 50 2HG LYS 50 1.577 -17.660 -5.639 84 2HG LYS 50 1HG LYS 50 1.972 -17.446 -3.933 85 1HD LYS 50 2HD LYS 50 2.345 -20.149 -4.336 86 2HD LYS 50 1HD LYS 50 2.926 -19.432 -5.840 87 1HE LYS 50 2HE LYS 50 4.280 -17.847 -4.415 88 2HE LYS 50 1HE LYS 50 3.852 -18.856 -3.035 89 1HZ LYS 50 1HZ LYS 50 4.990 -20.687 -3.962 90 2HZ LYS 50 2HZ LYS 50 6.036 -19.367 -4.112 91 3HZ LYS 50 3HZ LYS 50 5.179 -19.923 -5.460 92 H LYS 51 H LYS 51 -1.782 -17.259 -1.952 93 HA LYS 51 HA LYS 51 -1.537 -15.752 -0.268 94 1HB LYS 51 2HB LYS 51 1.277 -15.664 -1.364 95 2HB LYS 51 1HB LYS 51 0.784 -14.923 0.152 96 1HG LYS 51 2HG LYS 51 0.248 -17.818 -0.298 97 2HG LYS 51 1HG LYS 51 1.876 -17.288 0.126 98 1HD LYS 51 2HD LYS 51 0.891 -16.104 2.094 99 2HD LYS 51 1HD LYS 51 -0.657 -16.855 1.703 100 1HE LYS 51 2HE LYS 51 0.643 -18.050 3.461 101 2HE LYS 51 1HE LYS 51 0.235 -19.043 2.062 102 1HZ LYS 51 1HZ LYS 51 2.837 -17.656 2.245 103 2HZ LYS 51 2HZ LYS 51 2.415 -18.991 1.297 104 3HZ LYS 51 3HZ LYS 51 2.600 -19.168 2.969 105 H ALA 52 H ALA 52 -1.121 -13.455 0.261 106 HA ALA 52 HA ALA 52 -2.013 -11.785 -1.921 107 1HB ALA 52 1HB ALA 52 -2.496 -10.158 -0.300 108 2HB ALA 52 2HB ALA 52 -1.354 -10.845 0.855 109 3HB ALA 52 3HB ALA 52 -2.853 -11.696 0.485 110 H LYS 53 H LYS 53 -1.012 -9.517 -2.054 111 HA LYS 53 HA LYS 53 1.868 -9.858 -2.427 112 1HB LYS 53 2HB LYS 53 -0.008 -7.704 -3.422 113 2HB LYS 53 1HB LYS 53 1.708 -7.802 -3.796 114 1HG LYS 53 2HG LYS 53 1.431 -9.481 -5.288 115 2HG LYS 53 1HG LYS 53 0.071 -10.187 -4.410 116 1HD LYS 53 2HD LYS 53 -0.518 -7.541 -5.478 117 2HD LYS 53 1HD LYS 53 -0.083 -8.704 -6.731 118 1HE LYS 53 2HE LYS 53 -1.748 -10.267 -5.501 119 2HE LYS 53 1HE LYS 53 -2.358 -8.774 -4.788 120 1HZ LYS 53 1HZ LYS 53 -3.659 -9.001 -6.654 121 2HZ LYS 53 2HZ LYS 53 -2.411 -9.642 -7.599 122 3HZ LYS 53 3HZ LYS 53 -2.433 -7.990 -7.235 123 H LYS 54 H LYS 54 3.354 -8.770 -1.263 124 HA LYS 54 HA LYS 54 2.414 -7.122 0.926 125 1HB LYS 54 2HB LYS 54 4.924 -8.626 0.327 126 2HB LYS 54 1HB LYS 54 5.007 -7.261 1.433 127 1HG LYS 54 2HG LYS 54 2.939 -9.368 1.852 128 2HG LYS 54 1HG LYS 54 4.608 -9.666 2.339 129 1HD LYS 54 2HD LYS 54 3.962 -8.694 4.265 130 2HD LYS 54 1HD LYS 54 4.215 -7.194 3.371 131 1HE LYS 54 2HE LYS 54 1.898 -7.013 2.860 132 2HE LYS 54 1HE LYS 54 1.578 -8.644 3.449 133 1HZ LYS 54 1HZ LYS 54 1.561 -7.968 5.585 134 2HZ LYS 54 2HZ LYS 54 1.156 -6.475 4.903 135 3HZ LYS 54 3HZ LYS 54 2.755 -6.789 5.357 136 H VAL 55 H VAL 55 2.441 -5.033 0.818 137 HA VAL 55 HA VAL 55 4.467 -3.684 -0.832 138 HB VAL 55 HB VAL 55 2.797 -2.015 -1.551 139 1HG1 VAL 55 1HG1 VAL 55 1.712 -4.625 -2.471 140 2HG1 VAL 55 2HG1 VAL 55 3.401 -4.235 -2.798 141 3HG1 VAL 55 3HG1 VAL 55 2.120 -3.176 -3.391 142 1HG2 VAL 55 1HG2 VAL 55 0.920 -3.860 -0.120 143 2HG2 VAL 55 2HG2 VAL 55 0.368 -2.776 -1.395 144 3HG2 VAL 55 3HG2 VAL 55 1.115 -2.116 0.065 145 H ARG 56 H ARG 56 5.002 -1.597 -0.216 146 HA ARG 56 HA ARG 56 4.251 -0.884 2.534 147 1HB ARG 56 2HB ARG 56 6.703 -1.240 2.028 148 2HB ARG 56 1HB ARG 56 6.613 0.135 0.934 149 1HG ARG 56 2HG ARG 56 6.534 1.647 2.617 150 2HG ARG 56 1HG ARG 56 5.653 0.566 3.697 151 1HD ARG 56 2HD ARG 56 8.022 -0.732 3.483 152 2HD ARG 56 1HD ARG 56 8.546 0.945 3.337 153 HE ARG 56 HE ARG 56 6.756 0.435 5.539 154 1HH1 ARG 56 1HH1 ARG 56 10.084 0.552 4.493 155 2HH1 ARG 56 2HH1 ARG 56 10.708 0.783 6.092 156 1HH2 ARG 56 1HH2 ARG 56 7.575 0.740 7.641 157 2HH2 ARG 56 2HH2 ARG 56 9.284 0.891 7.878 158 H PHE 57 H PHE 57 2.559 0.478 2.433 159 HA PHE 57 HA PHE 57 2.301 2.248 0.156 160 1HB PHE 57 2HB PHE 57 0.495 1.492 2.431 161 2HB PHE 57 1HB PHE 57 0.112 2.855 1.388 162 HD1 PHE 57 1HD PHE 57 1.714 0.812 -0.824 163 HD2 PHE 57 2HD PHE 57 -1.862 0.898 1.494 164 HE1 PHE 57 1HE PHE 57 0.641 -0.695 -2.426 165 HE2 PHE 57 2HE PHE 57 -2.932 -0.625 -0.111 166 HZ PHE 57 HZ PHE 57 -1.685 -1.421 -2.076 167 H TYR 58 H TYR 58 2.722 4.268 0.076 168 HA TYR 58 HA TYR 58 3.322 5.777 2.533 169 1HB TYR 58 2HB TYR 58 4.411 6.368 -0.208 170 2HB TYR 58 1HB TYR 58 4.898 7.089 1.306 171 HD1 TYR 58 1HD TYR 58 4.673 3.636 -0.146 172 HD2 TYR 58 2HD TYR 58 6.942 6.440 2.110 173 HE1 TYR 58 1HE TYR 58 6.493 1.995 0.057 174 HE2 TYR 58 2HE TYR 58 8.764 4.805 2.322 175 HH TYR 58 HH TYR 58 9.468 2.617 0.716 176 H ARG 59 H ARG 59 2.535 7.880 2.655 177 HA ARG 59 HA ARG 59 0.345 8.448 0.789 178 1HB ARG 59 2HB ARG 59 0.665 10.303 3.037 179 2HB ARG 59 1HB ARG 59 -0.765 9.451 2.481 180 1HG ARG 59 2HG ARG 59 0.101 7.411 3.633 181 2HG ARG 59 1HG ARG 59 1.377 8.418 4.321 182 1HD ARG 59 2HD ARG 59 -1.591 8.823 4.669 183 2HD ARG 59 1HD ARG 59 -0.491 8.171 5.877 184 HE ARG 59 HE ARG 59 -0.637 10.951 4.966 185 1HH1 ARG 59 1HH1 ARG 59 0.751 8.576 7.130 186 2HH1 ARG 59 2HH1 ARG 59 1.423 9.765 8.191 187 1HH2 ARG 59 1HH2 ARG 59 0.252 12.500 6.367 188 2HH2 ARG 59 2HH2 ARG 59 1.141 11.985 7.762 189 H ASN 60 H ASN 60 0.762 9.754 -0.846 190 HA ASN 60 HA ASN 60 3.122 11.057 -1.328 191 1HB ASN 60 2HB ASN 60 0.877 10.684 -2.756 192 2HB ASN 60 1HB ASN 60 0.712 12.393 -2.393 193 1HD2 ASN 60 1HD2 ASN 60 1.320 10.840 -4.880 194 2HD2 ASN 60 2HD2 ASN 60 2.738 11.586 -5.518 195 H GLY 61 H GLY 61 4.130 12.608 -0.306 196 1HA GLY 61 2HA GLY 61 4.228 14.977 0.195 197 2HA GLY 61 1HA GLY 61 2.555 14.886 0.713 198 H ASP 62 H ASP 62 4.423 12.250 1.802 199 HA ASP 62 HA ASP 62 5.336 13.564 4.214 200 1HB ASP 62 2HB ASP 62 4.081 11.667 5.552 201 2HB ASP 62 1HB ASP 62 3.274 13.183 5.164 202 H ARG 63 H ARG 63 7.277 12.825 3.105 203 HA ARG 63 HA ARG 63 7.797 10.021 2.890 204 1HB ARG 63 2HB ARG 63 9.900 10.629 2.030 205 2HB ARG 63 1HB ARG 63 8.786 11.868 1.468 206 1HG ARG 63 2HG ARG 63 10.401 12.286 3.954 207 2HG ARG 63 1HG ARG 63 11.094 12.576 2.359 208 1HD ARG 63 2HD ARG 63 8.677 13.864 2.207 209 2HD ARG 63 1HD ARG 63 9.156 14.144 3.879 210 HE ARG 63 HE ARG 63 11.284 14.662 2.051 211 1HH1 ARG 63 1HH1 ARG 63 8.368 16.013 3.412 212 2HH1 ARG 63 2HH1 ARG 63 8.864 17.654 3.164 213 1HH2 ARG 63 1HH2 ARG 63 11.937 16.818 1.724 214 2HH2 ARG 63 2HH2 ARG 63 10.889 18.111 2.205 215 H TYR 64 H TYR 64 7.616 11.988 5.547 216 HA TYR 64 HA TYR 64 9.824 10.739 6.985 217 1HB TYR 64 2HB TYR 64 8.252 13.177 7.279 218 2HB TYR 64 1HB TYR 64 8.429 12.309 8.801 219 HD1 TYR 64 1HD TYR 64 9.901 14.672 6.663 220 HD2 TYR 64 2HD TYR 64 10.891 11.509 9.330 221 HE1 TYR 64 1HE TYR 64 12.161 15.607 6.924 222 HE2 TYR 64 2HE TYR 64 13.153 12.437 9.601 223 HH TYR 64 HH TYR 64 14.332 14.521 9.344 224 H PHE 65 H PHE 65 6.402 10.463 6.612 225 HA PHE 65 HA PHE 65 5.911 9.115 9.091 226 1HB PHE 65 2HB PHE 65 4.036 10.214 8.181 227 2HB PHE 65 1HB PHE 65 4.306 9.537 6.580 228 HD1 PHE 65 1HD PHE 65 3.257 7.556 5.923 229 HD2 PHE 65 2HD PHE 65 3.269 8.666 10.031 230 HE1 PHE 65 1HE PHE 65 1.659 5.749 6.411 231 HE2 PHE 65 2HE PHE 65 1.672 6.861 10.528 232 HZ PHE 65 HZ PHE 65 0.865 5.398 8.716 233 H LYS 66 H LYS 66 7.463 8.167 6.282 234 HA LYS 66 HA LYS 66 8.288 6.173 5.578 235 1HB LYS 66 2HB LYS 66 7.203 5.356 8.249 236 2HB LYS 66 1HB LYS 66 7.778 4.134 7.126 237 1HG LYS 66 2HG LYS 66 9.574 6.425 7.612 238 2HG LYS 66 1HG LYS 66 9.338 5.299 8.950 239 1HD LYS 66 2HD LYS 66 10.406 3.603 7.888 240 2HD LYS 66 1HD LYS 66 9.841 4.104 6.293 241 1HE LYS 66 2HE LYS 66 12.163 4.476 6.272 242 2HE LYS 66 1HE LYS 66 11.440 6.067 6.512 243 1HZ LYS 66 1HZ LYS 66 11.787 5.601 8.979 244 2HZ LYS 66 2HZ LYS 66 13.158 5.967 8.057 245 3HZ LYS 66 3HZ LYS 66 12.831 4.364 8.485 246 H GLY 67 H GLY 67 5.105 5.443 7.050 247 1HA GLY 67 2HA GLY 67 3.247 5.262 5.373 248 2HA GLY 67 1HA GLY 67 4.347 4.247 4.457 249 H ILE 68 H ILE 68 2.111 3.043 4.825 250 HA ILE 68 HA ILE 68 2.537 1.243 7.117 251 HB ILE 68 HB ILE 68 0.535 2.568 7.509 252 1HG1 ILE 68 2HG1 ILE 68 -0.334 -0.201 6.682 253 2HG1 ILE 68 1HG1 ILE 68 0.655 0.105 8.107 254 1HG2 ILE 68 1HG2 ILE 68 -1.079 3.016 6.004 255 2HG2 ILE 68 2HG2 ILE 68 -0.996 1.408 5.279 256 3HG2 ILE 68 3HG2 ILE 68 0.192 2.634 4.839 257 1HD1 ILE 68 1HD1 ILE 68 -1.101 0.741 9.307 258 2HD1 ILE 68 2HD1 ILE 68 -2.084 0.045 8.019 259 3HD1 ILE 68 3HD1 ILE 68 -1.719 1.770 8.015 260 H VAL 69 H VAL 69 2.470 -0.920 6.732 261 HA VAL 69 HA VAL 69 2.600 -1.743 3.954 262 HB VAL 69 HB VAL 69 2.969 -3.456 6.412 263 1HG1 VAL 69 1HG1 VAL 69 2.562 -4.696 4.346 264 2HG1 VAL 69 2HG1 VAL 69 4.220 -4.916 4.905 265 3HG1 VAL 69 3HG1 VAL 69 3.881 -3.827 3.559 266 1HG2 VAL 69 1HG2 VAL 69 5.366 -2.616 4.963 267 2HG2 VAL 69 2HG2 VAL 69 5.056 -2.694 6.697 268 3HG2 VAL 69 3HG2 VAL 69 4.520 -1.294 5.768 269 H TYR 70 H TYR 70 1.134 -2.933 2.878 270 HA TYR 70 HA TYR 70 -1.082 -4.119 4.361 271 1HB TYR 70 2HB TYR 70 -1.221 -1.954 2.418 272 2HB TYR 70 1HB TYR 70 -2.205 -3.332 1.942 273 HD1 TYR 70 1HD TYR 70 -1.469 -1.680 5.226 274 HD2 TYR 70 2HD TYR 70 -4.408 -3.003 2.448 275 HE1 TYR 70 1HE TYR 70 -3.244 -0.980 6.778 276 HE2 TYR 70 2HE TYR 70 -6.190 -2.302 3.989 277 HH TYR 70 HH TYR 70 -6.475 -1.911 6.414 278 H ALA 71 H ALA 71 -2.017 -5.882 3.435 279 HA ALA 71 HA ALA 71 -0.435 -7.215 1.347 280 1HB ALA 71 1HB ALA 71 -0.460 -8.432 3.448 281 2HB ALA 71 2HB ALA 71 -1.355 -9.320 2.214 282 3HB ALA 71 3HB ALA 71 -2.223 -8.419 3.457 283 H VAL 72 H VAL 72 -1.352 -7.138 -0.576 284 HA VAL 72 HA VAL 72 -4.220 -6.770 -0.804 285 HB VAL 72 HB VAL 72 -2.392 -6.773 -3.172 286 1HG1 VAL 72 1HG1 VAL 72 -4.033 -5.499 -4.174 287 2HG1 VAL 72 2HG1 VAL 72 -4.636 -4.877 -2.639 288 3HG1 VAL 72 3HG1 VAL 72 -4.992 -6.536 -3.117 289 1HG2 VAL 72 1HG2 VAL 72 -2.390 -4.167 -2.586 290 2HG2 VAL 72 2HG2 VAL 72 -1.113 -5.261 -2.053 291 3HG2 VAL 72 3HG2 VAL 72 -2.413 -4.815 -0.946 292 H SER 73 H SER 73 -5.480 -8.361 -1.162 293 HA SER 73 HA SER 73 -4.781 -10.526 -2.960 294 1HB SER 73 2HB SER 73 -4.535 -10.846 -0.139 295 2HB SER 73 1HB SER 73 -5.923 -11.796 -0.668 296 HG SER 73 HG SER 73 -4.453 -12.634 -2.334 297 H SER 74 H SER 74 -6.597 -11.724 -3.685 298 HA SER 74 HA SER 74 -8.955 -10.228 -3.977 299 1HB SER 74 2HB SER 74 -8.111 -11.997 -5.555 300 2HB SER 74 1HB SER 74 -8.677 -13.208 -4.404 301 HG SER 74 HG SER 74 -10.779 -12.070 -4.620 302 H ASP 75 H ASP 75 -7.937 -12.258 -1.421 303 HA ASP 75 HA ASP 75 -10.575 -12.988 -0.541 304 1HB ASP 75 2HB ASP 75 -7.821 -13.641 0.125 305 2HB ASP 75 1HB ASP 75 -8.807 -13.407 1.557 306 H ARG 76 H ARG 76 -8.222 -10.488 0.133 307 HA ARG 76 HA ARG 76 -9.778 -9.513 2.402 308 1HB ARG 76 2HB ARG 76 -7.271 -9.633 2.482 309 2HB ARG 76 1HB ARG 76 -7.227 -8.375 1.255 310 1HG ARG 76 2HG ARG 76 -8.098 -6.765 2.706 311 2HG ARG 76 1HG ARG 76 -8.677 -7.979 3.847 312 1HD ARG 76 2HD ARG 76 -5.875 -8.323 3.550 313 2HD ARG 76 1HD ARG 76 -6.184 -6.607 3.814 314 HE ARG 76 HE ARG 76 -6.354 -8.663 5.744 315 1HH1 ARG 76 1HH1 ARG 76 -7.960 -5.734 4.734 316 2HH1 ARG 76 2HH1 ARG 76 -8.576 -5.380 6.312 317 1HH2 ARG 76 1HH2 ARG 76 -7.164 -8.199 7.821 318 2HH2 ARG 76 2HH2 ARG 76 -8.125 -6.778 8.066 319 H PHE 77 H PHE 77 -8.822 -8.544 -0.854 320 HA PHE 77 HA PHE 77 -10.897 -6.464 -0.760 321 1HB PHE 77 2HB PHE 77 -8.297 -6.122 -2.250 322 2HB PHE 77 1HB PHE 77 -9.519 -4.902 -1.905 323 HD1 PHE 77 1HD PHE 77 -9.929 -4.346 0.578 324 HD2 PHE 77 2HD PHE 77 -6.461 -6.347 -0.861 325 HE1 PHE 77 1HE PHE 77 -8.719 -3.709 2.622 326 HE2 PHE 77 2HE PHE 77 -5.244 -5.712 1.181 327 HZ PHE 77 HZ PHE 77 -6.373 -4.393 2.927 328 H ARG 78 H ARG 78 -12.400 -6.813 -2.228 329 HA ARG 78 HA ARG 78 -12.228 -8.794 -4.208 330 1HB ARG 78 2HB ARG 78 -14.158 -6.849 -3.217 331 2HB ARG 78 1HB ARG 78 -14.294 -7.112 -4.942 332 1HG ARG 78 2HG ARG 78 -15.026 -9.244 -4.702 333 2HG ARG 78 1HG ARG 78 -14.077 -9.511 -3.237 334 1HD ARG 78 2HD ARG 78 -16.111 -7.488 -2.851 335 2HD ARG 78 1HD ARG 78 -16.806 -9.019 -3.384 336 HE ARG 78 HE ARG 78 -15.796 -8.445 -0.818 337 1HH1 ARG 78 1HH1 ARG 78 -15.818 -10.991 -3.206 338 2HH1 ARG 78 2HH1 ARG 78 -15.642 -12.258 -2.039 339 1HH2 ARG 78 1HH2 ARG 78 -15.563 -10.110 0.718 340 2HH2 ARG 78 2HH2 ARG 78 -15.497 -11.759 0.189 341 H SER 79 H SER 79 -11.494 -5.397 -4.174 342 HA SER 79 HA SER 79 -10.206 -5.563 -6.725 343 1HB SER 79 2HB SER 79 -12.921 -4.898 -6.794 344 2HB SER 79 1HB SER 79 -12.079 -3.357 -6.954 345 HG SER 79 HG SER 79 -12.307 -4.229 -8.988 346 H PHE 80 H PHE 80 -9.566 -3.184 -7.417 347 HA PHE 80 HA PHE 80 -7.901 -2.183 -5.405 348 1HB PHE 80 2HB PHE 80 -8.068 -1.833 -8.100 349 2HB PHE 80 1HB PHE 80 -8.654 -0.275 -7.525 350 HD1 PHE 80 1HD PHE 80 -7.053 1.360 -7.439 351 HD2 PHE 80 2HD PHE 80 -5.927 -2.654 -6.596 352 HE1 PHE 80 1HE PHE 80 -4.740 2.093 -7.070 353 HE2 PHE 80 2HE PHE 80 -3.610 -1.928 -6.216 354 HZ PHE 80 HZ PHE 80 -3.011 0.450 -6.455 355 H ASP 81 H ASP 81 -11.148 -1.287 -6.377 356 HA ASP 81 HA ASP 81 -11.320 1.181 -5.045 357 1HB ASP 81 2HB ASP 81 -12.976 -0.092 -6.698 358 2HB ASP 81 1HB ASP 81 -13.723 -0.585 -5.181 359 H ALA 82 H ALA 82 -11.981 -2.120 -3.979 360 HA ALA 82 HA ALA 82 -12.921 -1.416 -1.394 361 1HB ALA 82 1HB ALA 82 -12.455 -3.810 -2.897 362 2HB ALA 82 2HB ALA 82 -13.518 -3.542 -1.514 363 3HB ALA 82 3HB ALA 82 -11.832 -3.986 -1.257 364 H LEU 83 H LEU 83 -9.764 -2.094 -2.754 365 HA LEU 83 HA LEU 83 -8.341 -2.371 -0.325 366 1HB LEU 83 2HB LEU 83 -7.457 -3.002 -2.559 367 2HB LEU 83 1HB LEU 83 -7.382 -1.310 -2.990 368 HG LEU 83 HG LEU 83 -5.760 -0.977 -1.104 369 1HD1 LEU 83 1HD1 LEU 83 -4.725 -2.831 -0.059 370 2HD1 LEU 83 2HD1 LEU 83 -5.548 -3.976 -1.117 371 3HD1 LEU 83 3HD1 LEU 83 -6.466 -3.077 0.092 372 1HD2 LEU 83 1HD2 LEU 83 -5.294 -2.496 -3.587 373 2HD2 LEU 83 2HD2 LEU 83 -3.989 -2.531 -2.402 374 3HD2 LEU 83 3HD2 LEU 83 -4.574 -0.988 -3.022 375 H LEU 84 H LEU 84 -8.973 0.328 -2.484 376 HA LEU 84 HA LEU 84 -7.634 2.323 -1.053 377 1HB LEU 84 2HB LEU 84 -9.897 2.327 -3.014 378 2HB LEU 84 1HB LEU 84 -9.435 3.819 -2.214 379 HG LEU 84 HG LEU 84 -7.448 2.142 -3.724 380 1HD1 LEU 84 1HD1 LEU 84 -9.421 4.140 -4.736 381 2HD1 LEU 84 2HD1 LEU 84 -8.902 2.613 -5.448 382 3HD1 LEU 84 3HD1 LEU 84 -7.830 4.011 -5.488 383 1HD2 LEU 84 1HD2 LEU 84 -7.502 5.043 -2.908 384 2HD2 LEU 84 2HD2 LEU 84 -6.210 4.247 -3.805 385 3HD2 LEU 84 3HD2 LEU 84 -6.554 3.768 -2.139 386 H ALA 85 H ALA 85 -10.850 0.917 -0.672 387 HA ALA 85 HA ALA 85 -11.901 2.876 1.082 388 1HB ALA 85 1HB ALA 85 -12.538 -0.070 1.071 389 2HB ALA 85 2HB ALA 85 -13.211 1.090 -0.076 390 3HB ALA 85 3HB ALA 85 -13.564 1.245 1.646 391 H ASP 86 H ASP 86 -10.150 -0.143 1.668 392 HA ASP 86 HA ASP 86 -10.162 0.120 4.509 393 1HB ASP 86 2HB ASP 86 -9.038 -1.737 2.523 394 2HB ASP 86 1HB ASP 86 -8.042 -1.536 3.962 395 H LEU 87 H LEU 87 -8.050 1.063 1.900 396 HA LEU 87 HA LEU 87 -5.768 1.734 3.399 397 1HB LEU 87 2HB LEU 87 -6.846 2.748 0.773 398 2HB LEU 87 1HB LEU 87 -5.335 3.332 1.433 399 HG LEU 87 HG LEU 87 -5.949 0.799 0.070 400 1HD1 LEU 87 1HD1 LEU 87 -3.842 1.094 -0.860 401 2HD1 LEU 87 2HD1 LEU 87 -3.275 2.073 0.493 402 3HD1 LEU 87 3HD1 LEU 87 -4.441 2.738 -0.650 403 1HD2 LEU 87 1HD2 LEU 87 -3.963 0.790 2.341 404 2HD2 LEU 87 2HD2 LEU 87 -4.327 -0.537 1.238 405 3HD2 LEU 87 3HD2 LEU 87 -5.542 0.007 2.393 406 H THR 88 H THR 88 -8.648 3.585 2.557 407 HA THR 88 HA THR 88 -7.805 6.072 3.545 408 HB THR 88 HB THR 88 -10.625 5.628 4.027 409 HG1 THR 88 1HG THR 88 -11.168 5.043 1.891 410 1HG2 THR 88 1HG2 THR 88 -9.217 7.181 1.873 411 2HG2 THR 88 2HG2 THR 88 -9.720 7.801 3.446 412 3HG2 THR 88 3HG2 THR 88 -10.930 7.283 2.272 413 H ARG 89 H ARG 89 -9.340 3.305 5.073 414 HA ARG 89 HA ARG 89 -9.704 4.491 7.620 415 1HB ARG 89 2HB ARG 89 -9.933 1.786 6.452 416 2HB ARG 89 1HB ARG 89 -9.640 1.850 8.185 417 1HG ARG 89 2HG ARG 89 -11.951 1.795 8.020 418 2HG ARG 89 1HG ARG 89 -11.597 3.508 8.250 419 1HD ARG 89 2HD ARG 89 -11.997 4.009 5.998 420 2HD ARG 89 1HD ARG 89 -11.874 2.320 5.510 421 HE ARG 89 HE ARG 89 -14.214 3.666 6.366 422 1HH1 ARG 89 1HH1 ARG 89 -12.594 0.580 6.570 423 2HH1 ARG 89 2HH1 ARG 89 -14.060 -0.315 6.783 424 1HH2 ARG 89 1HH2 ARG 89 -16.143 2.488 6.647 425 2HH2 ARG 89 2HH2 ARG 89 -16.076 0.767 6.827 426 H SER 90 H SER 90 -7.156 2.347 6.306 427 HA SER 90 HA SER 90 -5.735 2.254 8.787 428 1HB SER 90 2HB SER 90 -5.573 0.969 6.251 429 2HB SER 90 1HB SER 90 -3.988 1.650 6.620 430 HG SER 90 HG SER 90 -5.289 -0.458 7.765 431 H LEU 91 H LEU 91 -5.420 4.178 5.842 432 HA LEU 91 HA LEU 91 -3.104 5.530 6.951 433 1HB LEU 91 2HB LEU 91 -4.236 5.069 4.294 434 2HB LEU 91 1HB LEU 91 -3.611 6.678 4.528 435 HG LEU 91 HG LEU 91 -2.125 4.072 4.698 436 1HD1 LEU 91 1HD1 LEU 91 -0.636 5.644 3.149 437 2HD1 LEU 91 2HD1 LEU 91 -2.213 6.374 2.847 438 3HD1 LEU 91 3HD1 LEU 91 -1.959 4.658 2.525 439 1HD2 LEU 91 1HD2 LEU 91 -0.240 6.030 5.091 440 2HD2 LEU 91 2HD2 LEU 91 -0.894 4.960 6.331 441 3HD2 LEU 91 3HD2 LEU 91 -1.584 6.567 6.101 442 H SER 92 H SER 92 -6.365 5.861 7.200 443 HA SER 92 HA SER 92 -7.277 8.290 6.626 444 1HB SER 92 2HB SER 92 -8.246 8.298 9.075 445 2HB SER 92 1HB SER 92 -8.760 7.077 7.914 446 HG SER 92 HG SER 92 -7.998 5.649 9.234 447 H ASP 93 H ASP 93 -6.719 10.324 6.840 448 HA ASP 93 HA ASP 93 -5.370 11.308 9.198 449 1HB ASP 93 2HB ASP 93 -3.929 10.719 6.730 450 2HB ASP 93 1HB ASP 93 -3.757 12.403 7.208 451 H ASN 94 H ASN 94 -4.536 13.779 8.105 452 HA ASN 94 HA ASN 94 -6.649 14.959 6.581 453 1HB ASN 94 2HB ASN 94 -7.326 16.560 8.422 454 2HB ASN 94 1HB ASN 94 -7.899 14.905 8.609 455 1HD2 ASN 94 1HD2 ASN 94 -8.155 15.596 10.852 456 2HD2 ASN 94 2HD2 ASN 94 -6.800 15.477 11.917 457 H ILE 95 H ILE 95 -3.739 14.755 6.598 458 HA ILE 95 HA ILE 95 -3.069 17.615 6.708 459 HB ILE 95 HB ILE 95 -1.419 15.201 7.418 460 1HG1 ILE 95 2HG1 ILE 95 -2.618 16.239 9.247 461 2HG1 ILE 95 1HG1 ILE 95 -0.900 16.586 9.418 462 1HG2 ILE 95 1HG2 ILE 95 -0.018 16.377 5.904 463 2HG2 ILE 95 2HG2 ILE 95 0.544 16.737 7.537 464 3HG2 ILE 95 3HG2 ILE 95 -0.410 17.927 6.650 465 1HD1 ILE 95 1HD1 ILE 95 -3.156 18.394 9.004 466 2HD1 ILE 95 2HD1 ILE 95 -1.747 18.741 8.001 467 3HD1 ILE 95 3HD1 ILE 95 -1.586 18.681 9.756 468 H ASN 96 H ASN 96 -1.939 14.559 5.253 469 HA ASN 96 HA ASN 96 -1.236 16.003 2.811 470 1HB ASN 96 2HB ASN 96 -0.520 13.318 3.940 471 2HB ASN 96 1HB ASN 96 -0.330 13.623 2.216 472 1HD2 ASN 96 1HD2 ASN 96 0.989 14.029 5.306 473 2HD2 ASN 96 2HD2 ASN 96 2.336 15.018 4.866 474 H LEU 97 H LEU 97 -3.494 13.654 4.044 475 HA LEU 97 HA LEU 97 -4.625 13.309 1.350 476 1HB LEU 97 2HB LEU 97 -4.793 11.632 3.843 477 2HB LEU 97 1HB LEU 97 -5.897 11.406 2.498 478 HG LEU 97 HG LEU 97 -2.915 11.267 2.132 479 1HD1 LEU 97 1HD1 LEU 97 -4.813 9.109 3.009 480 2HD1 LEU 97 2HD1 LEU 97 -3.299 9.610 3.763 481 3HD1 LEU 97 3HD1 LEU 97 -3.276 8.764 2.216 482 1HD2 LEU 97 1HD2 LEU 97 -5.292 10.300 0.560 483 2HD2 LEU 97 2HD2 LEU 97 -3.630 9.827 0.212 484 3HD2 LEU 97 3HD2 LEU 97 -4.109 11.520 0.088 485 HA PRO 98 HA PRO 98 -7.474 16.542 2.986 486 1HB PRO 98 2HB PRO 98 -8.547 15.686 0.315 487 2HB PRO 98 1HB PRO 98 -8.473 17.298 1.022 488 1HG PRO 98 2HG PRO 98 -6.676 16.547 -0.779 489 2HG PRO 98 1HG PRO 98 -6.190 17.510 0.629 490 1HD PRO 98 2HD PRO 98 -5.715 14.639 0.049 491 2HD PRO 98 1HD PRO 98 -4.756 15.770 1.022 492 H GLN 99 H GLN 99 -8.960 14.055 0.935 493 HA GLN 99 HA GLN 99 -10.986 13.624 3.004 494 1HB GLN 99 2HB GLN 99 -10.970 12.650 0.141 495 2HB GLN 99 1HB GLN 99 -12.325 12.597 1.261 496 1HG GLN 99 2HG GLN 99 -12.656 14.900 1.160 497 2HG GLN 99 1HG GLN 99 -11.049 15.195 0.499 498 1HE2 GLN 99 1HE2 GLN 99 -10.647 14.649 -1.691 499 2HE2 GLN 99 2HE2 GLN 99 -11.940 14.555 -2.832 500 H GLY 100 H GLY 100 -8.398 12.013 1.312 501 1HA GLY 100 2HA GLY 100 -7.569 10.175 2.930 502 2HA GLY 100 1HA GLY 100 -9.115 9.451 2.504 503 H VAL 101 H VAL 101 -7.347 7.829 1.886 504 HA VAL 101 HA VAL 101 -5.882 8.220 -0.517 505 HB VAL 101 HB VAL 101 -6.768 5.580 0.655 506 1HG1 VAL 101 1HG1 VAL 101 -5.106 4.574 -0.615 507 2HG1 VAL 101 2HG1 VAL 101 -4.253 6.093 -0.883 508 3HG1 VAL 101 3HG1 VAL 101 -5.771 5.779 -1.717 509 1HG2 VAL 101 1HG2 VAL 101 -5.284 7.464 1.980 510 2HG2 VAL 101 2HG2 VAL 101 -4.043 6.466 1.223 511 3HG2 VAL 101 3HG2 VAL 101 -5.242 5.727 2.285 512 H ARG 102 H ARG 102 -6.880 8.677 -2.345 513 HA ARG 102 HA ARG 102 -9.389 7.331 -2.999 514 1HB ARG 102 2HB ARG 102 -8.246 9.938 -3.568 515 2HB ARG 102 1HB ARG 102 -8.836 9.153 -5.026 516 1HG ARG 102 2HG ARG 102 -10.572 9.178 -2.615 517 2HG ARG 102 1HG ARG 102 -10.403 10.655 -3.568 518 1HD ARG 102 2HD ARG 102 -12.283 8.915 -4.112 519 2HD ARG 102 1HD ARG 102 -11.435 9.757 -5.402 520 HE ARG 102 HE ARG 102 -9.979 7.643 -5.448 521 1HH1 ARG 102 1HH1 ARG 102 -13.387 7.649 -4.634 522 2HH1 ARG 102 2HH1 ARG 102 -13.633 6.019 -5.156 523 1HH2 ARG 102 1HH2 ARG 102 -10.319 5.508 -6.131 524 2HH2 ARG 102 2HH2 ARG 102 -11.897 4.804 -6.004 525 H TYR 103 H TYR 103 -6.091 7.750 -4.150 526 HA TYR 103 HA TYR 103 -6.491 5.414 -5.843 527 1HB TYR 103 2HB TYR 103 -5.307 7.938 -7.008 528 2HB TYR 103 1HB TYR 103 -5.616 6.423 -7.825 529 HD1 TYR 103 1HD TYR 103 -7.905 5.711 -8.342 530 HD2 TYR 103 2HD TYR 103 -7.073 9.542 -6.695 531 HE1 TYR 103 1HE TYR 103 -10.122 6.482 -9.045 532 HE2 TYR 103 2HE TYR 103 -9.299 10.327 -7.386 533 HH TYR 103 HH TYR 103 -11.012 9.738 -9.089 534 H ILE 104 H ILE 104 -4.556 4.414 -6.565 535 HA ILE 104 HA ILE 104 -2.247 5.054 -4.856 536 HB ILE 104 HB ILE 104 -3.168 2.435 -6.032 537 1HG1 ILE 104 2HG1 ILE 104 -2.597 2.061 -3.371 538 2HG1 ILE 104 1HG1 ILE 104 -3.221 3.709 -3.391 539 1HG2 ILE 104 1HG2 ILE 104 -0.475 3.276 -5.232 540 2HG2 ILE 104 2HG2 ILE 104 -0.993 1.965 -6.294 541 3HG2 ILE 104 3HG2 ILE 104 -1.021 1.746 -4.544 542 1HD1 ILE 104 1HD1 ILE 104 -4.585 1.165 -4.136 543 2HD1 ILE 104 2HD1 ILE 104 -5.149 2.711 -4.773 544 3HD1 ILE 104 3HD1 ILE 104 -5.106 2.437 -3.031 545 H TYR 105 H TYR 105 -0.483 5.777 -5.824 546 HA TYR 105 HA TYR 105 -0.264 5.521 -8.729 547 1HB TYR 105 2HB TYR 105 0.227 7.676 -6.850 548 2HB TYR 105 1HB TYR 105 1.599 7.407 -7.926 549 HD1 TYR 105 1HD TYR 105 1.196 7.351 -10.391 550 HD2 TYR 105 2HD TYR 105 -1.705 8.752 -7.629 551 HE1 TYR 105 1HE TYR 105 0.028 8.474 -12.212 552 HE2 TYR 105 2HE TYR 105 -2.891 9.893 -9.437 553 HH TYR 105 HH TYR 105 -2.038 10.850 -11.893 554 H THR 106 H THR 106 1.923 5.473 -9.641 555 HA THR 106 HA THR 106 3.386 3.288 -8.513 556 HB THR 106 HB THR 106 5.027 3.897 -10.405 557 HG1 THR 106 1HG THR 106 4.505 5.486 -11.710 558 1HG2 THR 106 1HG2 THR 106 2.828 2.350 -10.453 559 2HG2 THR 106 2HG2 THR 106 3.908 2.580 -11.829 560 3HG2 THR 106 3HG2 THR 106 2.422 3.524 -11.706 561 H ILE 107 H ILE 107 5.627 3.304 -7.909 562 HA ILE 107 HA ILE 107 6.313 5.035 -5.915 563 HB ILE 107 HB ILE 107 7.454 2.879 -6.449 564 1HG1 ILE 107 2HG1 ILE 107 9.716 3.667 -5.702 565 2HG1 ILE 107 1HG1 ILE 107 9.164 5.321 -5.946 566 1HG2 ILE 107 1HG2 ILE 107 7.814 3.453 -8.868 567 2HG2 ILE 107 2HG2 ILE 107 9.208 2.759 -8.039 568 3HG2 ILE 107 3HG2 ILE 107 9.139 4.495 -8.345 569 1HD1 ILE 107 1HD1 ILE 107 9.073 4.186 -3.586 570 2HD1 ILE 107 2HD1 ILE 107 7.556 3.529 -4.203 571 3HD1 ILE 107 3HD1 ILE 107 7.794 5.275 -4.122 572 H ASP 108 H ASP 108 6.632 5.547 -9.338 573 HA ASP 108 HA ASP 108 8.258 7.942 -8.930 574 1HB ASP 108 2HB ASP 108 8.674 6.183 -10.782 575 2HB ASP 108 1HB ASP 108 7.305 6.933 -11.598 576 H GLY 109 H GLY 109 5.003 6.974 -9.525 577 1HA GLY 109 2HA GLY 109 3.108 8.317 -9.358 578 2HA GLY 109 1HA GLY 109 4.141 9.737 -9.398 579 H SER 110 H SER 110 4.751 7.462 -11.870 580 HA SER 110 HA SER 110 4.068 9.299 -13.910 581 1HB SER 110 2HB SER 110 5.016 6.465 -13.833 582 2HB SER 110 1HB SER 110 4.375 7.103 -15.347 583 HG SER 110 HG SER 110 6.369 8.448 -13.856 584 H ARG 111 H ARG 111 2.513 6.323 -12.748 585 HA ARG 111 HA ARG 111 -0.003 7.253 -13.857 586 1HB ARG 111 2HB ARG 111 -0.374 4.821 -14.671 587 2HB ARG 111 1HB ARG 111 0.584 5.909 -15.666 588 1HG ARG 111 2HG ARG 111 2.575 4.851 -15.138 589 2HG ARG 111 1HG ARG 111 1.915 4.124 -13.671 590 1HD ARG 111 2HD ARG 111 0.397 2.778 -15.180 591 2HD ARG 111 1HD ARG 111 1.374 3.354 -16.530 592 HE ARG 111 HE ARG 111 2.896 2.128 -14.414 593 1HH1 ARG 111 1HH1 ARG 111 1.118 1.573 -17.367 594 2HH1 ARG 111 2HH1 ARG 111 1.944 0.096 -17.733 595 1HH2 ARG 111 1HH2 ARG 111 3.983 0.186 -14.895 596 2HH2 ARG 111 2HH2 ARG 111 3.571 -0.691 -16.332 597 H LYS 112 H LYS 112 -1.816 6.302 -12.916 598 HA LYS 112 HA LYS 112 -1.352 5.276 -10.230 599 1HB LYS 112 2HB LYS 112 -2.869 7.057 -10.163 600 2HB LYS 112 1HB LYS 112 -3.706 6.536 -11.610 601 1HG LYS 112 2HG LYS 112 -4.247 4.457 -9.976 602 2HG LYS 112 1HG LYS 112 -4.114 5.767 -8.804 603 1HD LYS 112 2HD LYS 112 -5.915 5.689 -11.225 604 2HD LYS 112 1HD LYS 112 -6.417 5.553 -9.539 605 1HE LYS 112 2HE LYS 112 -6.852 7.770 -9.947 606 2HE LYS 112 1HE LYS 112 -5.211 7.864 -9.309 607 1HZ LYS 112 1HZ LYS 112 -4.384 8.495 -11.287 608 2HZ LYS 112 2HZ LYS 112 -5.970 9.002 -11.588 609 3HZ LYS 112 3HZ LYS 112 -5.432 7.513 -12.183 610 H ILE 113 H ILE 113 -2.066 3.306 -9.500 611 HA ILE 113 HA ILE 113 -2.467 1.280 -11.503 612 HB ILE 113 HB ILE 113 -2.482 1.026 -8.495 613 1HG1 ILE 113 2HG1 ILE 113 -0.372 1.958 -9.710 614 2HG1 ILE 113 1HG1 ILE 113 -0.188 0.675 -8.522 615 1HG2 ILE 113 1HG2 ILE 113 -1.620 -1.353 -9.417 616 2HG2 ILE 113 2HG2 ILE 113 -2.740 -0.900 -10.701 617 3HG2 ILE 113 3HG2 ILE 113 -3.304 -0.995 -9.033 618 1HD1 ILE 113 1HD1 ILE 113 -0.601 -0.292 -11.241 619 2HD1 ILE 113 2HD1 ILE 113 0.598 -0.764 -10.034 620 3HD1 ILE 113 3HD1 ILE 113 0.862 0.670 -11.030 621 H GLY 114 H GLY 114 -4.299 0.227 -12.000 622 1HA GLY 114 2HA GLY 114 -6.739 0.984 -10.516 623 2HA GLY 114 1HA GLY 114 -6.705 0.698 -12.249 624 H SER 115 H SER 115 -4.796 -1.613 -11.717 625 HA SER 115 HA SER 115 -6.813 -3.524 -10.740 626 1HB SER 115 2HB SER 115 -6.055 -5.129 -12.402 627 2HB SER 115 1HB SER 115 -6.516 -3.630 -13.208 628 HG SER 115 HG SER 115 -4.248 -3.086 -13.188 629 H MET 116 H MET 116 -6.105 -5.282 -9.572 630 HA MET 116 HA MET 116 -3.897 -4.899 -7.886 631 1HB MET 116 2HB MET 116 -6.127 -6.509 -7.884 632 2HB MET 116 1HB MET 116 -4.828 -7.669 -8.125 633 1HG MET 116 2HG MET 116 -3.725 -6.904 -6.117 634 2HG MET 116 1HG MET 116 -4.950 -5.656 -5.894 635 1HE MET 116 1HE MET 116 -6.885 -6.361 -3.802 636 2HE MET 116 2HE MET 116 -8.031 -7.307 -4.752 637 3HE MET 116 3HE MET 116 -7.214 -5.924 -5.479 638 H ASP 117 H ASP 117 -4.236 -6.482 -10.952 639 HA ASP 117 HA ASP 117 -2.085 -8.240 -10.878 640 1HB ASP 117 2HB ASP 117 -3.866 -7.081 -12.857 641 2HB ASP 117 1HB ASP 117 -2.253 -7.331 -13.494 642 H GLU 118 H GLU 118 -2.114 -4.805 -10.956 643 HA GLU 118 HA GLU 118 0.538 -4.608 -12.126 644 1HB GLU 118 2HB GLU 118 -1.330 -2.523 -10.995 645 2HB GLU 118 1HB GLU 118 0.248 -2.163 -11.680 646 1HG GLU 118 2HG GLU 118 -0.543 -3.229 -13.808 647 2HG GLU 118 1HG GLU 118 -2.153 -3.287 -13.091 648 H LEU 119 H LEU 119 -0.823 -5.031 -9.028 649 HA LEU 119 HA LEU 119 1.327 -3.769 -7.574 650 1HB LEU 119 2HB LEU 119 -0.517 -5.719 -6.284 651 2HB LEU 119 1HB LEU 119 0.153 -4.231 -5.650 652 HG LEU 119 HG LEU 119 -2.058 -4.407 -7.695 653 1HD1 LEU 119 1HD1 LEU 119 -3.585 -4.208 -6.044 654 2HD1 LEU 119 2HD1 LEU 119 -2.505 -3.277 -5.005 655 3HD1 LEU 119 3HD1 LEU 119 -2.334 -5.029 -5.110 656 1HD2 LEU 119 1HD2 LEU 119 -0.503 -2.395 -7.753 657 2HD2 LEU 119 2HD2 LEU 119 -1.165 -1.980 -6.172 658 3HD2 LEU 119 3HD2 LEU 119 -2.227 -2.072 -7.576 659 H GLU 120 H GLU 120 3.276 -4.677 -7.516 660 HA GLU 120 HA GLU 120 3.506 -7.593 -7.603 661 1HB GLU 120 2HB GLU 120 5.777 -5.621 -7.750 662 2HB GLU 120 1HB GLU 120 5.747 -7.287 -8.290 663 1HG GLU 120 2HG GLU 120 4.466 -6.783 -10.175 664 2HG GLU 120 1HG GLU 120 3.982 -5.216 -9.530 665 H GLU 121 H GLU 121 4.906 -8.698 -6.096 666 HA GLU 121 HA GLU 121 4.456 -8.061 -3.433 667 1HB GLU 121 2HB GLU 121 6.547 -9.811 -4.706 668 2HB GLU 121 1HB GLU 121 6.381 -9.655 -2.962 669 1HG GLU 121 2HG GLU 121 3.868 -10.255 -3.506 670 2HG GLU 121 1HG GLU 121 4.603 -10.987 -4.931 671 H GLY 122 H GLY 122 5.957 -7.528 -1.735 672 1HA GLY 122 2HA GLY 122 7.235 -5.870 -0.787 673 2HA GLY 122 1HA GLY 122 8.479 -6.597 -1.781 674 H GLU 123 H GLU 123 5.645 -4.715 -2.780 675 HA GLU 123 HA GLU 123 7.466 -2.922 -4.223 676 1HB GLU 123 2HB GLU 123 4.622 -3.728 -4.579 677 2HB GLU 123 1HB GLU 123 5.117 -2.146 -5.165 678 1HG GLU 123 2HG GLU 123 6.416 -4.747 -5.936 679 2HG GLU 123 1HG GLU 123 5.205 -3.895 -6.892 680 H SER 124 H SER 124 6.959 -0.631 -4.331 681 HA SER 124 HA SER 124 5.854 0.382 -1.794 682 1HB SER 124 2HB SER 124 7.961 1.713 -3.515 683 2HB SER 124 1HB SER 124 7.414 2.228 -1.919 684 HG SER 124 HG SER 124 9.066 1.063 -1.305 685 H TYR 125 H TYR 125 4.117 1.665 -1.955 686 HA TYR 125 HA TYR 125 3.571 2.911 -4.562 687 1HB TYR 125 2HB TYR 125 1.721 1.380 -2.797 688 2HB TYR 125 1HB TYR 125 1.097 2.601 -3.885 689 HD1 TYR 125 1HD TYR 125 1.666 2.421 -6.326 690 HD2 TYR 125 2HD TYR 125 2.212 -0.794 -3.612 691 HE1 TYR 125 1HE TYR 125 1.753 0.881 -8.203 692 HE2 TYR 125 2HE TYR 125 2.290 -2.375 -5.494 693 HH TYR 125 HH TYR 125 1.216 -1.762 -8.456 694 H VAL 126 H VAL 126 2.167 4.703 -4.555 695 HA VAL 126 HA VAL 126 2.340 6.261 -2.044 696 HB VAL 126 HB VAL 126 2.790 7.172 -4.875 697 1HG1 VAL 126 1HG1 VAL 126 1.540 8.702 -2.674 698 2HG1 VAL 126 2HG1 VAL 126 1.427 8.928 -4.419 699 3HG1 VAL 126 3HG1 VAL 126 2.844 9.511 -3.543 700 1HG2 VAL 126 1HG2 VAL 126 4.542 6.496 -2.992 701 2HG2 VAL 126 2HG2 VAL 126 4.287 8.181 -2.535 702 3HG2 VAL 126 3HG2 VAL 126 4.854 7.783 -4.157 703 H CYS 127 H CYS 127 0.567 7.277 -1.318 704 HA CYS 127 HA CYS 127 -1.943 6.647 -2.650 705 1HB CYS 127 2HB CYS 127 -1.337 7.805 0.074 706 2HB CYS 127 1HB CYS 127 -2.962 7.512 -0.533 707 HG CYS 127 HG CYS 127 -2.052 4.903 -0.702 708 H SER 128 H SER 128 -2.832 8.028 -3.993 709 HA SER 128 HA SER 128 -2.235 10.895 -3.693 710 1HB SER 128 2HB SER 128 -3.022 9.321 -6.158 711 2HB SER 128 1HB SER 128 -2.814 11.075 -6.107 712 HG SER 128 HG SER 128 -0.824 9.128 -5.543 713 H SER 129 H SER 129 -3.909 12.408 -4.121 714 HA SER 129 HA SER 129 -6.645 11.485 -4.288 715 1HB SER 129 2HB SER 129 -7.143 13.012 -2.195 716 2HB SER 129 1HB SER 129 -6.657 11.330 -1.974 717 HG SER 129 HG SER 129 -5.471 12.784 -0.644 718 H ASP 130 H ASP 130 -4.436 14.189 -3.768 719 HA ASP 130 HA ASP 130 -5.843 15.722 -5.800 720 1HB ASP 130 2HB ASP 130 -5.826 16.393 -2.918 721 2HB ASP 130 1HB ASP 130 -5.461 17.723 -4.012 722 H ASN 131 H ASN 131 -3.157 15.551 -3.507 723 HA ASN 131 HA ASN 131 -1.495 17.512 -4.503 724 1HB ASN 131 2HB ASN 131 0.356 16.248 -3.520 725 2HB ASN 131 1HB ASN 131 -1.042 16.241 -2.447 726 1HD2 ASN 131 1HD2 ASN 131 -2.072 14.341 -2.002 727 2HD2 ASN 131 2HD2 ASN 131 -1.481 12.798 -2.504 728 H PHE 132 H PHE 132 -0.135 17.728 -6.199 729 HA PHE 132 HA PHE 132 -0.347 15.765 -8.333 730 1HB PHE 132 2HB PHE 132 0.933 18.504 -8.250 731 2HB PHE 132 1HB PHE 132 0.848 17.486 -9.684 732 HD1 PHE 132 1HD PHE 132 -1.347 19.031 -7.102 733 HD2 PHE 132 2HD PHE 132 -0.929 17.725 -11.131 734 HE1 PHE 132 1HE PHE 132 -3.558 19.970 -7.631 735 HE2 PHE 132 2HE PHE 132 -3.139 18.663 -11.668 736 HZ PHE 132 HZ PHE 132 -4.457 19.788 -9.918 737 H PHE 133 H PHE 133 0.986 14.531 -6.430 738 HA PHE 133 HA PHE 133 2.870 13.379 -5.939 739 1HB PHE 133 2HB PHE 133 2.766 13.146 -8.485 740 2HB PHE 133 1HB PHE 133 4.015 14.380 -8.528 741 HD1 PHE 133 1HD PHE 133 6.274 13.829 -8.147 742 HD2 PHE 133 2HD PHE 133 3.219 10.993 -7.290 743 HE1 PHE 133 1HE PHE 133 7.984 12.091 -7.816 744 HE2 PHE 133 2HE PHE 133 4.921 9.249 -6.951 745 HZ PHE 133 HZ PHE 133 7.310 9.798 -7.216 746 H LYS 134 H LYS 134 4.318 13.925 -4.450 747 HA LYS 134 HA LYS 134 5.525 16.595 -4.594 748 1HB LYS 134 2HB LYS 134 5.483 14.748 -2.212 749 2HB LYS 134 1HB LYS 134 5.838 16.470 -2.230 750 1HG LYS 134 2HG LYS 134 3.208 15.808 -3.310 751 2HG LYS 134 1HG LYS 134 3.424 15.349 -1.620 752 1HD LYS 134 2HD LYS 134 3.136 17.466 -1.003 753 2HD LYS 134 1HD LYS 134 4.530 17.944 -1.971 754 1HE LYS 134 2HE LYS 134 1.782 17.570 -3.138 755 2HE LYS 134 1HE LYS 134 2.344 19.111 -2.490 756 1HZ LYS 134 1HZ LYS 134 3.293 17.646 -4.863 757 2HZ LYS 134 2HZ LYS 134 4.314 18.744 -4.083 758 3HZ LYS 134 3HZ LYS 134 2.840 19.270 -4.724 759 H LYS 135 H LYS 135 6.365 13.641 -5.571 760 HA LYS 135 HA LYS 135 8.292 12.390 -5.691 761 1HB LYS 135 2HB LYS 135 10.140 13.700 -6.717 762 2HB LYS 135 1HB LYS 135 8.578 13.953 -7.481 763 1HG LYS 135 2HG LYS 135 9.334 15.858 -5.351 764 2HG LYS 135 1HG LYS 135 10.238 15.941 -6.861 765 1HD LYS 135 2HD LYS 135 7.777 15.810 -7.873 766 2HD LYS 135 1HD LYS 135 7.386 16.540 -6.314 767 1HE LYS 135 2HE LYS 135 8.196 18.517 -6.944 768 2HE LYS 135 1HE LYS 135 9.695 17.793 -7.526 769 1HZ LYS 135 1HZ LYS 135 8.400 18.947 -9.266 770 2HZ LYS 135 2HZ LYS 135 7.156 17.820 -9.062 771 3HZ LYS 135 3HZ LYS 135 8.672 17.313 -9.614 772 H VAL 136 H VAL 136 8.744 11.610 -3.659 773 HA VAL 136 HA VAL 136 10.850 13.062 -2.199 774 HB VAL 136 HB VAL 136 9.678 11.513 -0.247 775 1HG1 VAL 136 1HG1 VAL 136 9.781 14.364 -0.951 776 2HG1 VAL 136 2HG1 VAL 136 10.253 13.536 0.533 777 3HG1 VAL 136 3HG1 VAL 136 8.555 13.910 0.234 778 1HG2 VAL 136 1HG2 VAL 136 7.769 11.268 -1.988 779 2HG2 VAL 136 2HG2 VAL 136 7.368 12.921 -1.523 780 3HG2 VAL 136 3HG2 VAL 136 7.368 11.639 -0.312 781 H GLU 137 H GLU 137 11.867 11.451 -0.509 782 HA GLU 137 HA GLU 137 12.950 9.300 -2.079 783 1HB GLU 137 2HB GLU 137 13.479 10.218 0.752 784 2HB GLU 137 1HB GLU 137 14.305 8.853 0.014 785 1HG GLU 137 2HG GLU 137 15.424 10.210 -1.521 786 2HG GLU 137 1HG GLU 137 14.333 11.569 -1.249 787 H TYR 138 H TYR 138 10.712 8.488 -2.239 788 HA TYR 138 HA TYR 138 9.264 7.250 -0.265 789 1HB TYR 138 2HB TYR 138 9.704 6.636 -3.167 790 2HB TYR 138 1HB TYR 138 8.536 5.731 -2.197 791 HD1 TYR 138 1HD TYR 138 7.416 7.903 -0.521 792 HD2 TYR 138 2HD TYR 138 8.392 7.849 -4.660 793 HE1 TYR 138 1HE TYR 138 5.749 9.664 -0.930 794 HE2 TYR 138 2HE TYR 138 6.726 9.608 -5.083 795 HH TYR 138 HH TYR 138 4.583 10.431 -3.933 796 H THR 139 H THR 139 11.704 5.698 -2.359 797 HA THR 139 HA THR 139 11.771 3.409 -0.543 798 HB THR 139 HB THR 139 12.963 2.247 -2.323 799 HG1 THR 139 1HG THR 139 12.805 4.715 -3.709 800 1HG2 THR 139 1HG2 THR 139 10.917 3.531 -3.984 801 2HG2 THR 139 2HG2 THR 139 10.347 2.884 -2.446 802 3HG2 THR 139 3HG2 THR 139 11.170 1.830 -3.595 803 H LYS 140 H LYS 140 13.608 6.186 -1.376 804 HA LYS 140 HA LYS 140 16.187 5.184 -0.699 805 1HB LYS 140 2HB LYS 140 15.017 7.742 -1.476 806 2HB LYS 140 1HB LYS 140 16.306 7.917 -0.291 807 1HG LYS 140 2HG LYS 140 17.733 6.492 -1.794 808 2HG LYS 140 1HG LYS 140 16.462 6.642 -3.009 809 1HD LYS 140 2HD LYS 140 17.105 9.230 -1.941 810 2HD LYS 140 1HD LYS 140 18.576 8.426 -2.493 811 1HE LYS 140 2HE LYS 140 17.885 8.360 -4.677 812 2HE LYS 140 1HE LYS 140 16.175 8.348 -4.249 813 1HZ LYS 140 1HZ LYS 140 17.635 10.758 -3.549 814 2HZ LYS 140 2HZ LYS 140 16.083 10.582 -4.198 815 3HZ LYS 140 3HZ LYS 140 17.438 10.482 -5.207 816 H ASN 141 H ASN 141 17.139 4.915 1.144 817 HA ASN 141 HA ASN 141 17.620 4.923 3.344 818 1HB ASN 141 2HB ASN 141 15.817 7.338 3.538 819 2HB ASN 141 1HB ASN 141 17.034 6.842 4.710 820 1HD2 ASN 141 1HD2 ASN 141 16.407 8.493 1.783 821 2HD2 ASN 141 2HD2 ASN 141 18.022 9.021 1.470 822 H VAL 142 H VAL 142 14.921 3.897 2.134 823 HA VAL 142 HA VAL 142 13.376 3.653 4.600 824 HB VAL 142 HB VAL 142 12.678 2.655 1.838 825 1HG1 VAL 142 1HG1 VAL 142 10.324 2.964 3.011 826 2HG1 VAL 142 2HG1 VAL 142 11.285 2.680 4.463 827 3HG1 VAL 142 3HG1 VAL 142 11.253 1.474 3.176 828 1HG2 VAL 142 1HG2 VAL 142 11.045 4.818 2.490 829 2HG2 VAL 142 2HG2 VAL 142 12.344 4.789 1.296 830 3HG2 VAL 142 3HG2 VAL 142 12.673 5.322 2.945 831 H ASN 143 H ASN 143 15.508 1.819 2.585 832 HA ASN 143 HA ASN 143 16.431 -0.246 2.834 833 1HB ASN 143 2HB ASN 143 15.398 0.357 5.500 834 2HB ASN 143 1HB ASN 143 15.436 -1.370 5.163 835 1HD2 ASN 143 1HD2 ASN 143 17.358 -2.414 5.052 836 2HD2 ASN 143 2HD2 ASN 143 18.881 -1.663 5.375 837 HA PRO 144 HA PRO 144 12.650 -2.162 1.124 838 1HB PRO 144 2HB PRO 144 14.541 -3.416 -0.731 839 2HB PRO 144 1HB PRO 144 13.173 -2.356 -1.076 840 1HG PRO 144 2HG PRO 144 15.729 -1.557 -1.395 841 2HG PRO 144 1HG PRO 144 14.440 -0.443 -0.901 842 1HD PRO 144 2HD PRO 144 16.521 -1.797 0.783 843 2HD PRO 144 1HD PRO 144 15.939 -0.119 0.848 844 H ASN 145 H ASN 145 12.992 -3.301 3.312 845 HA ASN 145 HA ASN 145 13.320 -6.131 2.744 846 1HB ASN 145 2HB ASN 145 14.852 -6.547 4.582 847 2HB ASN 145 1HB ASN 145 15.571 -5.387 3.470 848 1HD2 ASN 145 1HD2 ASN 145 15.925 -5.964 6.392 849 2HD2 ASN 145 2HD2 ASN 145 15.762 -4.425 7.161 850 H TRP 146 H TRP 146 11.204 -4.158 3.545 851 HA TRP 146 HA TRP 146 10.452 -4.835 6.226 852 1HB TRP 146 2HB TRP 146 8.143 -3.876 5.070 853 2HB TRP 146 1HB TRP 146 9.357 -2.902 5.886 854 HD1 TRP 146 HD TRP 146 10.922 -1.369 4.381 855 HE1 TRP 146 1HE TRP 146 10.736 -0.570 1.942 856 HE3 TRP 146 3HE TRP 146 7.353 -4.637 2.716 857 HZ2 TRP 146 2HZ TRP 146 9.273 -1.233 -0.377 858 HZ3 TRP 146 3HZ TRP 146 6.615 -4.483 0.379 859 HH2 TRP 146 HH TRP 146 7.556 -2.818 -1.136 860 H SER 147 H SER 147 9.860 -6.173 3.082 861 HA SER 147 HA SER 147 7.599 -7.756 3.918 862 1HB SER 147 2HB SER 147 7.801 -8.781 1.662 863 2HB SER 147 1HB SER 147 7.721 -7.020 1.604 864 HG SER 147 HG SER 147 10.164 -8.452 1.598 865 H VAL 148 H VAL 148 11.049 -8.123 3.785 866 HA VAL 148 HA VAL 148 10.915 -11.009 4.111 867 HB VAL 148 HB VAL 148 13.442 -10.782 4.300 868 1HG1 VAL 148 1HG1 VAL 148 12.198 -11.455 2.251 869 2HG1 VAL 148 2HG1 VAL 148 13.727 -10.640 1.920 870 3HG1 VAL 148 3HG1 VAL 148 12.206 -9.765 1.745 871 1HG2 VAL 148 1HG2 VAL 148 14.489 -8.757 3.661 872 2HG2 VAL 148 2HG2 VAL 148 13.304 -8.327 4.894 873 3HG2 VAL 148 3HG2 VAL 148 12.954 -8.028 3.192 874 H ASN 149 H ASN 149 10.386 -8.551 6.160 875 HA ASN 149 HA ASN 149 11.953 -9.592 8.388 876 1HB ASN 149 2HB ASN 149 10.428 -7.094 7.856 877 2HB ASN 149 1HB ASN 149 10.541 -7.627 9.530 878 1HD2 ASN 149 1HD2 ASN 149 11.766 -5.762 9.990 879 2HD2 ASN 149 2HD2 ASN 149 13.438 -5.666 9.566 880 H VAL 150 H VAL 150 10.139 -11.437 7.477 881 HA VAL 150 HA VAL 150 7.899 -11.320 9.374 882 HB VAL 150 HB VAL 150 7.066 -13.331 8.053 883 1HG1 VAL 150 1HG1 VAL 150 5.885 -11.972 6.614 884 2HG1 VAL 150 2HG1 VAL 150 7.278 -10.947 6.269 885 3HG1 VAL 150 3HG1 VAL 150 6.443 -10.808 7.817 886 1HG2 VAL 150 1HG2 VAL 150 9.532 -13.383 6.974 887 2HG2 VAL 150 2HG2 VAL 150 8.677 -12.453 5.743 888 3HG2 VAL 150 3HG2 VAL 150 8.107 -14.062 6.187 Start of MODEL 8 1 1H GLY 38 1HT GLY 38 -19.282 -20.241 -9.877 2 2H GLY 38 2HT GLY 38 -19.645 -19.664 -8.329 3 3H GLY 38 3HT GLY 38 -20.871 -20.312 -9.299 4 1HA GLY 38 1HA GLY 38 -18.553 -21.826 -8.226 5 2HA GLY 38 2HA GLY 38 -20.178 -21.867 -7.562 6 H ALA 39 H ALA 39 -18.486 -22.330 -10.663 7 HA ALA 39 HA ALA 39 -20.418 -24.460 -11.295 8 1HB ALA 39 1HB ALA 39 -19.594 -24.143 -13.658 9 2HB ALA 39 2HB ALA 39 -18.738 -22.715 -13.080 10 3HB ALA 39 3HB ALA 39 -20.497 -22.792 -12.974 11 H MET 40 H MET 40 -16.971 -23.639 -11.351 12 HA MET 40 HA MET 40 -16.263 -26.401 -11.938 13 1HB MET 40 2HB MET 40 -14.888 -23.793 -12.007 14 2HB MET 40 1HB MET 40 -13.887 -25.148 -11.506 15 1HG MET 40 2HG MET 40 -14.245 -26.290 -13.539 16 2HG MET 40 1HG MET 40 -15.546 -25.197 -14.006 17 1HE MET 40 1HE MET 40 -13.783 -26.003 -15.906 18 2HE MET 40 2HE MET 40 -12.062 -25.748 -15.613 19 3HE MET 40 3HE MET 40 -12.949 -24.647 -16.667 20 H ASP 41 H ASP 41 -16.906 -27.469 -10.060 21 HA ASP 41 HA ASP 41 -16.621 -28.386 -8.002 22 1HB ASP 41 2HB ASP 41 -13.964 -27.200 -8.586 23 2HB ASP 41 1HB ASP 41 -14.283 -27.629 -6.908 24 HA PRO 42 HA PRO 42 -18.389 -25.420 -5.239 25 1HB PRO 42 2HB PRO 42 -17.218 -27.120 -3.094 26 2HB PRO 42 1HB PRO 42 -18.885 -26.582 -3.320 27 1HG PRO 42 2HG PRO 42 -18.189 -29.093 -3.857 28 2HG PRO 42 1HG PRO 42 -19.347 -28.229 -4.887 29 1HD PRO 42 2HD PRO 42 -16.463 -28.848 -5.378 30 2HD PRO 42 1HD PRO 42 -17.824 -28.825 -6.519 31 H GLU 43 H GLU 43 -17.790 -23.941 -3.490 32 HA GLU 43 HA GLU 43 -15.112 -22.954 -3.847 33 1HB GLU 43 2HB GLU 43 -17.593 -21.857 -3.100 34 2HB GLU 43 1HB GLU 43 -16.543 -21.649 -1.706 35 1HG GLU 43 2HG GLU 43 -15.210 -20.952 -4.181 36 2HG GLU 43 1HG GLU 43 -16.685 -20.019 -3.931 37 H PHE 44 H PHE 44 -16.809 -24.849 -1.488 38 HA PHE 44 HA PHE 44 -14.780 -24.492 0.552 39 1HB PHE 44 2HB PHE 44 -16.161 -26.110 1.843 40 2HB PHE 44 1HB PHE 44 -17.068 -24.704 1.294 41 HD1 PHE 44 1HD PHE 44 -16.504 -28.299 0.798 42 HD2 PHE 44 2HD PHE 44 -18.853 -24.917 -0.276 43 HE1 PHE 44 1HE PHE 44 -18.155 -29.787 -0.257 44 HE2 PHE 44 2HE PHE 44 -20.509 -26.399 -1.332 45 HZ PHE 44 HZ PHE 44 -20.162 -28.837 -1.323 46 H ALA 45 H ALA 45 -14.064 -25.726 -2.062 47 HA ALA 45 HA ALA 45 -13.637 -28.516 -1.579 48 1HB ALA 45 1HB ALA 45 -11.983 -27.163 -3.610 49 2HB ALA 45 2HB ALA 45 -13.729 -27.036 -3.825 50 3HB ALA 45 3HB ALA 45 -12.965 -28.623 -3.731 51 H LEU 46 H LEU 46 -11.455 -29.497 -1.603 52 HA LEU 46 HA LEU 46 -9.801 -28.245 0.395 53 1HB LEU 46 2HB LEU 46 -9.324 -30.810 -1.123 54 2HB LEU 46 1HB LEU 46 -8.519 -30.303 0.349 55 HG LEU 46 HG LEU 46 -11.023 -30.274 1.261 56 1HD1 LEU 46 1HD1 LEU 46 -11.897 -32.561 0.190 57 2HD1 LEU 46 2HD1 LEU 46 -11.099 -31.870 -1.223 58 3HD1 LEU 46 3HD1 LEU 46 -12.379 -30.973 -0.407 59 1HD2 LEU 46 1HD2 LEU 46 -9.011 -32.462 1.044 60 2HD2 LEU 46 2HD2 LEU 46 -10.581 -32.808 1.771 61 3HD2 LEU 46 3HD2 LEU 46 -9.545 -31.558 2.461 62 H SER 47 H SER 47 -7.354 -28.334 0.073 63 HA SER 47 HA SER 47 -5.500 -27.506 -0.953 64 1HB SER 47 2HB SER 47 -6.940 -28.664 -3.340 65 2HB SER 47 1HB SER 47 -5.351 -27.911 -3.471 66 HG SER 47 HG SER 47 -4.538 -29.700 -2.762 67 H ASN 48 H ASN 48 -5.669 -25.350 -0.526 68 HA ASN 48 HA ASN 48 -7.384 -23.643 -2.102 69 1HB ASN 48 2HB ASN 48 -6.474 -23.459 0.440 70 2HB ASN 48 1HB ASN 48 -5.309 -22.421 -0.378 71 1HD2 ASN 48 1HD2 ASN 48 -8.801 -23.028 -0.255 72 2HD2 ASN 48 2HD2 ASN 48 -9.265 -21.366 -0.341 73 H GLU 49 H GLU 49 -6.088 -21.399 -2.623 74 HA GLU 49 HA GLU 49 -3.525 -21.802 -3.840 75 1HB GLU 49 2HB GLU 49 -6.000 -21.993 -5.451 76 2HB GLU 49 1HB GLU 49 -4.724 -20.985 -6.120 77 1HG GLU 49 2HG GLU 49 -3.191 -23.000 -5.678 78 2HG GLU 49 1HG GLU 49 -4.690 -23.917 -5.532 79 H LYS 50 H LYS 50 -2.858 -20.000 -2.726 80 HA LYS 50 HA LYS 50 -3.680 -17.455 -3.854 81 1HB LYS 50 2HB LYS 50 -4.012 -16.433 -1.618 82 2HB LYS 50 1HB LYS 50 -5.221 -17.651 -2.004 83 1HG LYS 50 2HG LYS 50 -4.721 -18.798 -0.180 84 2HG LYS 50 1HG LYS 50 -3.023 -18.884 -0.649 85 1HD LYS 50 2HD LYS 50 -3.224 -16.305 0.208 86 2HD LYS 50 1HD LYS 50 -4.366 -17.122 1.277 87 1HE LYS 50 2HE LYS 50 -2.124 -18.786 1.182 88 2HE LYS 50 1HE LYS 50 -1.480 -17.149 1.299 89 1HZ LYS 50 1HZ LYS 50 -2.175 -18.536 3.416 90 2HZ LYS 50 2HZ LYS 50 -3.685 -17.851 3.080 91 3HZ LYS 50 3HZ LYS 50 -2.347 -16.854 3.356 92 H LYS 51 H LYS 51 -2.276 -15.656 -3.025 93 HA LYS 51 HA LYS 51 0.215 -16.381 -1.811 94 1HB LYS 51 2HB LYS 51 0.437 -17.054 -4.243 95 2HB LYS 51 1HB LYS 51 0.348 -15.340 -4.629 96 1HG LYS 51 2HG LYS 51 2.414 -14.890 -3.737 97 2HG LYS 51 1HG LYS 51 2.365 -16.278 -2.647 98 1HD LYS 51 2HD LYS 51 3.793 -17.161 -4.161 99 2HD LYS 51 1HD LYS 51 2.301 -17.545 -5.021 100 1HE LYS 51 2HE LYS 51 2.723 -15.043 -5.913 101 2HE LYS 51 1HE LYS 51 4.388 -15.548 -5.630 102 1HZ LYS 51 1HZ LYS 51 3.581 -16.018 -7.898 103 2HZ LYS 51 2HZ LYS 51 2.434 -17.081 -7.255 104 3HZ LYS 51 3HZ LYS 51 4.083 -17.409 -7.076 105 H ALA 52 H ALA 52 -2.010 -14.099 -2.897 106 HA ALA 52 HA ALA 52 -2.230 -11.834 -2.682 107 1HB ALA 52 1HB ALA 52 -1.310 -12.948 -0.161 108 2HB ALA 52 2HB ALA 52 -2.602 -11.792 -0.485 109 3HB ALA 52 3HB ALA 52 -0.938 -11.231 -0.322 110 H LYS 53 H LYS 53 -0.781 -9.807 -1.703 111 HA LYS 53 HA LYS 53 1.910 -9.956 -2.829 112 1HB LYS 53 2HB LYS 53 -0.258 -8.087 -3.774 113 2HB LYS 53 1HB LYS 53 1.449 -7.724 -3.995 114 1HG LYS 53 2HG LYS 53 1.614 -9.094 -5.737 115 2HG LYS 53 1HG LYS 53 0.777 -10.397 -4.894 116 1HD LYS 53 2HD LYS 53 -0.975 -8.192 -5.674 117 2HD LYS 53 1HD LYS 53 -0.201 -8.995 -7.041 118 1HE LYS 53 2HE LYS 53 -1.441 -10.655 -4.897 119 2HE LYS 53 1HE LYS 53 -2.487 -9.864 -6.074 120 1HZ LYS 53 1HZ LYS 53 -1.696 -11.136 -7.775 121 2HZ LYS 53 2HZ LYS 53 -1.536 -12.243 -6.507 122 3HZ LYS 53 3HZ LYS 53 -0.185 -11.389 -7.057 123 H LYS 54 H LYS 54 3.349 -8.813 -1.667 124 HA LYS 54 HA LYS 54 2.351 -7.256 0.575 125 1HB LYS 54 2HB LYS 54 4.900 -8.679 -0.045 126 2HB LYS 54 1HB LYS 54 4.955 -7.320 1.069 127 1HG LYS 54 2HG LYS 54 2.876 -9.367 1.552 128 2HG LYS 54 1HG LYS 54 4.552 -9.826 1.863 129 1HD LYS 54 2HD LYS 54 4.718 -8.477 3.662 130 2HD LYS 54 1HD LYS 54 3.765 -7.193 2.913 131 1HE LYS 54 2HE LYS 54 1.747 -8.132 3.578 132 2HE LYS 54 1HE LYS 54 2.454 -9.730 3.811 133 1HZ LYS 54 1HZ LYS 54 3.818 -8.372 5.614 134 2HZ LYS 54 2HZ LYS 54 2.329 -9.093 5.960 135 3HZ LYS 54 3HZ LYS 54 2.406 -7.440 5.611 136 H VAL 55 H VAL 55 2.324 -5.148 0.493 137 HA VAL 55 HA VAL 55 4.273 -3.754 -1.222 138 HB VAL 55 HB VAL 55 2.561 -2.056 -1.759 139 1HG1 VAL 55 1HG1 VAL 55 3.075 -4.272 -3.097 140 2HG1 VAL 55 2HG1 VAL 55 1.824 -3.135 -3.607 141 3HG1 VAL 55 3HG1 VAL 55 1.381 -4.596 -2.723 142 1HG2 VAL 55 1HG2 VAL 55 0.976 -2.198 -0.072 143 2HG2 VAL 55 2HG2 VAL 55 0.809 -3.946 -0.244 144 3HG2 VAL 55 3HG2 VAL 55 0.147 -2.876 -1.477 145 H ARG 56 H ARG 56 4.846 -1.676 -0.614 146 HA ARG 56 HA ARG 56 4.322 -1.033 2.205 147 1HB ARG 56 2HB ARG 56 6.739 -1.195 0.806 148 2HB ARG 56 1HB ARG 56 6.420 0.531 0.919 149 1HG ARG 56 2HG ARG 56 6.218 -1.209 3.341 150 2HG ARG 56 1HG ARG 56 7.784 -0.626 2.778 151 1HD ARG 56 2HD ARG 56 7.383 1.479 3.451 152 2HD ARG 56 1HD ARG 56 5.700 1.431 2.929 153 HE ARG 56 HE ARG 56 5.102 0.894 5.065 154 1HH1 ARG 56 1HH1 ARG 56 8.510 0.260 4.676 155 2HH1 ARG 56 2HH1 ARG 56 8.764 -0.094 6.351 156 1HH2 ARG 56 1HH2 ARG 56 5.433 0.429 7.270 157 2HH2 ARG 56 2HH2 ARG 56 7.017 0.001 7.825 158 H PHE 57 H PHE 57 2.615 0.308 2.272 159 HA PHE 57 HA PHE 57 2.188 2.166 0.089 160 1HB PHE 57 2HB PHE 57 0.521 1.296 2.429 161 2HB PHE 57 1HB PHE 57 0.058 2.672 1.435 162 HD1 PHE 57 1HD PHE 57 1.544 0.835 -0.963 163 HD2 PHE 57 2HD PHE 57 -1.808 0.545 1.654 164 HE1 PHE 57 1HE PHE 57 0.440 -0.661 -2.550 165 HE2 PHE 57 2HE PHE 57 -2.910 -0.971 0.060 166 HZ PHE 57 HZ PHE 57 -1.790 -1.572 -2.045 167 H TYR 58 H TYR 58 2.561 4.196 0.083 168 HA TYR 58 HA TYR 58 3.227 5.611 2.574 169 1HB TYR 58 2HB TYR 58 4.435 6.204 -0.113 170 2HB TYR 58 1HB TYR 58 4.919 6.844 1.442 171 HD1 TYR 58 1HD TYR 58 6.121 5.395 3.061 172 HD2 TYR 58 2HD TYR 58 5.240 4.084 -0.888 173 HE1 TYR 58 1HE TYR 58 7.781 3.597 3.293 174 HE2 TYR 58 2HE TYR 58 6.893 2.281 -0.666 175 HH TYR 58 HH TYR 58 9.058 2.094 2.056 176 H ARG 59 H ARG 59 2.560 7.744 2.715 177 HA ARG 59 HA ARG 59 0.396 8.436 0.866 178 1HB ARG 59 2HB ARG 59 -0.001 10.275 2.643 179 2HB ARG 59 1HB ARG 59 -0.399 8.614 3.061 180 1HG ARG 59 2HG ARG 59 1.358 8.417 4.528 181 2HG ARG 59 1HG ARG 59 2.304 9.676 3.732 182 1HD ARG 59 2HD ARG 59 1.204 11.373 4.804 183 2HD ARG 59 1HD ARG 59 -0.277 10.436 4.999 184 HE ARG 59 HE ARG 59 1.951 10.558 6.809 185 1HH1 ARG 59 1HH1 ARG 59 -0.764 8.641 5.746 186 2HH1 ARG 59 2HH1 ARG 59 -0.889 7.766 7.235 187 1HH2 ARG 59 1HH2 ARG 59 1.788 9.409 8.769 188 2HH2 ARG 59 2HH2 ARG 59 0.559 8.202 8.951 189 H ASN 60 H ASN 60 0.860 9.704 -0.755 190 HA ASN 60 HA ASN 60 3.209 10.916 -1.359 191 1HB ASN 60 2HB ASN 60 0.934 10.657 -2.678 192 2HB ASN 60 1HB ASN 60 0.726 12.334 -2.192 193 1HD2 ASN 60 1HD2 ASN 60 1.237 10.976 -4.812 194 2HD2 ASN 60 2HD2 ASN 60 2.586 11.819 -5.480 195 H GLY 61 H GLY 61 4.004 13.042 -1.382 196 1HA GLY 61 2HA GLY 61 4.653 14.965 -0.308 197 2HA GLY 61 1HA GLY 61 2.929 15.305 -0.242 198 H ASP 62 H ASP 62 5.486 13.513 1.440 199 HA ASP 62 HA ASP 62 4.406 14.434 3.983 200 1HB ASP 62 2HB ASP 62 3.427 12.136 3.395 201 2HB ASP 62 1HB ASP 62 5.057 11.510 3.629 202 H ARG 63 H ARG 63 6.876 12.335 2.510 203 HA ARG 63 HA ARG 63 9.087 12.019 3.001 204 1HB ARG 63 2HB ARG 63 9.113 14.996 3.453 205 2HB ARG 63 1HB ARG 63 10.407 13.983 2.828 206 1HG ARG 63 2HG ARG 63 9.623 14.043 0.744 207 2HG ARG 63 1HG ARG 63 7.941 13.911 1.252 208 1HD ARG 63 2HD ARG 63 7.727 16.062 0.721 209 2HD ARG 63 1HD ARG 63 8.720 16.421 2.134 210 HE ARG 63 HE ARG 63 10.571 15.960 0.247 211 1HH1 ARG 63 1HH1 ARG 63 7.714 17.968 0.259 212 2HH1 ARG 63 2HH1 ARG 63 8.374 19.128 -0.843 213 1HH2 ARG 63 1HH2 ARG 63 11.440 17.487 -1.200 214 2HH2 ARG 63 2HH2 ARG 63 10.488 18.857 -1.671 215 H TYR 64 H TYR 64 7.229 11.944 5.317 216 HA TYR 64 HA TYR 64 9.243 12.054 7.390 217 1HB TYR 64 2HB TYR 64 7.077 14.024 7.146 218 2HB TYR 64 1HB TYR 64 7.185 13.258 8.723 219 HD1 TYR 64 1HD TYR 64 9.021 15.286 6.248 220 HD2 TYR 64 2HD TYR 64 8.955 13.800 10.234 221 HE1 TYR 64 1HE TYR 64 10.856 16.811 6.839 222 HE2 TYR 64 2HE TYR 64 10.790 15.322 10.837 223 HH TYR 64 HH TYR 64 11.746 17.467 10.027 224 H PHE 65 H PHE 65 7.843 9.952 6.110 225 HA PHE 65 HA PHE 65 6.822 8.577 8.412 226 1HB PHE 65 2HB PHE 65 4.818 9.825 7.696 227 2HB PHE 65 1HB PHE 65 4.951 9.109 6.094 228 HD1 PHE 65 1HD PHE 65 5.274 7.593 9.483 229 HD2 PHE 65 2HD PHE 65 3.129 7.735 5.810 230 HE1 PHE 65 1HE PHE 65 3.894 5.693 10.219 231 HE2 PHE 65 2HE PHE 65 1.747 5.835 6.537 232 HZ PHE 65 HZ PHE 65 2.127 4.811 8.745 233 H LYS 66 H LYS 66 7.214 6.447 8.250 234 HA LYS 66 HA LYS 66 8.574 5.472 5.921 235 1HB LYS 66 2HB LYS 66 7.876 4.322 8.598 236 2HB LYS 66 1HB LYS 66 8.468 3.275 7.317 237 1HG LYS 66 2HG LYS 66 9.964 5.744 8.111 238 2HG LYS 66 1HG LYS 66 10.152 4.228 8.995 239 1HD LYS 66 2HD LYS 66 11.451 3.360 7.402 240 2HD LYS 66 1HD LYS 66 10.324 3.830 6.129 241 1HE LYS 66 2HE LYS 66 11.909 6.003 7.349 242 2HE LYS 66 1HE LYS 66 12.802 4.841 6.370 243 1HZ LYS 66 1HZ LYS 66 10.889 5.282 4.689 244 2HZ LYS 66 2HZ LYS 66 12.173 6.376 4.811 245 3HZ LYS 66 3HZ LYS 66 10.696 6.721 5.559 246 H GLY 67 H GLY 67 5.349 5.832 6.510 247 1HA GLY 67 2HA GLY 67 3.534 5.067 5.305 248 2HA GLY 67 1HA GLY 67 4.636 4.075 4.364 249 H ILE 68 H ILE 68 2.385 2.866 4.807 250 HA ILE 68 HA ILE 68 2.927 1.029 7.046 251 HB ILE 68 HB ILE 68 0.944 2.316 7.579 252 1HG1 ILE 68 2HG1 ILE 68 -0.332 -0.221 6.731 253 2HG1 ILE 68 1HG1 ILE 68 1.125 -0.372 7.708 254 1HG2 ILE 68 1HG2 ILE 68 -0.683 2.887 6.145 255 2HG2 ILE 68 2HG2 ILE 68 -0.735 1.281 5.412 256 3HG2 ILE 68 3HG2 ILE 68 0.488 2.443 4.901 257 1HD1 ILE 68 1HD1 ILE 68 -1.003 1.485 8.622 258 2HD1 ILE 68 2HD1 ILE 68 0.140 0.521 9.558 259 3HD1 ILE 68 3HD1 ILE 68 -1.255 -0.252 8.802 260 H VAL 69 H VAL 69 2.854 -1.126 6.621 261 HA VAL 69 HA VAL 69 2.821 -1.896 3.822 262 HB VAL 69 HB VAL 69 3.359 -3.637 6.230 263 1HG1 VAL 69 1HG1 VAL 69 3.882 -5.310 4.816 264 2HG1 VAL 69 2HG1 VAL 69 4.604 -4.222 3.631 265 3HG1 VAL 69 3HG1 VAL 69 2.853 -4.426 3.690 266 1HG2 VAL 69 1HG2 VAL 69 5.579 -2.660 4.536 267 2HG2 VAL 69 2HG2 VAL 69 5.535 -2.998 6.266 268 3HG2 VAL 69 3HG2 VAL 69 4.851 -1.497 5.643 269 H TYR 70 H TYR 70 1.273 -3.065 2.827 270 HA TYR 70 HA TYR 70 -0.816 -4.291 4.450 271 1HB TYR 70 2HB TYR 70 -1.118 -2.041 2.622 272 2HB TYR 70 1HB TYR 70 -2.158 -3.393 2.190 273 HD1 TYR 70 1HD TYR 70 -1.094 -1.750 5.388 274 HD2 TYR 70 2HD TYR 70 -4.291 -3.207 2.988 275 HE1 TYR 70 1HE TYR 70 -2.697 -1.101 7.138 276 HE2 TYR 70 2HE TYR 70 -5.901 -2.561 4.730 277 HH TYR 70 HH TYR 70 -5.960 -2.120 7.107 278 H ALA 71 H ALA 71 -1.880 -5.978 3.510 279 HA ALA 71 HA ALA 71 -0.450 -7.300 1.315 280 1HB ALA 71 1HB ALA 71 -0.726 -8.444 3.574 281 2HB ALA 71 2HB ALA 71 -1.224 -9.369 2.156 282 3HB ALA 71 3HB ALA 71 -2.438 -8.591 3.173 283 H VAL 72 H VAL 72 -1.616 -8.074 -0.494 284 HA VAL 72 HA VAL 72 -4.452 -7.369 -0.595 285 HB VAL 72 HB VAL 72 -2.831 -6.710 -3.004 286 1HG1 VAL 72 1HG1 VAL 72 -5.436 -5.962 -1.790 287 2HG1 VAL 72 2HG1 VAL 72 -5.039 -6.368 -3.460 288 3HG1 VAL 72 3HG1 VAL 72 -4.629 -4.777 -2.817 289 1HG2 VAL 72 1HG2 VAL 72 -1.496 -5.521 -1.500 290 2HG2 VAL 72 2HG2 VAL 72 -2.862 -5.109 -0.464 291 3HG2 VAL 72 3HG2 VAL 72 -2.680 -4.330 -2.036 292 H SER 73 H SER 73 -5.679 -8.726 -1.653 293 HA SER 73 HA SER 73 -4.681 -10.512 -3.686 294 1HB SER 73 2HB SER 73 -5.728 -12.495 -2.306 295 2HB SER 73 1HB SER 73 -4.068 -11.987 -1.998 296 HG SER 73 HG SER 73 -6.379 -11.244 -0.526 297 H SER 74 H SER 74 -6.679 -12.246 -4.000 298 HA SER 74 HA SER 74 -8.895 -10.528 -4.715 299 1HB SER 74 2HB SER 74 -8.047 -13.308 -5.392 300 2HB SER 74 1HB SER 74 -9.746 -12.882 -5.592 301 HG SER 74 HG SER 74 -7.499 -11.636 -6.792 302 H ASP 75 H ASP 75 -8.126 -12.771 -2.211 303 HA ASP 75 HA ASP 75 -10.861 -13.332 -1.512 304 1HB ASP 75 2HB ASP 75 -8.216 -14.298 -0.800 305 2HB ASP 75 1HB ASP 75 -9.241 -14.094 0.608 306 H ARG 76 H ARG 76 -8.445 -10.992 -0.669 307 HA ARG 76 HA ARG 76 -9.879 -10.188 1.741 308 1HB ARG 76 2HB ARG 76 -7.173 -9.973 0.793 309 2HB ARG 76 1HB ARG 76 -7.780 -8.376 1.204 310 1HG ARG 76 2HG ARG 76 -8.576 -10.096 3.284 311 2HG ARG 76 1HG ARG 76 -6.890 -10.473 2.927 312 1HD ARG 76 2HD ARG 76 -7.029 -7.688 2.885 313 2HD ARG 76 1HD ARG 76 -8.026 -8.171 4.256 314 HE ARG 76 HE ARG 76 -5.171 -8.384 4.026 315 1HH1 ARG 76 1HH1 ARG 76 -8.011 -9.660 5.601 316 2HH1 ARG 76 2HH1 ARG 76 -7.138 -10.252 6.974 317 1HH2 ARG 76 1HH2 ARG 76 -4.020 -9.161 5.831 318 2HH2 ARG 76 2HH2 ARG 76 -4.871 -9.968 7.105 319 H PHE 77 H PHE 77 -8.861 -8.754 -1.352 320 HA PHE 77 HA PHE 77 -11.080 -6.841 -1.095 321 1HB PHE 77 2HB PHE 77 -8.318 -6.240 -2.161 322 2HB PHE 77 1HB PHE 77 -9.670 -5.112 -2.122 323 HD1 PHE 77 1HD PHE 77 -10.610 -4.456 0.137 324 HD2 PHE 77 2HD PHE 77 -6.897 -6.480 -0.329 325 HE1 PHE 77 1HE PHE 77 -9.941 -3.740 2.394 326 HE2 PHE 77 2HE PHE 77 -6.221 -5.768 1.927 327 HZ PHE 77 HZ PHE 77 -7.744 -4.396 3.291 328 H ARG 78 H ARG 78 -12.470 -7.038 -2.691 329 HA ARG 78 HA ARG 78 -12.066 -8.702 -4.912 330 1HB ARG 78 2HB ARG 78 -14.177 -7.058 -3.765 331 2HB ARG 78 1HB ARG 78 -14.215 -7.074 -5.515 332 1HG ARG 78 2HG ARG 78 -14.794 -9.262 -5.625 333 2HG ARG 78 1HG ARG 78 -13.884 -9.677 -4.168 334 1HD ARG 78 2HD ARG 78 -15.805 -8.056 -3.149 335 2HD ARG 78 1HD ARG 78 -16.677 -8.822 -4.477 336 HE ARG 78 HE ARG 78 -16.776 -10.701 -3.201 337 1HH1 ARG 78 1HH1 ARG 78 -13.989 -8.861 -2.188 338 2HH1 ARG 78 2HH1 ARG 78 -13.562 -9.966 -0.926 339 1HH2 ARG 78 1HH2 ARG 78 -16.216 -12.155 -1.540 340 2HH2 ARG 78 2HH2 ARG 78 -14.825 -11.838 -0.558 341 H SER 79 H SER 79 -11.449 -5.325 -4.385 342 HA SER 79 HA SER 79 -10.166 -5.114 -6.942 343 1HB SER 79 2HB SER 79 -12.871 -3.938 -6.533 344 2HB SER 79 1HB SER 79 -11.690 -2.988 -7.436 345 HG SER 79 HG SER 79 -11.440 -4.776 -8.837 346 H PHE 80 H PHE 80 -9.592 -2.684 -7.357 347 HA PHE 80 HA PHE 80 -7.904 -1.854 -5.282 348 1HB PHE 80 2HB PHE 80 -8.194 -1.243 -7.941 349 2HB PHE 80 1HB PHE 80 -8.712 0.250 -7.172 350 HD1 PHE 80 1HD PHE 80 -7.046 1.827 -7.173 351 HD2 PHE 80 2HD PHE 80 -6.020 -2.244 -6.486 352 HE1 PHE 80 1HE PHE 80 -4.697 2.475 -6.878 353 HE2 PHE 80 2HE PHE 80 -3.670 -1.599 -6.181 354 HZ PHE 80 HZ PHE 80 -3.002 0.755 -6.377 355 H ASP 81 H ASP 81 -11.180 -0.913 -6.124 356 HA ASP 81 HA ASP 81 -11.363 1.415 -4.563 357 1HB ASP 81 2HB ASP 81 -13.011 0.575 -6.321 358 2HB ASP 81 1HB ASP 81 -13.643 -0.497 -5.074 359 H ALA 82 H ALA 82 -11.978 -1.976 -3.811 360 HA ALA 82 HA ALA 82 -12.925 -1.543 -1.173 361 1HB ALA 82 1HB ALA 82 -13.353 -3.713 -1.285 362 2HB ALA 82 2HB ALA 82 -11.645 -4.094 -1.500 363 3HB ALA 82 3HB ALA 82 -12.645 -3.707 -2.900 364 H LEU 83 H LEU 83 -9.748 -2.256 -2.543 365 HA LEU 83 HA LEU 83 -8.380 -2.568 -0.086 366 1HB LEU 83 2HB LEU 83 -7.478 -3.272 -2.282 367 2HB LEU 83 1HB LEU 83 -7.335 -1.593 -2.749 368 HG LEU 83 HG LEU 83 -5.760 -1.295 -0.792 369 1HD1 LEU 83 1HD1 LEU 83 -4.628 -3.421 -0.075 370 2HD1 LEU 83 2HD1 LEU 83 -5.979 -4.294 -0.797 371 3HD1 LEU 83 3HD1 LEU 83 -6.262 -3.186 0.546 372 1HD2 LEU 83 1HD2 LEU 83 -4.523 -1.267 -2.669 373 2HD2 LEU 83 2HD2 LEU 83 -5.275 -2.728 -3.314 374 3HD2 LEU 83 3HD2 LEU 83 -3.995 -2.854 -2.107 375 H LEU 84 H LEU 84 -8.829 0.134 -2.296 376 HA LEU 84 HA LEU 84 -7.431 2.072 -0.844 377 1HB LEU 84 2HB LEU 84 -9.642 2.166 -2.863 378 2HB LEU 84 1HB LEU 84 -9.123 3.642 -2.066 379 HG LEU 84 HG LEU 84 -7.285 1.822 -3.617 380 1HD1 LEU 84 1HD1 LEU 84 -7.412 4.058 -5.089 381 2HD1 LEU 84 2HD1 LEU 84 -9.060 4.019 -4.459 382 3HD1 LEU 84 3HD1 LEU 84 -8.431 2.647 -5.372 383 1HD2 LEU 84 1HD2 LEU 84 -5.961 4.065 -3.572 384 2HD2 LEU 84 2HD2 LEU 84 -5.921 2.990 -2.172 385 3HD2 LEU 84 3HD2 LEU 84 -6.967 4.410 -2.166 386 H ALA 85 H ALA 85 -10.682 0.776 -0.512 387 HA ALA 85 HA ALA 85 -11.741 2.791 1.169 388 1HB ALA 85 1HB ALA 85 -13.045 0.989 0.032 389 2HB ALA 85 2HB ALA 85 -13.435 1.197 1.740 390 3HB ALA 85 3HB ALA 85 -12.412 -0.145 1.225 391 H ASP 86 H ASP 86 -10.044 -0.235 1.873 392 HA ASP 86 HA ASP 86 -10.115 0.096 4.705 393 1HB ASP 86 2HB ASP 86 -9.306 -1.922 2.870 394 2HB ASP 86 1HB ASP 86 -7.924 -1.568 3.901 395 H LEU 87 H LEU 87 -7.917 0.940 2.129 396 HA LEU 87 HA LEU 87 -5.668 1.607 3.682 397 1HB LEU 87 2HB LEU 87 -6.636 2.548 0.988 398 2HB LEU 87 1HB LEU 87 -5.151 3.154 1.689 399 HG LEU 87 HG LEU 87 -5.760 0.433 0.612 400 1HD1 LEU 87 1HD1 LEU 87 -3.934 0.787 -0.732 401 2HD1 LEU 87 2HD1 LEU 87 -3.177 1.904 0.404 402 3HD1 LEU 87 3HD1 LEU 87 -4.559 2.427 -0.558 403 1HD2 LEU 87 1HD2 LEU 87 -4.975 -0.044 2.855 404 2HD2 LEU 87 2HD2 LEU 87 -3.608 1.049 2.637 405 3HD2 LEU 87 3HD2 LEU 87 -3.715 -0.430 1.686 406 H THR 88 H THR 88 -8.498 3.475 2.743 407 HA THR 88 HA THR 88 -7.630 5.988 3.626 408 HB THR 88 HB THR 88 -10.464 5.509 4.131 409 HG1 THR 88 1HG THR 88 -9.517 4.892 1.536 410 1HG2 THR 88 1HG2 THR 88 -10.664 7.119 2.177 411 2HG2 THR 88 2HG2 THR 88 -8.907 7.240 2.251 412 3HG2 THR 88 3HG2 THR 88 -9.883 7.711 3.642 413 H ARG 89 H ARG 89 -9.218 3.322 5.291 414 HA ARG 89 HA ARG 89 -9.524 4.642 7.778 415 1HB ARG 89 2HB ARG 89 -9.834 1.884 6.756 416 2HB ARG 89 1HB ARG 89 -9.550 2.043 8.484 417 1HG ARG 89 2HG ARG 89 -11.803 2.171 8.512 418 2HG ARG 89 1HG ARG 89 -11.462 3.878 8.220 419 1HD ARG 89 2HD ARG 89 -12.778 3.696 6.429 420 2HD ARG 89 1HD ARG 89 -11.465 2.781 5.687 421 HE ARG 89 HE ARG 89 -12.821 0.893 7.062 422 1HH1 ARG 89 1HH1 ARG 89 -13.808 3.322 4.759 423 2HH1 ARG 89 2HH1 ARG 89 -15.130 2.385 4.149 424 1HH2 ARG 89 1HH2 ARG 89 -14.558 -0.341 6.261 425 2HH2 ARG 89 2HH2 ARG 89 -15.555 0.304 4.999 426 H SER 90 H SER 90 -7.051 2.349 6.569 427 HA SER 90 HA SER 90 -5.623 2.374 9.055 428 1HB SER 90 2HB SER 90 -5.628 0.751 6.810 429 2HB SER 90 1HB SER 90 -4.052 1.543 6.744 430 HG SER 90 HG SER 90 -3.441 0.338 8.341 431 H LEU 91 H LEU 91 -5.231 4.034 5.962 432 HA LEU 91 HA LEU 91 -2.835 5.341 6.935 433 1HB LEU 91 2HB LEU 91 -4.014 4.723 4.345 434 2HB LEU 91 1HB LEU 91 -3.381 6.345 4.434 435 HG LEU 91 HG LEU 91 -1.915 3.743 4.692 436 1HD1 LEU 91 1HD1 LEU 91 -0.901 6.061 3.171 437 2HD1 LEU 91 2HD1 LEU 91 -2.345 5.262 2.550 438 3HD1 LEU 91 3HD1 LEU 91 -0.861 4.341 2.788 439 1HD2 LEU 91 1HD2 LEU 91 -1.123 6.411 5.785 440 2HD2 LEU 91 2HD2 LEU 91 0.098 5.288 5.189 441 3HD2 LEU 91 3HD2 LEU 91 -0.968 4.813 6.513 442 H SER 92 H SER 92 -6.058 5.877 7.243 443 HA SER 92 HA SER 92 -6.854 8.302 6.509 444 1HB SER 92 2HB SER 92 -8.224 8.437 8.416 445 2HB SER 92 1HB SER 92 -7.927 6.710 8.222 446 HG SER 92 HG SER 92 -6.438 6.793 9.870 447 H ASP 93 H ASP 93 -6.444 10.401 6.808 448 HA ASP 93 HA ASP 93 -4.661 11.329 8.889 449 1HB ASP 93 2HB ASP 93 -3.761 10.827 6.166 450 2HB ASP 93 1HB ASP 93 -3.500 12.498 6.632 451 H ASN 94 H ASN 94 -4.091 13.847 7.608 452 HA ASN 94 HA ASN 94 -6.560 15.022 6.744 453 1HB ASN 94 2HB ASN 94 -6.965 14.842 9.166 454 2HB ASN 94 1HB ASN 94 -5.499 15.766 9.475 455 1HD2 ASN 94 1HD2 ASN 94 -8.793 15.921 9.053 456 2HD2 ASN 94 2HD2 ASN 94 -8.952 17.622 8.793 457 H ILE 95 H ILE 95 -3.204 15.361 7.714 458 HA ILE 95 HA ILE 95 -3.043 17.988 6.460 459 HB ILE 95 HB ILE 95 -1.115 16.389 8.139 460 1HG1 ILE 95 2HG1 ILE 95 -2.838 17.570 9.382 461 2HG1 ILE 95 1HG1 ILE 95 -1.284 18.357 9.634 462 1HG2 ILE 95 1HG2 ILE 95 -0.608 18.959 6.660 463 2HG2 ILE 95 2HG2 ILE 95 0.219 17.418 6.446 464 3HG2 ILE 95 3HG2 ILE 95 0.425 18.327 7.943 465 1HD1 ILE 95 1HD1 ILE 95 -2.435 19.637 7.431 466 2HD1 ILE 95 2HD1 ILE 95 -2.237 20.266 9.067 467 3HD1 ILE 95 3HD1 ILE 95 -3.728 19.440 8.615 468 H ASN 96 H ASN 96 -1.997 14.662 6.107 469 HA ASN 96 HA ASN 96 -0.499 15.309 3.680 470 1HB ASN 96 2HB ASN 96 -0.683 12.876 5.436 471 2HB ASN 96 1HB ASN 96 -0.048 12.749 3.799 472 1HD2 ASN 96 1HD2 ASN 96 0.372 14.389 6.882 473 2HD2 ASN 96 2HD2 ASN 96 2.066 14.683 6.703 474 H LEU 97 H LEU 97 -3.165 13.245 4.783 475 HA LEU 97 HA LEU 97 -4.076 13.043 1.988 476 1HB LEU 97 2HB LEU 97 -4.230 11.135 4.290 477 2HB LEU 97 1HB LEU 97 -5.429 11.055 3.015 478 HG LEU 97 HG LEU 97 -2.587 11.059 2.166 479 1HD1 LEU 97 1HD1 LEU 97 -3.807 8.967 3.878 480 2HD1 LEU 97 2HD1 LEU 97 -2.126 9.484 3.740 481 3HD1 LEU 97 3HD1 LEU 97 -2.833 8.442 2.504 482 1HD2 LEU 97 1HD2 LEU 97 -4.948 10.753 0.886 483 2HD2 LEU 97 2HD2 LEU 97 -4.521 9.070 1.195 484 3HD2 LEU 97 3HD2 LEU 97 -3.412 10.111 0.302 485 HA PRO 98 HA PRO 98 -6.960 16.155 3.840 486 1HB PRO 98 2HB PRO 98 -7.811 15.672 1.002 487 2HB PRO 98 1HB PRO 98 -7.790 17.177 1.919 488 1HG PRO 98 2HG PRO 98 -5.844 16.621 0.198 489 2HG PRO 98 1HG PRO 98 -5.485 17.406 1.747 490 1HD PRO 98 2HD PRO 98 -4.931 14.633 0.865 491 2HD PRO 98 1HD PRO 98 -4.105 15.617 2.090 492 H GLN 99 H GLN 99 -8.336 13.993 1.378 493 HA GLN 99 HA GLN 99 -10.571 13.446 3.180 494 1HB GLN 99 2HB GLN 99 -10.306 12.631 0.286 495 2HB GLN 99 1HB GLN 99 -11.774 12.693 1.250 496 1HG GLN 99 2HG GLN 99 -11.860 15.016 1.197 497 2HG GLN 99 1HG GLN 99 -10.164 15.163 0.736 498 1HE2 GLN 99 1HE2 GLN 99 -9.735 13.851 -1.400 499 2HE2 GLN 99 2HE2 GLN 99 -10.821 14.229 -2.689 500 H GLY 100 H GLY 100 -7.841 11.860 1.705 501 1HA GLY 100 2HA GLY 100 -7.202 9.876 3.147 502 2HA GLY 100 1HA GLY 100 -8.799 9.280 2.718 503 H VAL 101 H VAL 101 -6.986 7.611 2.101 504 HA VAL 101 HA VAL 101 -5.607 7.959 -0.348 505 HB VAL 101 HB VAL 101 -6.496 5.342 0.870 506 1HG1 VAL 101 1HG1 VAL 101 -5.203 4.297 -0.626 507 2HG1 VAL 101 2HG1 VAL 101 -3.925 5.503 -0.510 508 3HG1 VAL 101 3HG1 VAL 101 -5.320 5.794 -1.548 509 1HG2 VAL 101 1HG2 VAL 101 -4.947 5.497 2.471 510 2HG2 VAL 101 2HG2 VAL 101 -4.940 7.227 2.124 511 3HG2 VAL 101 3HG2 VAL 101 -3.746 6.170 1.367 512 H ARG 102 H ARG 102 -6.757 8.527 -2.087 513 HA ARG 102 HA ARG 102 -9.205 7.062 -2.726 514 1HB ARG 102 2HB ARG 102 -8.273 9.775 -3.156 515 2HB ARG 102 1HB ARG 102 -8.865 9.046 -4.641 516 1HG ARG 102 2HG ARG 102 -10.510 8.758 -2.193 517 2HG ARG 102 1HG ARG 102 -10.464 10.329 -3.000 518 1HD ARG 102 2HD ARG 102 -12.249 8.536 -3.667 519 2HD ARG 102 1HD ARG 102 -11.487 9.545 -4.892 520 HE ARG 102 HE ARG 102 -9.909 7.533 -5.163 521 1HH1 ARG 102 1HH1 ARG 102 -13.297 7.270 -4.303 522 2HH1 ARG 102 2HH1 ARG 102 -13.464 5.686 -4.979 523 1HH2 ARG 102 1HH2 ARG 102 -10.148 5.460 -6.047 524 2HH2 ARG 102 2HH2 ARG 102 -11.682 4.660 -5.967 525 H TYR 103 H TYR 103 -5.997 7.787 -3.966 526 HA TYR 103 HA TYR 103 -6.361 5.603 -5.875 527 1HB TYR 103 2HB TYR 103 -4.922 8.082 -6.772 528 2HB TYR 103 1HB TYR 103 -5.547 6.752 -7.723 529 HD1 TYR 103 1HD TYR 103 -7.660 6.816 -8.677 530 HD2 TYR 103 2HD TYR 103 -6.601 9.699 -5.735 531 HE1 TYR 103 1HE TYR 103 -9.687 8.088 -9.211 532 HE2 TYR 103 2HE TYR 103 -8.636 10.981 -6.254 533 HH TYR 103 HH TYR 103 -10.198 11.254 -8.179 534 H ILE 104 H ILE 104 -4.333 4.804 -6.763 535 HA ILE 104 HA ILE 104 -2.076 5.219 -4.918 536 HB ILE 104 HB ILE 104 -2.873 2.624 -6.227 537 1HG1 ILE 104 2HG1 ILE 104 -3.349 3.740 -3.474 538 2HG1 ILE 104 1HG1 ILE 104 -4.504 2.995 -4.574 539 1HG2 ILE 104 1HG2 ILE 104 -0.433 3.024 -5.782 540 2HG2 ILE 104 2HG2 ILE 104 -1.129 1.599 -5.011 541 3HG2 ILE 104 3HG2 ILE 104 -0.837 3.060 -4.066 542 1HD1 ILE 104 1HD1 ILE 104 -3.181 0.841 -4.218 543 2HD1 ILE 104 2HD1 ILE 104 -4.184 1.418 -2.886 544 3HD1 ILE 104 3HD1 ILE 104 -2.438 1.675 -2.853 545 H TYR 105 H TYR 105 -0.306 5.931 -5.909 546 HA TYR 105 HA TYR 105 -0.069 5.582 -8.802 547 1HB TYR 105 2HB TYR 105 0.431 7.782 -6.981 548 2HB TYR 105 1HB TYR 105 1.808 7.468 -8.038 549 HD1 TYR 105 1HD TYR 105 -1.520 8.810 -7.821 550 HD2 TYR 105 2HD TYR 105 1.460 7.399 -10.494 551 HE1 TYR 105 1HE TYR 105 -2.674 9.910 -9.674 552 HE2 TYR 105 2HE TYR 105 0.330 8.491 -12.356 553 HH TYR 105 HH TYR 105 -1.417 10.698 -12.424 554 H THR 106 H THR 106 2.139 5.515 -9.689 555 HA THR 106 HA THR 106 3.581 3.353 -8.475 556 HB THR 106 HB THR 106 5.259 4.065 -10.400 557 HG1 THR 106 1HG THR 106 4.244 5.199 -12.017 558 1HG2 THR 106 1HG2 THR 106 4.073 2.009 -10.559 559 2HG2 THR 106 2HG2 THR 106 3.852 2.884 -12.074 560 3HG2 THR 106 3HG2 THR 106 2.555 2.848 -10.881 561 H ILE 107 H ILE 107 5.702 3.360 -7.665 562 HA ILE 107 HA ILE 107 6.384 5.278 -5.848 563 HB ILE 107 HB ILE 107 7.426 3.023 -6.026 564 1HG1 ILE 107 2HG1 ILE 107 9.793 3.896 -5.427 565 2HG1 ILE 107 1HG1 ILE 107 9.094 5.496 -5.655 566 1HG2 ILE 107 1HG2 ILE 107 9.439 2.782 -7.436 567 2HG2 ILE 107 2HG2 ILE 107 9.074 4.339 -8.179 568 3HG2 ILE 107 3HG2 ILE 107 7.962 2.985 -8.376 569 1HD1 ILE 107 1HD1 ILE 107 9.025 3.883 -3.360 570 2HD1 ILE 107 2HD1 ILE 107 7.376 3.949 -3.982 571 3HD1 ILE 107 3HD1 ILE 107 8.242 5.442 -3.618 572 H ASP 108 H ASP 108 6.914 5.380 -9.279 573 HA ASP 108 HA ASP 108 8.718 7.663 -9.051 574 1HB ASP 108 2HB ASP 108 7.944 5.787 -11.228 575 2HB ASP 108 1HB ASP 108 8.425 7.416 -11.697 576 H GLY 109 H GLY 109 5.425 6.871 -9.906 577 1HA GLY 109 2HA GLY 109 3.653 8.432 -9.754 578 2HA GLY 109 1HA GLY 109 4.813 9.732 -9.973 579 H SER 110 H SER 110 5.031 7.039 -12.121 580 HA SER 110 HA SER 110 4.593 8.681 -14.389 581 1HB SER 110 2HB SER 110 5.364 5.910 -13.864 582 2HB SER 110 1HB SER 110 4.358 6.076 -15.302 583 HG SER 110 HG SER 110 6.604 7.728 -14.827 584 H ARG 111 H ARG 111 2.697 6.019 -12.977 585 HA ARG 111 HA ARG 111 0.260 7.263 -13.929 586 1HB ARG 111 2HB ARG 111 -0.475 4.922 -14.733 587 2HB ARG 111 1HB ARG 111 0.578 5.867 -15.777 588 1HG ARG 111 2HG ARG 111 1.525 3.758 -15.851 589 2HG ARG 111 1HG ARG 111 2.500 4.585 -14.631 590 1HD ARG 111 2HD ARG 111 1.964 3.045 -13.129 591 2HD ARG 111 1HD ARG 111 0.252 3.398 -13.345 592 HE ARG 111 HE ARG 111 1.755 1.218 -14.527 593 1HH1 ARG 111 1HH1 ARG 111 -1.206 3.073 -14.539 594 2HH1 ARG 111 2HH1 ARG 111 -2.123 1.832 -15.323 595 1HH2 ARG 111 1HH2 ARG 111 0.546 -0.410 -15.559 596 2HH2 ARG 111 2HH2 ARG 111 -1.130 -0.143 -15.903 597 H LYS 112 H LYS 112 -1.636 6.284 -12.987 598 HA LYS 112 HA LYS 112 -1.094 5.288 -10.297 599 1HB LYS 112 2HB LYS 112 -2.728 6.654 -9.629 600 2HB LYS 112 1HB LYS 112 -2.873 7.232 -11.278 601 1HG LYS 112 2HG LYS 112 -4.496 5.326 -11.662 602 2HG LYS 112 1HG LYS 112 -4.476 5.088 -9.914 603 1HD LYS 112 2HD LYS 112 -6.370 6.492 -10.655 604 2HD LYS 112 1HD LYS 112 -5.281 7.343 -9.559 605 1HE LYS 112 2HE LYS 112 -4.362 8.633 -11.284 606 2HE LYS 112 1HE LYS 112 -4.981 7.555 -12.536 607 1HZ LYS 112 1HZ LYS 112 -6.136 9.855 -11.868 608 2HZ LYS 112 2HZ LYS 112 -6.982 8.808 -10.845 609 3HZ LYS 112 3HZ LYS 112 -6.987 8.543 -12.515 610 H ILE 113 H ILE 113 -1.916 3.384 -9.520 611 HA ILE 113 HA ILE 113 -2.527 1.381 -11.484 612 HB ILE 113 HB ILE 113 -2.479 1.140 -8.476 613 1HG1 ILE 113 2HG1 ILE 113 -0.352 1.955 -9.771 614 2HG1 ILE 113 1HG1 ILE 113 -0.209 0.706 -8.541 615 1HG2 ILE 113 1HG2 ILE 113 -3.427 -0.830 -9.003 616 2HG2 ILE 113 2HG2 ILE 113 -1.768 -1.283 -9.396 617 3HG2 ILE 113 3HG2 ILE 113 -2.871 -0.776 -10.675 618 1HD1 ILE 113 1HD1 ILE 113 0.834 0.544 -11.022 619 2HD1 ILE 113 2HD1 ILE 113 -0.705 -0.286 -11.252 620 3HD1 ILE 113 3HD1 ILE 113 0.425 -0.850 -10.021 621 H GLY 114 H GLY 114 -4.443 0.533 -11.982 622 1HA GLY 114 2HA GLY 114 -6.786 1.419 -10.418 623 2HA GLY 114 1HA GLY 114 -6.815 1.113 -12.150 624 H SER 115 H SER 115 -5.002 -1.297 -11.548 625 HA SER 115 HA SER 115 -7.130 -3.080 -10.569 626 1HB SER 115 2HB SER 115 -5.157 -4.225 -12.450 627 2HB SER 115 1HB SER 115 -6.898 -4.482 -12.346 628 HG SER 115 HG SER 115 -7.032 -2.253 -13.222 629 H MET 116 H MET 116 -6.537 -4.814 -9.316 630 HA MET 116 HA MET 116 -4.309 -4.484 -7.633 631 1HB MET 116 2HB MET 116 -6.654 -5.918 -7.550 632 2HB MET 116 1HB MET 116 -5.445 -7.185 -7.710 633 1HG MET 116 2HG MET 116 -5.728 -6.919 -5.415 634 2HG MET 116 1HG MET 116 -4.238 -6.051 -5.782 635 1HE MET 116 1HE MET 116 -7.164 -5.013 -3.162 636 2HE MET 116 2HE MET 116 -7.343 -6.328 -4.323 637 3HE MET 116 3HE MET 116 -8.267 -4.839 -4.526 638 H ASP 117 H ASP 117 -4.760 -6.219 -10.601 639 HA ASP 117 HA ASP 117 -2.741 -8.124 -10.398 640 1HB ASP 117 2HB ASP 117 -4.445 -6.985 -12.454 641 2HB ASP 117 1HB ASP 117 -2.857 -7.394 -13.071 642 H GLU 118 H GLU 118 -2.504 -4.715 -10.674 643 HA GLU 118 HA GLU 118 0.129 -4.792 -11.900 644 1HB GLU 118 2HB GLU 118 -1.629 -2.548 -10.927 645 2HB GLU 118 1HB GLU 118 0.016 -2.283 -11.487 646 1HG GLU 118 2HG GLU 118 -0.964 -1.953 -13.467 647 2HG GLU 118 1HG GLU 118 -0.980 -3.713 -13.546 648 H LEU 119 H LEU 119 -1.159 -4.990 -8.758 649 HA LEU 119 HA LEU 119 1.082 -3.763 -7.418 650 1HB LEU 119 2HB LEU 119 -0.811 -5.585 -6.014 651 2HB LEU 119 1HB LEU 119 -0.049 -4.114 -5.443 652 HG LEU 119 HG LEU 119 -2.354 -4.282 -7.381 653 1HD1 LEU 119 1HD1 LEU 119 -3.698 -3.430 -5.629 654 2HD1 LEU 119 2HD1 LEU 119 -2.298 -3.147 -4.597 655 3HD1 LEU 119 3HD1 LEU 119 -2.805 -4.795 -4.965 656 1HD2 LEU 119 1HD2 LEU 119 -2.332 -1.966 -7.550 657 2HD2 LEU 119 2HD2 LEU 119 -0.626 -2.393 -7.656 658 3HD2 LEU 119 3HD2 LEU 119 -1.286 -1.772 -6.145 659 H GLU 120 H GLU 120 2.996 -4.743 -7.370 660 HA GLU 120 HA GLU 120 3.098 -7.669 -7.261 661 1HB GLU 120 2HB GLU 120 5.454 -5.847 -7.665 662 2HB GLU 120 1HB GLU 120 5.291 -7.536 -8.097 663 1HG GLU 120 2HG GLU 120 3.916 -7.062 -9.929 664 2HG GLU 120 1HG GLU 120 3.617 -5.415 -9.378 665 H GLU 121 H GLU 121 4.408 -8.719 -5.708 666 HA GLU 121 HA GLU 121 4.217 -7.716 -3.108 667 1HB GLU 121 2HB GLU 121 5.961 -9.540 -2.588 668 2HB GLU 121 1HB GLU 121 4.396 -10.031 -3.225 669 1HG GLU 121 2HG GLU 121 6.190 -9.557 -5.392 670 2HG GLU 121 1HG GLU 121 6.951 -10.632 -4.222 671 H GLY 122 H GLY 122 6.006 -7.334 -1.579 672 1HA GLY 122 2HA GLY 122 7.653 -5.895 -0.902 673 2HA GLY 122 1HA GLY 122 8.607 -6.725 -2.111 674 H GLU 123 H GLU 123 5.800 -4.717 -2.808 675 HA GLU 123 HA GLU 123 7.539 -2.979 -4.404 676 1HB GLU 123 2HB GLU 123 4.619 -3.626 -4.469 677 2HB GLU 123 1HB GLU 123 5.195 -2.133 -5.197 678 1HG GLU 123 2HG GLU 123 6.431 -4.765 -5.902 679 2HG GLU 123 1HG GLU 123 4.944 -4.216 -6.674 680 H SER 124 H SER 124 6.697 -0.658 -4.596 681 HA SER 124 HA SER 124 5.936 0.407 -1.961 682 1HB SER 124 2HB SER 124 8.232 1.238 -3.727 683 2HB SER 124 1HB SER 124 7.511 2.369 -2.581 684 HG SER 124 HG SER 124 7.895 0.596 -0.996 685 H TYR 125 H TYR 125 4.077 1.497 -2.169 686 HA TYR 125 HA TYR 125 3.563 2.858 -4.726 687 1HB TYR 125 2HB TYR 125 1.714 1.356 -2.937 688 2HB TYR 125 1HB TYR 125 1.099 2.589 -4.016 689 HD1 TYR 125 1HD TYR 125 1.943 -0.837 -3.751 690 HD2 TYR 125 2HD TYR 125 1.850 2.415 -6.476 691 HE1 TYR 125 1HE TYR 125 1.972 -2.419 -5.631 692 HE2 TYR 125 2HE TYR 125 1.880 0.868 -8.355 693 HH TYR 125 HH TYR 125 1.055 -1.894 -8.493 694 H VAL 126 H VAL 126 2.192 4.669 -4.700 695 HA VAL 126 HA VAL 126 2.469 6.265 -2.223 696 HB VAL 126 HB VAL 126 2.810 7.043 -5.095 697 1HG1 VAL 126 1HG1 VAL 126 1.350 8.752 -4.739 698 2HG1 VAL 126 2HG1 VAL 126 2.779 9.477 -4.000 699 3HG1 VAL 126 3HG1 VAL 126 1.556 8.711 -2.988 700 1HG2 VAL 126 1HG2 VAL 126 4.547 6.627 -3.035 701 2HG2 VAL 126 2HG2 VAL 126 4.332 8.377 -2.982 702 3HG2 VAL 126 3HG2 VAL 126 4.888 7.601 -4.466 703 H CYS 127 H CYS 127 0.711 7.248 -1.391 704 HA CYS 127 HA CYS 127 -1.853 6.623 -2.642 705 1HB CYS 127 2HB CYS 127 -1.299 7.787 0.090 706 2HB CYS 127 1HB CYS 127 -2.841 7.168 -0.494 707 HG CYS 127 HG CYS 127 -1.695 4.767 -0.545 708 H SER 128 H SER 128 -3.150 8.078 -3.554 709 HA SER 128 HA SER 128 -2.611 10.940 -3.125 710 1HB SER 128 2HB SER 128 -3.131 9.625 -5.805 711 2HB SER 128 1HB SER 128 -2.984 11.363 -5.525 712 HG SER 128 HG SER 128 -0.911 11.124 -5.652 713 H SER 129 H SER 129 -4.436 12.331 -3.825 714 HA SER 129 HA SER 129 -7.026 11.053 -4.039 715 1HB SER 129 2HB SER 129 -6.623 11.099 -1.600 716 2HB SER 129 1HB SER 129 -6.396 12.844 -1.680 717 HG SER 129 HG SER 129 -8.758 11.620 -2.622 718 H ASP 130 H ASP 130 -5.366 14.140 -3.421 719 HA ASP 130 HA ASP 130 -6.733 15.310 -5.702 720 1HB ASP 130 2HB ASP 130 -7.618 15.777 -3.012 721 2HB ASP 130 1HB ASP 130 -6.978 17.276 -3.681 722 H ASN 131 H ASN 131 -3.965 14.642 -4.912 723 HA ASN 131 HA ASN 131 -2.793 17.344 -4.922 724 1HB ASN 131 2HB ASN 131 -0.673 16.112 -4.225 725 2HB ASN 131 1HB ASN 131 -1.966 16.184 -3.031 726 1HD2 ASN 131 1HD2 ASN 131 -2.210 14.367 -1.978 727 2HD2 ASN 131 2HD2 ASN 131 -1.985 12.775 -2.612 728 H PHE 132 H PHE 132 -0.836 17.638 -6.213 729 HA PHE 132 HA PHE 132 -1.137 16.372 -8.814 730 1HB PHE 132 2HB PHE 132 -0.930 18.834 -8.634 731 2HB PHE 132 1HB PHE 132 0.683 18.633 -7.958 732 HD1 PHE 132 1HD PHE 132 -1.255 17.487 -10.937 733 HD2 PHE 132 2HD PHE 132 2.437 18.931 -9.390 734 HE1 PHE 132 1HE PHE 132 -0.308 17.489 -13.209 735 HE2 PHE 132 2HE PHE 132 3.391 18.936 -11.659 736 HZ PHE 132 HZ PHE 132 2.017 18.216 -13.571 737 H PHE 133 H PHE 133 0.038 14.934 -6.482 738 HA PHE 133 HA PHE 133 1.667 13.412 -6.098 739 1HB PHE 133 2HB PHE 133 1.317 12.735 -8.427 740 2HB PHE 133 1HB PHE 133 2.444 13.975 -8.969 741 HD1 PHE 133 1HD PHE 133 2.080 10.645 -7.627 742 HD2 PHE 133 2HD PHE 133 4.853 13.781 -8.392 743 HE1 PHE 133 1HE PHE 133 3.941 9.055 -7.381 744 HE2 PHE 133 2HE PHE 133 6.719 12.196 -8.150 745 HZ PHE 133 HZ PHE 133 6.263 9.829 -7.644 746 H LYS 134 H LYS 134 3.905 13.226 -5.573 747 HA LYS 134 HA LYS 134 5.510 15.645 -5.930 748 1HB LYS 134 2HB LYS 134 4.891 14.328 -3.284 749 2HB LYS 134 1HB LYS 134 6.192 15.491 -3.513 750 1HG LYS 134 2HG LYS 134 3.893 16.668 -4.599 751 2HG LYS 134 1HG LYS 134 3.403 15.951 -3.063 752 1HD LYS 134 2HD LYS 134 4.213 17.816 -2.122 753 2HD LYS 134 1HD LYS 134 5.809 17.137 -2.449 754 1HE LYS 134 2HE LYS 134 4.398 18.708 -4.563 755 2HE LYS 134 1HE LYS 134 5.222 19.550 -3.251 756 1HZ LYS 134 1HZ LYS 134 6.468 17.595 -5.108 757 2HZ LYS 134 2HZ LYS 134 7.262 18.390 -3.844 758 3HZ LYS 134 3HZ LYS 134 6.668 19.274 -5.158 759 H LYS 135 H LYS 135 7.334 15.048 -6.825 760 HA LYS 135 HA LYS 135 8.255 12.328 -6.718 761 1HB LYS 135 2HB LYS 135 10.203 13.301 -8.061 762 2HB LYS 135 1HB LYS 135 8.606 13.365 -8.794 763 1HG LYS 135 2HG LYS 135 9.325 15.729 -7.213 764 2HG LYS 135 1HG LYS 135 10.323 15.453 -8.641 765 1HD LYS 135 2HD LYS 135 8.483 15.582 -10.090 766 2HD LYS 135 1HD LYS 135 7.324 15.356 -8.778 767 1HE LYS 135 2HE LYS 135 7.095 17.583 -8.856 768 2HE LYS 135 1HE LYS 135 8.632 17.619 -7.992 769 1HZ LYS 135 1HZ LYS 135 9.780 17.820 -10.104 770 2HZ LYS 135 2HZ LYS 135 8.656 19.072 -9.926 771 3HZ LYS 135 3HZ LYS 135 8.311 17.765 -10.942 772 H VAL 136 H VAL 136 8.744 11.968 -4.538 773 HA VAL 136 HA VAL 136 11.140 13.384 -3.568 774 HB VAL 136 HB VAL 136 10.115 12.187 -1.318 775 1HG1 VAL 136 1HG1 VAL 136 10.297 14.888 -2.425 776 2HG1 VAL 136 2HG1 VAL 136 10.813 14.253 -0.862 777 3HG1 VAL 136 3HG1 VAL 136 9.123 14.699 -1.119 778 1HG2 VAL 136 1HG2 VAL 136 7.783 13.321 -2.861 779 2HG2 VAL 136 2HG2 VAL 136 7.765 12.807 -1.172 780 3HG2 VAL 136 3HG2 VAL 136 8.023 11.622 -2.454 781 H GLU 137 H GLU 137 12.425 12.045 -1.973 782 HA GLU 137 HA GLU 137 13.061 9.557 -3.257 783 1HB GLU 137 2HB GLU 137 14.287 10.476 -0.673 784 2HB GLU 137 1HB GLU 137 15.016 9.530 -1.962 785 1HG GLU 137 2HG GLU 137 15.993 11.430 -2.574 786 2HG GLU 137 1HG GLU 137 14.420 11.871 -3.235 787 H TYR 138 H TYR 138 10.866 8.823 -2.788 788 HA TYR 138 HA TYR 138 9.865 8.114 -0.309 789 1HB TYR 138 2HB TYR 138 9.558 7.036 -3.082 790 2HB TYR 138 1HB TYR 138 8.706 6.278 -1.734 791 HD1 TYR 138 1HD TYR 138 8.086 8.247 -4.353 792 HD2 TYR 138 2HD TYR 138 7.762 8.445 -0.117 793 HE1 TYR 138 1HE TYR 138 6.306 9.929 -4.575 794 HE2 TYR 138 2HE TYR 138 5.979 10.127 -0.325 795 HH TYR 138 HH TYR 138 5.253 11.674 -3.301 796 H THR 139 H THR 139 12.248 6.473 -2.293 797 HA THR 139 HA THR 139 12.209 4.126 -0.572 798 HB THR 139 HB THR 139 13.484 3.026 -2.233 799 HG1 THR 139 1HG THR 139 14.418 4.194 -3.971 800 1HG2 THR 139 1HG2 THR 139 11.524 4.891 -3.540 801 2HG2 THR 139 2HG2 THR 139 11.266 3.221 -3.030 802 3HG2 THR 139 3HG2 THR 139 12.332 3.573 -4.390 803 H LYS 140 H LYS 140 13.888 7.052 -0.688 804 HA LYS 140 HA LYS 140 16.469 6.102 0.095 805 1HB LYS 140 2HB LYS 140 15.149 8.733 -0.166 806 2HB LYS 140 1HB LYS 140 16.470 8.648 0.988 807 1HG LYS 140 2HG LYS 140 17.746 7.505 -0.973 808 2HG LYS 140 1HG LYS 140 16.520 8.287 -1.971 809 1HD LYS 140 2HD LYS 140 17.293 10.386 -1.512 810 2HD LYS 140 1HD LYS 140 17.882 9.936 0.089 811 1HE LYS 140 2HE LYS 140 19.184 8.861 -2.385 812 2HE LYS 140 1HE LYS 140 19.592 10.466 -1.778 813 1HZ LYS 140 1HZ LYS 140 21.139 8.980 -0.842 814 2HZ LYS 140 2HZ LYS 140 19.945 7.863 -0.407 815 3HZ LYS 140 3HZ LYS 140 20.054 9.342 0.405 816 H ASN 141 H ASN 141 17.257 5.605 1.978 817 HA ASN 141 HA ASN 141 17.451 5.189 4.181 818 1HB ASN 141 2HB ASN 141 15.927 7.716 4.116 819 2HB ASN 141 1HB ASN 141 15.826 6.813 5.623 820 1HD2 ASN 141 1HD2 ASN 141 18.390 7.457 3.252 821 2HD2 ASN 141 2HD2 ASN 141 19.545 8.025 4.404 822 H VAL 142 H VAL 142 15.050 4.226 2.446 823 HA VAL 142 HA VAL 142 13.197 3.452 4.561 824 HB VAL 142 HB VAL 142 13.026 2.845 1.609 825 1HG1 VAL 142 1HG1 VAL 142 11.674 1.641 3.612 826 2HG1 VAL 142 2HG1 VAL 142 11.021 1.884 1.992 827 3HG1 VAL 142 3HG1 VAL 142 10.609 3.009 3.285 828 1HG2 VAL 142 1HG2 VAL 142 11.124 4.793 2.447 829 2HG2 VAL 142 2HG2 VAL 142 12.402 4.945 1.242 830 3HG2 VAL 142 3HG2 VAL 142 12.732 5.334 2.930 831 H ASN 143 H ASN 143 13.465 1.606 5.618 832 HA ASN 143 HA ASN 143 15.333 -0.379 4.725 833 1HB ASN 143 2HB ASN 143 14.280 0.368 7.183 834 2HB ASN 143 1HB ASN 143 13.558 -1.210 6.889 835 1HD2 ASN 143 1HD2 ASN 143 14.766 -2.041 8.629 836 2HD2 ASN 143 2HD2 ASN 143 16.445 -2.413 8.456 837 HA PRO 144 HA PRO 144 12.149 -2.615 2.494 838 1HB PRO 144 2HB PRO 144 13.734 -4.341 1.221 839 2HB PRO 144 1HB PRO 144 13.738 -2.623 0.808 840 1HG PRO 144 2HG PRO 144 15.683 -4.181 2.456 841 2HG PRO 144 1HG PRO 144 15.992 -2.903 1.268 842 1HD PRO 144 2HD PRO 144 15.921 -2.537 4.020 843 2HD PRO 144 1HD PRO 144 15.709 -1.250 2.817 844 H ASN 145 H ASN 145 12.844 -3.337 5.326 845 HA ASN 145 HA ASN 145 12.884 -6.244 5.265 846 1HB ASN 145 2HB ASN 145 12.763 -4.364 7.631 847 2HB ASN 145 1HB ASN 145 13.038 -6.103 7.700 848 1HD2 ASN 145 1HD2 ASN 145 15.029 -5.955 8.654 849 2HD2 ASN 145 2HD2 ASN 145 16.423 -5.339 7.839 850 H TRP 146 H TRP 146 10.510 -4.179 4.660 851 HA TRP 146 HA TRP 146 8.493 -5.045 6.491 852 1HB TRP 146 2HB TRP 146 6.984 -4.083 4.507 853 2HB TRP 146 1HB TRP 146 7.792 -3.045 5.672 854 HD1 TRP 146 HD TRP 146 10.088 -1.822 4.793 855 HE1 TRP 146 1HE TRP 146 10.722 -1.029 2.428 856 HE3 TRP 146 3HE TRP 146 6.745 -4.587 2.077 857 HZ2 TRP 146 2HZ TRP 146 9.907 -1.503 -0.232 858 HZ3 TRP 146 3HZ TRP 146 6.730 -4.345 -0.363 859 HH2 TRP 146 HH TRP 146 8.279 -2.841 -1.496 860 H SER 147 H SER 147 9.825 -6.332 3.602 861 HA SER 147 HA SER 147 7.536 -7.978 2.979 862 1HB SER 147 2HB SER 147 9.550 -7.048 1.445 863 2HB SER 147 1HB SER 147 10.185 -8.649 1.827 864 HG SER 147 HG SER 147 8.403 -8.049 0.009 865 H VAL 148 H VAL 148 9.697 -8.104 5.425 866 HA VAL 148 HA VAL 148 10.190 -10.969 5.366 867 HB VAL 148 HB VAL 148 10.902 -9.011 7.550 868 1HG1 VAL 148 1HG1 VAL 148 12.719 -10.790 7.903 869 2HG1 VAL 148 2HG1 VAL 148 11.692 -11.836 6.922 870 3HG1 VAL 148 3HG1 VAL 148 11.078 -11.166 8.434 871 1HG2 VAL 148 1HG2 VAL 148 12.685 -9.951 5.310 872 2HG2 VAL 148 2HG2 VAL 148 13.050 -8.746 6.545 873 3HG2 VAL 148 3HG2 VAL 148 11.842 -8.402 5.306 874 H ASN 149 H ASN 149 7.615 -9.099 6.219 875 HA ASN 149 HA ASN 149 6.920 -10.590 8.625 876 1HB ASN 149 2HB ASN 149 5.923 -8.122 7.297 877 2HB ASN 149 1HB ASN 149 4.759 -9.055 8.232 878 1HD2 ASN 149 1HD2 ASN 149 4.487 -7.952 10.045 879 2HD2 ASN 149 2HD2 ASN 149 5.750 -7.419 11.096 880 H VAL 150 H VAL 150 7.089 -12.366 6.673 881 HA VAL 150 HA VAL 150 4.289 -13.059 6.147 882 HB VAL 150 HB VAL 150 5.050 -14.026 3.922 883 1HG1 VAL 150 1HG1 VAL 150 3.903 -11.680 4.520 884 2HG1 VAL 150 2HG1 VAL 150 4.257 -12.187 2.869 885 3HG1 VAL 150 3HG1 VAL 150 5.356 -11.095 3.711 886 1HG2 VAL 150 1HG2 VAL 150 7.397 -14.009 4.088 887 2HG2 VAL 150 2HG2 VAL 150 7.431 -12.318 4.589 888 3HG2 VAL 150 3HG2 VAL 150 7.007 -12.737 2.930 Start of MODEL 9 1 1H GLY 38 1HT GLY 38 -10.597 -36.368 -15.188 2 2H GLY 38 2HT GLY 38 -12.090 -36.712 -14.470 3 3H GLY 38 3HT GLY 38 -11.561 -37.621 -15.794 4 1HA GLY 38 1HA GLY 38 -11.347 -38.617 -13.444 5 2HA GLY 38 2HA GLY 38 -10.026 -38.803 -14.588 6 H ALA 39 H ALA 39 -9.019 -39.167 -12.340 7 HA ALA 39 HA ALA 39 -8.534 -37.020 -10.603 8 1HB ALA 39 1HB ALA 39 -6.333 -38.543 -10.244 9 2HB ALA 39 2HB ALA 39 -7.401 -39.701 -11.037 10 3HB ALA 39 3HB ALA 39 -7.911 -38.909 -9.546 11 H MET 40 H MET 40 -7.963 -35.160 -11.701 12 HA MET 40 HA MET 40 -5.617 -35.192 -13.426 13 1HB MET 40 2HB MET 40 -7.824 -33.284 -12.870 14 2HB MET 40 1HB MET 40 -6.280 -32.594 -13.348 15 1HG MET 40 2HG MET 40 -6.358 -33.519 -15.449 16 2HG MET 40 1HG MET 40 -7.448 -34.813 -14.954 17 1HE MET 40 1HE MET 40 -7.994 -30.586 -14.868 18 2HE MET 40 2HE MET 40 -8.312 -30.745 -16.596 19 3HE MET 40 3HE MET 40 -6.802 -31.354 -15.917 20 H ASP 41 H ASP 41 -4.034 -35.692 -11.840 21 HA ASP 41 HA ASP 41 -2.394 -35.206 -10.342 22 1HB ASP 41 2HB ASP 41 -3.046 -32.649 -11.636 23 2HB ASP 41 1HB ASP 41 -2.265 -32.479 -10.067 24 HA PRO 42 HA PRO 42 -5.488 -34.386 -6.980 25 1HB PRO 42 2HB PRO 42 -5.011 -37.061 -6.014 26 2HB PRO 42 1HB PRO 42 -6.497 -36.385 -6.679 27 1HG PRO 42 2HG PRO 42 -5.001 -38.325 -7.915 28 2HG PRO 42 1HG PRO 42 -6.083 -37.209 -8.766 29 1HD PRO 42 2HD PRO 42 -3.106 -37.093 -8.448 30 2HD PRO 42 1HD PRO 42 -4.105 -36.716 -9.871 31 H GLU 43 H GLU 43 -2.872 -33.462 -6.933 32 HA GLU 43 HA GLU 43 -1.451 -34.625 -4.715 33 1HB GLU 43 2HB GLU 43 -0.975 -32.022 -6.180 34 2HB GLU 43 1HB GLU 43 0.133 -32.777 -5.041 35 1HG GLU 43 2HG GLU 43 -0.294 -34.784 -6.841 36 2HG GLU 43 1HG GLU 43 -0.346 -33.348 -7.862 37 H PHE 44 H PHE 44 -3.678 -34.273 -3.524 38 HA PHE 44 HA PHE 44 -4.775 -33.291 -1.790 39 1HB PHE 44 2HB PHE 44 -1.975 -32.367 -1.505 40 2HB PHE 44 1HB PHE 44 -3.182 -31.453 -0.606 41 HD1 PHE 44 1HD PHE 44 -4.962 -33.065 0.623 42 HD2 PHE 44 2HD PHE 44 -0.953 -34.076 -0.384 43 HE1 PHE 44 1HE PHE 44 -4.958 -34.786 2.383 44 HE2 PHE 44 2HE PHE 44 -0.942 -35.798 1.372 45 HZ PHE 44 HZ PHE 44 -2.946 -36.155 2.758 46 H ALA 45 H ALA 45 -6.438 -32.087 -2.451 47 HA ALA 45 HA ALA 45 -6.109 -29.715 -4.022 48 1HB ALA 45 1HB ALA 45 -8.467 -31.119 -2.820 49 2HB ALA 45 2HB ALA 45 -8.053 -30.893 -4.519 50 3HB ALA 45 3HB ALA 45 -8.637 -29.529 -3.566 51 H LEU 46 H LEU 46 -6.032 -27.645 -3.390 52 HA LEU 46 HA LEU 46 -5.952 -25.799 -2.069 53 1HB LEU 46 2HB LEU 46 -8.278 -27.156 -1.315 54 2HB LEU 46 1HB LEU 46 -7.486 -26.750 0.197 55 HG LEU 46 HG LEU 46 -9.074 -25.022 -0.413 56 1HD1 LEU 46 1HD1 LEU 46 -7.419 -23.074 -0.592 57 2HD1 LEU 46 2HD1 LEU 46 -6.164 -24.312 -0.543 58 3HD1 LEU 46 3HD1 LEU 46 -7.288 -24.143 0.805 59 1HD2 LEU 46 1HD2 LEU 46 -7.519 -24.967 -2.983 60 2HD2 LEU 46 2HD2 LEU 46 -8.509 -23.606 -2.454 61 3HD2 LEU 46 3HD2 LEU 46 -9.254 -25.177 -2.749 62 H SER 47 H SER 47 -3.897 -25.658 -1.379 63 HA SER 47 HA SER 47 -3.308 -26.414 1.331 64 1HB SER 47 2HB SER 47 -2.746 -28.357 -0.500 65 2HB SER 47 1HB SER 47 -1.223 -27.468 -0.471 66 HG SER 47 HG SER 47 -1.440 -27.671 1.913 67 H ASN 48 H ASN 48 -3.476 -23.985 -0.202 68 HA ASN 48 HA ASN 48 -0.960 -22.821 0.572 69 1HB ASN 48 2HB ASN 48 -0.427 -21.873 -1.631 70 2HB ASN 48 1HB ASN 48 -0.399 -23.633 -1.674 71 1HD2 ASN 48 1HD2 ASN 48 -1.276 -21.037 -3.378 72 2HD2 ASN 48 2HD2 ASN 48 -2.588 -21.689 -4.293 73 H GLU 49 H GLU 49 -4.029 -22.379 -1.142 74 HA GLU 49 HA GLU 49 -5.672 -20.818 -0.869 75 1HB GLU 49 2HB GLU 49 -4.314 -20.686 1.569 76 2HB GLU 49 1HB GLU 49 -4.392 -19.018 1.018 77 1HG GLU 49 2HG GLU 49 -6.670 -18.930 1.154 78 2HG GLU 49 1HG GLU 49 -6.863 -20.665 0.906 79 H LYS 50 H LYS 50 -5.657 -18.124 -0.625 80 HA LYS 50 HA LYS 50 -4.203 -17.335 -3.016 81 1HB LYS 50 2HB LYS 50 -6.225 -15.802 -1.371 82 2HB LYS 50 1HB LYS 50 -5.579 -15.305 -2.928 83 1HG LYS 50 2HG LYS 50 -6.577 -17.866 -3.362 84 2HG LYS 50 1HG LYS 50 -7.767 -17.081 -2.321 85 1HD LYS 50 2HD LYS 50 -8.574 -16.228 -4.234 86 2HD LYS 50 1HD LYS 50 -7.216 -15.107 -4.121 87 1HE LYS 50 2HE LYS 50 -7.396 -17.649 -5.722 88 2HE LYS 50 1HE LYS 50 -7.196 -16.003 -6.322 89 1HZ LYS 50 1HZ LYS 50 -5.067 -16.299 -4.692 90 2HZ LYS 50 2HZ LYS 50 -5.038 -16.524 -6.368 91 3HZ LYS 50 3HZ LYS 50 -5.219 -17.854 -5.340 92 H LYS 51 H LYS 51 -2.168 -16.698 -2.726 93 HA LYS 51 HA LYS 51 -1.296 -15.463 -0.272 94 1HB LYS 51 2HB LYS 51 0.005 -16.432 -2.766 95 2HB LYS 51 1HB LYS 51 0.851 -15.201 -1.839 96 1HG LYS 51 2HG LYS 51 -0.188 -17.549 -0.362 97 2HG LYS 51 1HG LYS 51 1.206 -17.790 -1.417 98 1HD LYS 51 2HD LYS 51 1.668 -15.414 0.045 99 2HD LYS 51 1HD LYS 51 1.103 -16.628 1.193 100 1HE LYS 51 2HE LYS 51 3.325 -17.117 1.218 101 2HE LYS 51 1HE LYS 51 2.831 -18.141 -0.129 102 1HZ LYS 51 1HZ LYS 51 4.464 -15.743 -0.126 103 2HZ LYS 51 2HZ LYS 51 3.352 -15.857 -1.396 104 3HZ LYS 51 3HZ LYS 51 4.499 -17.078 -1.166 105 H ALA 52 H ALA 52 -1.443 -13.375 0.151 106 HA ALA 52 HA ALA 52 -2.105 -11.482 -1.924 107 1HB ALA 52 1HB ALA 52 -1.549 -10.905 0.979 108 2HB ALA 52 2HB ALA 52 -3.110 -11.457 0.372 109 3HB ALA 52 3HB ALA 52 -2.450 -9.911 -0.165 110 H LYS 53 H LYS 53 -0.947 -9.401 -2.108 111 HA LYS 53 HA LYS 53 1.938 -9.874 -2.167 112 1HB LYS 53 2HB LYS 53 0.262 -7.700 -3.438 113 2HB LYS 53 1HB LYS 53 2.001 -7.874 -3.629 114 1HG LYS 53 2HG LYS 53 1.759 -9.378 -5.242 115 2HG LYS 53 1HG LYS 53 0.624 -10.327 -4.281 116 1HD LYS 53 2HD LYS 53 -0.511 -7.834 -5.297 117 2HD LYS 53 1HD LYS 53 0.017 -8.935 -6.571 118 1HE LYS 53 2HE LYS 53 -1.567 -10.037 -4.305 119 2HE LYS 53 1HE LYS 53 -2.404 -9.083 -5.529 120 1HZ LYS 53 1HZ LYS 53 -2.143 -10.677 -7.075 121 2HZ LYS 53 2HZ LYS 53 -1.987 -11.698 -5.736 122 3HZ LYS 53 3HZ LYS 53 -0.606 -11.131 -6.531 123 H LYS 54 H LYS 54 3.390 -8.671 -1.028 124 HA LYS 54 HA LYS 54 2.313 -6.985 1.067 125 1HB LYS 54 2HB LYS 54 4.364 -8.867 1.001 126 2HB LYS 54 1HB LYS 54 5.202 -7.322 1.076 127 1HG LYS 54 2HG LYS 54 4.845 -8.196 3.298 128 2HG LYS 54 1HG LYS 54 3.904 -6.722 3.064 129 1HD LYS 54 2HD LYS 54 2.184 -7.916 3.866 130 2HD LYS 54 1HD LYS 54 2.145 -8.663 2.268 131 1HE LYS 54 2HE LYS 54 2.138 -10.408 3.903 132 2HE LYS 54 1HE LYS 54 3.718 -10.399 3.121 133 1HZ LYS 54 1HZ LYS 54 4.605 -9.185 5.015 134 2HZ LYS 54 2HZ LYS 54 3.920 -10.649 5.512 135 3HZ LYS 54 3HZ LYS 54 3.087 -9.199 5.764 136 H VAL 55 H VAL 55 2.301 -4.908 0.908 137 HA VAL 55 HA VAL 55 4.311 -3.554 -0.766 138 HB VAL 55 HB VAL 55 2.594 -1.870 -1.379 139 1HG1 VAL 55 1HG1 VAL 55 1.844 -2.991 -3.217 140 2HG1 VAL 55 2HG1 VAL 55 1.539 -4.484 -2.327 141 3HG1 VAL 55 3HG1 VAL 55 3.192 -4.016 -2.725 142 1HG2 VAL 55 1HG2 VAL 55 0.180 -2.756 -1.161 143 2HG2 VAL 55 2HG2 VAL 55 0.948 -1.995 0.237 144 3HG2 VAL 55 3HG2 VAL 55 0.839 -3.753 0.134 145 H ARG 56 H ARG 56 4.837 -1.445 -0.163 146 HA ARG 56 HA ARG 56 4.172 -0.762 2.614 147 1HB ARG 56 2HB ARG 56 6.667 -0.860 1.249 148 2HB ARG 56 1HB ARG 56 6.319 0.835 1.566 149 1HG ARG 56 2HG ARG 56 5.720 -0.222 3.965 150 2HG ARG 56 1HG ARG 56 6.965 -1.349 3.430 151 1HD ARG 56 2HD ARG 56 8.460 0.563 2.985 152 2HD ARG 56 1HD ARG 56 7.219 1.651 3.607 153 HE ARG 56 HE ARG 56 9.047 0.099 5.135 154 1HH1 ARG 56 1HH1 ARG 56 5.793 1.365 5.144 155 2HH1 ARG 56 2HH1 ARG 56 5.674 1.385 6.871 156 1HH2 ARG 56 1HH2 ARG 56 8.889 0.127 7.407 157 2HH2 ARG 56 2HH2 ARG 56 7.431 0.686 8.155 158 H PHE 57 H PHE 57 2.473 0.585 2.565 159 HA PHE 57 HA PHE 57 2.119 2.354 0.307 160 1HB PHE 57 2HB PHE 57 0.424 1.720 2.715 161 2HB PHE 57 1HB PHE 57 -0.012 2.971 1.559 162 HD1 PHE 57 1HD PHE 57 -1.747 0.675 2.196 163 HD2 PHE 57 2HD PHE 57 1.294 1.073 -0.764 164 HE1 PHE 57 1HE PHE 57 -2.875 -1.006 0.803 165 HE2 PHE 57 2HE PHE 57 0.160 -0.594 -2.155 166 HZ PHE 57 HZ PHE 57 -1.925 -1.640 -1.374 167 H TYR 58 H TYR 58 2.553 4.371 0.198 168 HA TYR 58 HA TYR 58 3.290 5.881 2.613 169 1HB TYR 58 2HB TYR 58 4.338 6.340 -0.170 170 2HB TYR 58 1HB TYR 58 4.851 7.149 1.292 171 HD1 TYR 58 1HD TYR 58 4.957 3.950 -0.547 172 HD2 TYR 58 2HD TYR 58 6.455 6.166 2.762 173 HE1 TYR 58 1HE TYR 58 6.716 2.265 -0.223 174 HE2 TYR 58 2HE TYR 58 8.220 4.486 3.094 175 HH TYR 58 HH TYR 58 9.418 2.764 1.648 176 H ARG 59 H ARG 59 2.625 8.012 2.726 177 HA ARG 59 HA ARG 59 0.313 8.624 1.039 178 1HB ARG 59 2HB ARG 59 1.198 10.182 3.462 179 2HB ARG 59 1HB ARG 59 -0.400 10.120 2.733 180 1HG ARG 59 2HG ARG 59 -0.993 8.434 4.042 181 2HG ARG 59 1HG ARG 59 0.409 7.488 3.541 182 1HD ARG 59 2HD ARG 59 0.320 7.892 5.983 183 2HD ARG 59 1HD ARG 59 1.778 8.528 5.221 184 HE ARG 59 HE ARG 59 0.109 10.655 5.229 185 1HH1 ARG 59 1HH1 ARG 59 1.172 8.446 7.712 186 2HH1 ARG 59 2HH1 ARG 59 1.048 9.617 8.982 187 1HH2 ARG 59 1HH2 ARG 59 -0.054 12.197 6.897 188 2HH2 ARG 59 2HH2 ARG 59 0.352 11.746 8.519 189 H ASN 60 H ASN 60 0.617 9.854 -0.658 190 HA ASN 60 HA ASN 60 2.873 11.095 -1.501 191 1HB ASN 60 2HB ASN 60 1.012 10.813 -2.979 192 2HB ASN 60 1HB ASN 60 0.002 11.868 -2.003 193 1HD2 ASN 60 1HD2 ASN 60 -0.359 12.961 -4.035 194 2HD2 ASN 60 2HD2 ASN 60 0.777 14.144 -4.570 195 H GLY 61 H GLY 61 3.917 12.986 -1.252 196 1HA GLY 61 2HA GLY 61 4.591 14.939 -0.255 197 2HA GLY 61 1HA GLY 61 2.887 15.369 -0.229 198 H ASP 62 H ASP 62 5.284 13.409 1.520 199 HA ASP 62 HA ASP 62 4.176 14.408 4.030 200 1HB ASP 62 2HB ASP 62 3.096 12.175 3.419 201 2HB ASP 62 1HB ASP 62 4.682 11.455 3.675 202 H ARG 63 H ARG 63 6.648 12.359 2.515 203 HA ARG 63 HA ARG 63 8.776 11.818 3.214 204 1HB ARG 63 2HB ARG 63 10.258 13.758 3.120 205 2HB ARG 63 1HB ARG 63 9.060 13.799 1.835 206 1HG ARG 63 2HG ARG 63 7.736 15.306 3.493 207 2HG ARG 63 1HG ARG 63 9.316 15.536 4.243 208 1HD ARG 63 2HD ARG 63 9.208 15.802 1.309 209 2HD ARG 63 1HD ARG 63 8.378 17.055 2.231 210 HE ARG 63 HE ARG 63 10.970 16.615 3.276 211 1HH1 ARG 63 1HH1 ARG 63 9.323 18.070 0.565 212 2HH1 ARG 63 2HH1 ARG 63 10.572 19.233 0.270 213 1HH2 ARG 63 1HH2 ARG 63 12.615 18.143 2.889 214 2HH2 ARG 63 2HH2 ARG 63 12.441 19.275 1.589 215 H TYR 64 H TYR 64 7.004 11.765 5.431 216 HA TYR 64 HA TYR 64 8.937 12.112 7.562 217 1HB TYR 64 2HB TYR 64 6.655 13.896 7.183 218 2HB TYR 64 1HB TYR 64 6.666 13.131 8.765 219 HD1 TYR 64 1HD TYR 64 8.684 15.205 6.451 220 HD2 TYR 64 2HD TYR 64 8.149 13.863 10.454 221 HE1 TYR 64 1HE TYR 64 10.347 16.845 7.217 222 HE2 TYR 64 2HE TYR 64 9.811 15.501 11.231 223 HH TYR 64 HH TYR 64 10.952 18.033 9.273 224 H PHE 65 H PHE 65 7.650 9.897 6.213 225 HA PHE 65 HA PHE 65 6.826 8.408 8.521 226 1HB PHE 65 2HB PHE 65 4.708 9.511 7.960 227 2HB PHE 65 1HB PHE 65 4.820 8.906 6.311 228 HD1 PHE 65 1HD PHE 65 3.191 7.344 5.946 229 HD2 PHE 65 2HD PHE 65 5.290 7.294 9.645 230 HE1 PHE 65 1HE PHE 65 1.969 5.316 6.604 231 HE2 PHE 65 2HE PHE 65 4.074 5.263 10.313 232 HZ PHE 65 HZ PHE 65 2.409 4.270 8.792 233 H LYS 66 H LYS 66 7.183 6.252 8.258 234 HA LYS 66 HA LYS 66 8.632 5.440 5.924 235 1HB LYS 66 2HB LYS 66 7.712 3.855 8.327 236 2HB LYS 66 1HB LYS 66 8.803 3.256 7.085 237 1HG LYS 66 2HG LYS 66 9.533 5.782 8.454 238 2HG LYS 66 1HG LYS 66 9.678 4.276 9.363 239 1HD LYS 66 2HD LYS 66 10.795 4.397 6.604 240 2HD LYS 66 1HD LYS 66 11.677 5.194 7.909 241 1HE LYS 66 2HE LYS 66 10.837 2.586 8.755 242 2HE LYS 66 1HE LYS 66 11.693 2.465 7.219 243 1HZ LYS 66 1HZ LYS 66 13.367 4.035 8.420 244 2HZ LYS 66 2HZ LYS 66 13.414 2.368 8.696 245 3HZ LYS 66 3HZ LYS 66 12.676 3.390 9.823 246 H GLY 67 H GLY 67 5.331 5.306 6.883 247 1HA GLY 67 2HA GLY 67 3.634 4.801 5.272 248 2HA GLY 67 1HA GLY 67 4.756 3.702 4.488 249 H ILE 68 H ILE 68 2.412 2.630 4.806 250 HA ILE 68 HA ILE 68 2.674 0.908 7.184 251 HB ILE 68 HB ILE 68 0.726 2.299 7.498 252 1HG1 ILE 68 2HG1 ILE 68 -0.612 -0.198 6.617 253 2HG1 ILE 68 1HG1 ILE 68 0.731 -0.381 7.741 254 1HG2 ILE 68 1HG2 ILE 68 0.508 2.366 4.793 255 2HG2 ILE 68 2HG2 ILE 68 -0.744 2.904 5.915 256 3HG2 ILE 68 3HG2 ILE 68 -0.814 1.282 5.222 257 1HD1 ILE 68 1HD1 ILE 68 -1.097 1.710 8.558 258 2HD1 ILE 68 2HD1 ILE 68 -0.497 0.313 9.453 259 3HD1 ILE 68 3HD1 ILE 68 -1.893 0.146 8.388 260 H VAL 69 H VAL 69 2.517 -1.270 6.878 261 HA VAL 69 HA VAL 69 2.688 -2.195 4.136 262 HB VAL 69 HB VAL 69 2.843 -3.906 6.612 263 1HG1 VAL 69 1HG1 VAL 69 3.520 -4.250 3.727 264 2HG1 VAL 69 2HG1 VAL 69 2.720 -5.363 4.837 265 3HG1 VAL 69 3HG1 VAL 69 4.464 -5.117 4.939 266 1HG2 VAL 69 1HG2 VAL 69 5.424 -3.318 5.547 267 2HG2 VAL 69 2HG2 VAL 69 4.796 -3.004 7.165 268 3HG2 VAL 69 3HG2 VAL 69 4.592 -1.802 5.892 269 H TYR 70 H TYR 70 1.196 -3.323 3.052 270 HA TYR 70 HA TYR 70 -1.112 -4.393 4.474 271 1HB TYR 70 2HB TYR 70 -1.129 -2.137 2.634 272 2HB TYR 70 1HB TYR 70 -2.187 -3.435 2.094 273 HD1 TYR 70 1HD TYR 70 -1.363 -1.754 5.344 274 HD2 TYR 70 2HD TYR 70 -4.372 -3.238 2.725 275 HE1 TYR 70 1HE TYR 70 -3.097 -1.026 6.931 276 HE2 TYR 70 2HE TYR 70 -6.112 -2.512 4.304 277 HH TYR 70 HH TYR 70 -6.439 -0.985 6.113 278 H ALA 71 H ALA 71 -2.032 -6.149 3.568 279 HA ALA 71 HA ALA 71 -0.536 -7.418 1.385 280 1HB ALA 71 1HB ALA 71 -1.932 -9.461 2.257 281 2HB ALA 71 2HB ALA 71 -2.046 -8.484 3.721 282 3HB ALA 71 3HB ALA 71 -0.466 -8.950 3.089 283 H VAL 72 H VAL 72 -1.451 -7.269 -0.531 284 HA VAL 72 HA VAL 72 -4.323 -6.862 -0.731 285 HB VAL 72 HB VAL 72 -2.501 -6.698 -3.096 286 1HG1 VAL 72 1HG1 VAL 72 -5.126 -6.461 -2.948 287 2HG1 VAL 72 2HG1 VAL 72 -4.173 -5.451 -4.035 288 3HG1 VAL 72 3HG1 VAL 72 -4.715 -4.811 -2.483 289 1HG2 VAL 72 1HG2 VAL 72 -2.555 -4.860 -0.764 290 2HG2 VAL 72 2HG2 VAL 72 -2.487 -4.143 -2.374 291 3HG2 VAL 72 3HG2 VAL 72 -1.229 -5.264 -1.854 292 H SER 73 H SER 73 -5.584 -8.417 -1.240 293 HA SER 73 HA SER 73 -4.866 -10.442 -3.175 294 1HB SER 73 2HB SER 73 -5.699 -12.246 -1.478 295 2HB SER 73 1HB SER 73 -4.031 -11.683 -1.386 296 HG SER 73 HG SER 73 -5.134 -11.733 0.659 297 H SER 74 H SER 74 -6.707 -11.770 -3.806 298 HA SER 74 HA SER 74 -9.065 -10.237 -4.075 299 1HB SER 74 2HB SER 74 -8.773 -13.203 -4.581 300 2HB SER 74 1HB SER 74 -9.951 -12.107 -5.303 301 HG SER 74 HG SER 74 -7.408 -12.635 -6.061 302 H ASP 75 H ASP 75 -8.004 -12.230 -1.535 303 HA ASP 75 HA ASP 75 -10.610 -13.072 -0.663 304 1HB ASP 75 2HB ASP 75 -7.833 -13.589 0.028 305 2HB ASP 75 1HB ASP 75 -8.840 -13.389 1.450 306 H ARG 76 H ARG 76 -8.339 -10.495 0.062 307 HA ARG 76 HA ARG 76 -10.003 -9.550 2.267 308 1HB ARG 76 2HB ARG 76 -7.420 -9.639 2.276 309 2HB ARG 76 1HB ARG 76 -7.509 -8.200 1.270 310 1HG ARG 76 2HG ARG 76 -8.131 -6.879 2.981 311 2HG ARG 76 1HG ARG 76 -9.123 -8.132 3.731 312 1HD ARG 76 2HD ARG 76 -6.154 -8.419 3.732 313 2HD ARG 76 1HD ARG 76 -6.911 -7.310 4.874 314 HE ARG 76 HE ARG 76 -8.193 -9.830 4.950 315 1HH1 ARG 76 1HH1 ARG 76 -5.256 -8.226 5.935 316 2HH1 ARG 76 2HH1 ARG 76 -4.981 -9.282 7.279 317 1HH2 ARG 76 1HH2 ARG 76 -7.836 -11.220 6.717 318 2HH2 ARG 76 2HH2 ARG 76 -6.448 -10.982 7.725 319 H PHE 77 H PHE 77 -8.867 -8.504 -0.918 320 HA PHE 77 HA PHE 77 -11.025 -6.505 -0.935 321 1HB PHE 77 2HB PHE 77 -8.383 -6.023 -2.296 322 2HB PHE 77 1HB PHE 77 -9.645 -4.858 -1.906 323 HD1 PHE 77 1HD PHE 77 -10.034 -4.259 0.504 324 HD2 PHE 77 2HD PHE 77 -6.641 -6.475 -0.794 325 HE1 PHE 77 1HE PHE 77 -8.876 -3.709 2.603 326 HE2 PHE 77 2HE PHE 77 -5.477 -5.928 1.303 327 HZ PHE 77 HZ PHE 77 -6.594 -4.544 3.005 328 H ARG 78 H ARG 78 -12.419 -6.900 -2.504 329 HA ARG 78 HA ARG 78 -11.987 -8.828 -4.511 330 1HB ARG 78 2HB ARG 78 -14.137 -7.119 -3.564 331 2HB ARG 78 1HB ARG 78 -14.152 -7.285 -5.307 332 1HG ARG 78 2HG ARG 78 -13.744 -9.819 -3.946 333 2HG ARG 78 1HG ARG 78 -15.257 -9.030 -3.496 334 1HD ARG 78 2HD ARG 78 -16.023 -8.996 -5.720 335 2HD ARG 78 1HD ARG 78 -14.419 -9.347 -6.363 336 HE ARG 78 HE ARG 78 -14.863 -11.566 -6.102 337 1HH1 ARG 78 1HH1 ARG 78 -17.034 -9.769 -4.043 338 2HH1 ARG 78 2HH1 ARG 78 -17.927 -11.169 -3.551 339 1HH2 ARG 78 1HH2 ARG 78 -16.037 -13.407 -5.458 340 2HH2 ARG 78 2HH2 ARG 78 -17.360 -13.235 -4.353 341 H SER 79 H SER 79 -11.407 -5.416 -4.359 342 HA SER 79 HA SER 79 -10.076 -5.454 -6.889 343 1HB SER 79 2HB SER 79 -12.733 -5.049 -7.174 344 2HB SER 79 1HB SER 79 -12.199 -3.387 -6.918 345 HG SER 79 HG SER 79 -11.732 -5.099 -9.044 346 H PHE 80 H PHE 80 -9.508 -3.047 -7.507 347 HA PHE 80 HA PHE 80 -7.929 -2.025 -5.433 348 1HB PHE 80 2HB PHE 80 -8.065 -1.626 -8.136 349 2HB PHE 80 1HB PHE 80 -8.663 -0.088 -7.522 350 HD1 PHE 80 1HD PHE 80 -5.938 -2.487 -6.644 351 HD2 PHE 80 2HD PHE 80 -7.070 1.551 -7.352 352 HE1 PHE 80 1HE PHE 80 -3.630 -1.767 -6.210 353 HE2 PHE 80 2HE PHE 80 -4.766 2.278 -6.928 354 HZ PHE 80 HZ PHE 80 -3.036 0.618 -6.355 355 H ASP 81 H ASP 81 -11.180 -1.229 -6.476 356 HA ASP 81 HA ASP 81 -11.472 1.216 -5.127 357 1HB ASP 81 2HB ASP 81 -13.647 -0.830 -5.607 358 2HB ASP 81 1HB ASP 81 -13.850 0.905 -5.386 359 H ALA 82 H ALA 82 -12.065 -2.115 -4.111 360 HA ALA 82 HA ALA 82 -13.058 -1.461 -1.532 361 1HB ALA 82 1HB ALA 82 -12.470 -3.838 -3.049 362 2HB ALA 82 2HB ALA 82 -13.629 -3.592 -1.742 363 3HB ALA 82 3HB ALA 82 -11.956 -4.003 -1.371 364 H LEU 83 H LEU 83 -9.869 -2.171 -2.836 365 HA LEU 83 HA LEU 83 -8.504 -2.369 -0.366 366 1HB LEU 83 2HB LEU 83 -7.610 -3.092 -2.590 367 2HB LEU 83 1HB LEU 83 -7.431 -1.407 -3.023 368 HG LEU 83 HG LEU 83 -5.826 -1.116 -1.163 369 1HD1 LEU 83 1HD1 LEU 83 -5.390 -3.994 -0.839 370 2HD1 LEU 83 2HD1 LEU 83 -6.890 -3.393 -0.136 371 3HD1 LEU 83 3HD1 LEU 83 -5.347 -2.695 0.352 372 1HD2 LEU 83 1HD2 LEU 83 -4.148 -2.911 -2.237 373 2HD2 LEU 83 2HD2 LEU 83 -4.596 -1.403 -3.034 374 3HD2 LEU 83 3HD2 LEU 83 -5.409 -2.906 -3.471 375 H LEU 84 H LEU 84 -9.100 0.252 -2.628 376 HA LEU 84 HA LEU 84 -7.726 2.282 -1.277 377 1HB LEU 84 2HB LEU 84 -10.008 2.237 -3.217 378 2HB LEU 84 1HB LEU 84 -9.560 3.750 -2.448 379 HG LEU 84 HG LEU 84 -7.618 2.054 -4.012 380 1HD1 LEU 84 1HD1 LEU 84 -9.553 4.142 -4.886 381 2HD1 LEU 84 2HD1 LEU 84 -9.040 2.665 -5.703 382 3HD1 LEU 84 3HD1 LEU 84 -7.968 4.065 -5.655 383 1HD2 LEU 84 1HD2 LEU 84 -6.567 3.540 -2.425 384 2HD2 LEU 84 2HD2 LEU 84 -7.535 4.895 -3.010 385 3HD2 LEU 84 3HD2 LEU 84 -6.328 4.157 -4.061 386 H ALA 85 H ALA 85 -10.910 0.861 -0.788 387 HA ALA 85 HA ALA 85 -11.952 2.875 0.917 388 1HB ALA 85 1HB ALA 85 -13.589 1.241 1.563 389 2HB ALA 85 2HB ALA 85 -12.566 -0.074 0.982 390 3HB ALA 85 3HB ALA 85 -13.278 1.063 -0.164 391 H ASP 86 H ASP 86 -10.200 -0.136 1.557 392 HA ASP 86 HA ASP 86 -10.136 0.222 4.390 393 1HB ASP 86 2HB ASP 86 -9.751 -1.924 2.811 394 2HB ASP 86 1HB ASP 86 -8.072 -1.460 3.073 395 H LEU 87 H LEU 87 -8.052 0.994 1.700 396 HA LEU 87 HA LEU 87 -5.726 1.667 3.130 397 1HB LEU 87 2HB LEU 87 -6.791 2.636 0.478 398 2HB LEU 87 1HB LEU 87 -5.219 3.099 1.093 399 HG LEU 87 HG LEU 87 -6.044 0.666 -0.276 400 1HD1 LEU 87 1HD1 LEU 87 -3.304 1.697 0.413 401 2HD1 LEU 87 2HD1 LEU 87 -4.263 2.267 -0.952 402 3HD1 LEU 87 3HD1 LEU 87 -3.742 0.584 -0.882 403 1HD2 LEU 87 1HD2 LEU 87 -4.259 0.300 2.124 404 2HD2 LEU 87 2HD2 LEU 87 -4.783 -0.930 0.974 405 3HD2 LEU 87 3HD2 LEU 87 -5.951 -0.195 2.070 406 H THR 88 H THR 88 -8.519 3.600 2.171 407 HA THR 88 HA THR 88 -7.563 6.084 3.041 408 HB THR 88 HB THR 88 -10.274 4.889 2.577 409 HG1 THR 88 1HG THR 88 -9.380 5.636 0.759 410 1HG2 THR 88 1HG2 THR 88 -10.827 7.547 2.865 411 2HG2 THR 88 2HG2 THR 88 -9.797 7.211 4.256 412 3HG2 THR 88 3HG2 THR 88 -11.265 6.269 3.999 413 H ARG 89 H ARG 89 -9.242 3.469 4.678 414 HA ARG 89 HA ARG 89 -9.586 4.795 7.157 415 1HB ARG 89 2HB ARG 89 -9.606 1.873 6.411 416 2HB ARG 89 1HB ARG 89 -9.981 2.463 8.024 417 1HG ARG 89 2HG ARG 89 -11.739 3.927 6.823 418 2HG ARG 89 1HG ARG 89 -11.523 2.796 5.485 419 1HD ARG 89 2HD ARG 89 -13.109 1.597 6.523 420 2HD ARG 89 1HD ARG 89 -11.796 1.095 7.588 421 HE ARG 89 HE ARG 89 -12.684 3.353 8.763 422 1HH1 ARG 89 1HH1 ARG 89 -14.313 0.477 7.640 423 2HH1 ARG 89 2HH1 ARG 89 -15.571 0.577 8.825 424 1HH2 ARG 89 1HH2 ARG 89 -14.339 3.484 10.323 425 2HH2 ARG 89 2HH2 ARG 89 -15.588 2.284 10.347 426 H SER 90 H SER 90 -7.119 2.467 5.996 427 HA SER 90 HA SER 90 -5.750 2.453 8.512 428 1HB SER 90 2HB SER 90 -5.712 0.868 6.235 429 2HB SER 90 1HB SER 90 -4.120 1.629 6.246 430 HG SER 90 HG SER 90 -4.086 0.946 8.548 431 H LEU 91 H LEU 91 -5.245 4.148 5.447 432 HA LEU 91 HA LEU 91 -2.875 5.425 6.534 433 1HB LEU 91 2HB LEU 91 -3.951 4.828 3.883 434 2HB LEU 91 1HB LEU 91 -3.257 6.422 4.014 435 HG LEU 91 HG LEU 91 -1.904 3.767 4.383 436 1HD1 LEU 91 1HD1 LEU 91 -1.772 6.018 2.464 437 2HD1 LEU 91 2HD1 LEU 91 -1.660 4.280 2.189 438 3HD1 LEU 91 3HD1 LEU 91 -0.275 5.161 2.835 439 1HD2 LEU 91 1HD2 LEU 91 0.139 5.278 4.895 440 2HD2 LEU 91 2HD2 LEU 91 -0.980 4.864 6.194 441 3HD2 LEU 91 3HD2 LEU 91 -1.074 6.446 5.419 442 H SER 92 H SER 92 -6.111 5.975 6.648 443 HA SER 92 HA SER 92 -6.851 8.401 5.867 444 1HB SER 92 2HB SER 92 -8.436 8.405 7.534 445 2HB SER 92 1HB SER 92 -7.918 6.724 7.617 446 HG SER 92 HG SER 92 -7.984 7.745 9.678 447 H ASP 93 H ASP 93 -6.596 10.517 6.319 448 HA ASP 93 HA ASP 93 -4.873 11.404 8.474 449 1HB ASP 93 2HB ASP 93 -4.168 12.170 5.635 450 2HB ASP 93 1HB ASP 93 -3.261 12.525 7.101 451 H ASN 94 H ASN 94 -4.529 13.994 6.861 452 HA ASN 94 HA ASN 94 -7.145 14.999 6.376 453 1HB ASN 94 2HB ASN 94 -7.262 16.582 8.254 454 2HB ASN 94 1HB ASN 94 -7.275 14.914 8.819 455 1HD2 ASN 94 1HD2 ASN 94 -5.150 14.030 9.476 456 2HD2 ASN 94 2HD2 ASN 94 -4.059 15.085 10.302 457 H ILE 95 H ILE 95 -3.776 15.691 7.162 458 HA ILE 95 HA ILE 95 -3.884 18.114 5.524 459 HB ILE 95 HB ILE 95 -1.900 17.108 7.559 460 1HG1 ILE 95 2HG1 ILE 95 -2.905 19.871 7.653 461 2HG1 ILE 95 1HG1 ILE 95 -4.150 18.641 7.842 462 1HG2 ILE 95 1HG2 ILE 95 -0.584 19.160 7.074 463 2HG2 ILE 95 2HG2 ILE 95 -1.580 19.402 5.639 464 3HG2 ILE 95 3HG2 ILE 95 -0.566 17.966 5.777 465 1HD1 ILE 95 1HD1 ILE 95 -2.065 19.496 9.681 466 2HD1 ILE 95 2HD1 ILE 95 -2.186 17.744 9.516 467 3HD1 ILE 95 3HD1 ILE 95 -3.599 18.686 9.996 468 H ASN 96 H ASN 96 -2.526 14.909 5.726 469 HA ASN 96 HA ASN 96 -0.817 15.354 3.401 470 1HB ASN 96 2HB ASN 96 -1.049 13.230 5.484 471 2HB ASN 96 1HB ASN 96 -0.411 12.772 3.908 472 1HD2 ASN 96 1HD2 ASN 96 0.023 14.973 6.614 473 2HD2 ASN 96 2HD2 ASN 96 1.718 15.213 6.386 474 H LEU 97 H LEU 97 -3.757 13.722 4.358 475 HA LEU 97 HA LEU 97 -4.307 13.149 1.537 476 1HB LEU 97 2HB LEU 97 -4.170 11.213 3.775 477 2HB LEU 97 1HB LEU 97 -5.502 11.024 2.652 478 HG LEU 97 HG LEU 97 -2.694 11.238 1.632 479 1HD1 LEU 97 1HD1 LEU 97 -3.885 9.016 3.147 480 2HD1 LEU 97 2HD1 LEU 97 -2.194 9.435 2.878 481 3HD1 LEU 97 3HD1 LEU 97 -3.097 8.576 1.632 482 1HD2 LEU 97 1HD2 LEU 97 -4.507 9.393 0.336 483 2HD2 LEU 97 2HD2 LEU 97 -3.611 10.756 -0.335 484 3HD2 LEU 97 3HD2 LEU 97 -5.180 11.021 0.423 485 HA PRO 98 HA PRO 98 -7.827 15.675 2.953 486 1HB PRO 98 2HB PRO 98 -8.616 14.767 0.207 487 2HB PRO 98 1HB PRO 98 -8.785 16.352 0.953 488 1HG PRO 98 2HG PRO 98 -6.833 15.904 -0.778 489 2HG PRO 98 1HG PRO 98 -6.530 16.865 0.682 490 1HD PRO 98 2HD PRO 98 -5.731 14.062 0.056 491 2HD PRO 98 1HD PRO 98 -4.888 15.289 1.023 492 H GLN 99 H GLN 99 -8.800 13.077 0.736 493 HA GLN 99 HA GLN 99 -10.779 12.217 2.720 494 1HB GLN 99 2HB GLN 99 -10.594 11.729 -0.254 495 2HB GLN 99 1HB GLN 99 -11.826 11.023 0.782 496 1HG GLN 99 2HG GLN 99 -13.033 12.809 0.212 497 2HG GLN 99 1HG GLN 99 -12.052 13.656 1.406 498 1HE2 GLN 99 1HE2 GLN 99 -12.151 12.784 -2.019 499 2HE2 GLN 99 2HE2 GLN 99 -11.366 14.213 -2.588 500 H GLY 100 H GLY 100 -8.305 11.393 3.412 501 1HA GLY 100 2HA GLY 100 -7.232 9.485 4.110 502 2HA GLY 100 1HA GLY 100 -8.609 8.575 3.515 503 H VAL 101 H VAL 101 -8.660 8.070 1.206 504 HA VAL 101 HA VAL 101 -6.293 8.362 -0.399 505 HB VAL 101 HB VAL 101 -6.950 5.585 0.625 506 1HG1 VAL 101 1HG1 VAL 101 -4.715 6.446 -1.205 507 2HG1 VAL 101 2HG1 VAL 101 -6.228 5.732 -1.757 508 3HG1 VAL 101 3HG1 VAL 101 -5.138 4.801 -0.730 509 1HG2 VAL 101 1HG2 VAL 101 -4.593 7.381 1.174 510 2HG2 VAL 101 2HG2 VAL 101 -4.629 5.657 1.543 511 3HG2 VAL 101 3HG2 VAL 101 -5.757 6.751 2.339 512 H ARG 102 H ARG 102 -7.169 8.713 -2.307 513 HA ARG 102 HA ARG 102 -9.633 7.316 -3.038 514 1HB ARG 102 2HB ARG 102 -8.568 9.967 -3.543 515 2HB ARG 102 1HB ARG 102 -9.081 9.180 -5.029 516 1HG ARG 102 2HG ARG 102 -10.887 9.140 -2.663 517 2HG ARG 102 1HG ARG 102 -10.756 10.606 -3.640 518 1HD ARG 102 2HD ARG 102 -12.537 8.755 -4.199 519 2HD ARG 102 1HD ARG 102 -11.707 9.636 -5.476 520 HE ARG 102 HE ARG 102 -10.162 7.645 -5.569 521 1HH1 ARG 102 1HH1 ARG 102 -13.465 7.326 -4.441 522 2HH1 ARG 102 2HH1 ARG 102 -13.578 5.660 -4.888 523 1HH2 ARG 102 1HH2 ARG 102 -10.329 5.461 -6.152 524 2HH2 ARG 102 2HH2 ARG 102 -11.803 4.602 -5.856 525 H TYR 103 H TYR 103 -6.307 7.807 -4.046 526 HA TYR 103 HA TYR 103 -6.622 5.527 -5.834 527 1HB TYR 103 2HB TYR 103 -5.389 8.087 -6.857 528 2HB TYR 103 1HB TYR 103 -5.671 6.604 -7.742 529 HD1 TYR 103 1HD TYR 103 -7.120 9.714 -6.629 530 HD2 TYR 103 2HD TYR 103 -7.986 5.893 -8.282 531 HE1 TYR 103 1HE TYR 103 -9.321 10.535 -7.361 532 HE2 TYR 103 2HE TYR 103 -10.180 6.699 -9.023 533 HH TYR 103 HH TYR 103 -11.020 9.987 -9.055 534 H ILE 104 H ILE 104 -4.602 4.680 -6.653 535 HA ILE 104 HA ILE 104 -2.365 5.198 -4.807 536 HB ILE 104 HB ILE 104 -3.060 2.594 -6.171 537 1HG1 ILE 104 2HG1 ILE 104 -3.520 3.607 -3.368 538 2HG1 ILE 104 1HG1 ILE 104 -4.701 2.951 -4.495 539 1HG2 ILE 104 1HG2 ILE 104 -1.255 1.611 -5.083 540 2HG2 ILE 104 2HG2 ILE 104 -1.078 2.958 -3.956 541 3HG2 ILE 104 3HG2 ILE 104 -0.616 3.153 -5.646 542 1HD1 ILE 104 1HD1 ILE 104 -4.451 1.191 -3.062 543 2HD1 ILE 104 2HD1 ILE 104 -2.752 1.540 -2.751 544 3HD1 ILE 104 3HD1 ILE 104 -3.232 0.785 -4.269 545 H TYR 105 H TYR 105 -0.549 5.900 -5.722 546 HA TYR 105 HA TYR 105 -0.285 5.725 -8.626 547 1HB TYR 105 2HB TYR 105 0.226 7.796 -6.659 548 2HB TYR 105 1HB TYR 105 1.606 7.535 -7.726 549 HD1 TYR 105 1HD TYR 105 1.169 7.502 -10.220 550 HD2 TYR 105 2HD TYR 105 -1.599 9.040 -7.395 551 HE1 TYR 105 1HE TYR 105 0.057 8.736 -12.005 552 HE2 TYR 105 2HE TYR 105 -2.729 10.290 -9.167 553 HH TYR 105 HH TYR 105 -2.741 9.760 -12.082 554 H THR 106 H THR 106 1.956 5.720 -9.468 555 HA THR 106 HA THR 106 3.341 3.443 -8.422 556 HB THR 106 HB THR 106 5.086 4.447 -10.225 557 HG1 THR 106 1HG THR 106 3.586 6.294 -10.448 558 1HG2 THR 106 1HG2 THR 106 2.683 2.751 -10.525 559 2HG2 THR 106 2HG2 THR 106 4.381 2.385 -10.830 560 3HG2 THR 106 3HG2 THR 106 3.462 3.340 -11.994 561 H ILE 107 H ILE 107 5.523 3.377 -7.675 562 HA ILE 107 HA ILE 107 6.156 5.014 -5.591 563 HB ILE 107 HB ILE 107 7.283 2.857 -6.154 564 1HG1 ILE 107 2HG1 ILE 107 9.424 3.479 -5.149 565 2HG1 ILE 107 1HG1 ILE 107 9.141 5.169 -5.555 566 1HG2 ILE 107 1HG2 ILE 107 9.126 2.774 -7.652 567 2HG2 ILE 107 2HG2 ILE 107 9.081 4.518 -7.905 568 3HG2 ILE 107 3HG2 ILE 107 7.779 3.503 -8.527 569 1HD1 ILE 107 1HD1 ILE 107 8.676 4.315 -3.153 570 2HD1 ILE 107 2HD1 ILE 107 7.177 3.706 -3.854 571 3HD1 ILE 107 3HD1 ILE 107 7.546 5.430 -3.918 572 H ASP 108 H ASP 108 6.692 5.637 -8.972 573 HA ASP 108 HA ASP 108 8.321 7.989 -8.376 574 1HB ASP 108 2HB ASP 108 7.860 6.295 -10.758 575 2HB ASP 108 1HB ASP 108 8.087 8.013 -11.074 576 H GLY 109 H GLY 109 5.119 7.068 -9.344 577 1HA GLY 109 2HA GLY 109 3.239 8.473 -9.115 578 2HA GLY 109 1HA GLY 109 4.303 9.870 -9.184 579 H SER 110 H SER 110 4.777 7.419 -11.556 580 HA SER 110 HA SER 110 4.275 9.208 -13.689 581 1HB SER 110 2HB SER 110 4.598 7.196 -15.132 582 2HB SER 110 1HB SER 110 5.891 7.423 -13.953 583 HG SER 110 HG SER 110 4.765 5.234 -14.265 584 H ARG 111 H ARG 111 2.505 6.322 -12.567 585 HA ARG 111 HA ARG 111 0.039 7.493 -13.545 586 1HB ARG 111 2HB ARG 111 -0.501 5.106 -14.461 587 2HB ARG 111 1HB ARG 111 0.421 6.233 -15.445 588 1HG ARG 111 2HG ARG 111 2.190 4.892 -15.490 589 2HG ARG 111 1HG ARG 111 2.139 4.639 -13.744 590 1HD ARG 111 2HD ARG 111 0.163 3.069 -14.242 591 2HD ARG 111 1HD ARG 111 0.726 3.119 -15.912 592 HE ARG 111 HE ARG 111 2.929 2.496 -14.367 593 1HH1 ARG 111 1HH1 ARG 111 -0.190 1.088 -15.049 594 2HH1 ARG 111 2HH1 ARG 111 0.356 -0.540 -14.819 595 1HH2 ARG 111 1HH2 ARG 111 3.648 0.356 -14.065 596 2HH2 ARG 111 2HH2 ARG 111 2.534 -0.955 -14.260 597 H LYS 112 H LYS 112 -1.836 6.422 -12.729 598 HA LYS 112 HA LYS 112 -1.403 5.352 -10.053 599 1HB LYS 112 2HB LYS 112 -2.923 7.103 -9.917 600 2HB LYS 112 1HB LYS 112 -3.701 6.692 -11.431 601 1HG LYS 112 2HG LYS 112 -4.359 4.525 -9.968 602 2HG LYS 112 1HG LYS 112 -4.245 5.744 -8.701 603 1HD LYS 112 2HD LYS 112 -5.966 5.840 -11.179 604 2HD LYS 112 1HD LYS 112 -6.514 5.677 -9.510 605 1HE LYS 112 2HE LYS 112 -6.861 7.916 -9.839 606 2HE LYS 112 1HE LYS 112 -5.217 7.942 -9.205 607 1HZ LYS 112 1HZ LYS 112 -5.464 7.672 -12.086 608 2HZ LYS 112 2HZ LYS 112 -4.374 8.589 -11.173 609 3HZ LYS 112 3HZ LYS 112 -5.942 9.164 -11.446 610 H ILE 113 H ILE 113 -2.124 3.374 -9.369 611 HA ILE 113 HA ILE 113 -2.489 1.377 -11.407 612 HB ILE 113 HB ILE 113 -2.581 1.079 -8.404 613 1HG1 ILE 113 2HG1 ILE 113 -0.442 2.030 -9.583 614 2HG1 ILE 113 1HG1 ILE 113 -0.291 0.775 -8.361 615 1HG2 ILE 113 1HG2 ILE 113 -1.693 -1.285 -9.337 616 2HG2 ILE 113 2HG2 ILE 113 -2.769 -0.811 -10.651 617 3HG2 ILE 113 3HG2 ILE 113 -3.388 -0.932 -9.004 618 1HD1 ILE 113 1HD1 ILE 113 -0.603 -0.235 -11.085 619 2HD1 ILE 113 2HD1 ILE 113 0.531 -0.707 -9.817 620 3HD1 ILE 113 3HD1 ILE 113 0.858 0.714 -10.813 621 H GLY 114 H GLY 114 -4.312 0.349 -11.968 622 1HA GLY 114 2HA GLY 114 -6.785 1.091 -10.532 623 2HA GLY 114 1HA GLY 114 -6.711 0.805 -12.265 624 H SER 115 H SER 115 -4.807 -1.505 -11.672 625 HA SER 115 HA SER 115 -6.851 -3.417 -10.756 626 1HB SER 115 2HB SER 115 -5.964 -5.036 -12.380 627 2HB SER 115 1HB SER 115 -6.530 -3.576 -13.189 628 HG SER 115 HG SER 115 -4.333 -2.878 -13.242 629 H MET 116 H MET 116 -6.189 -5.144 -9.533 630 HA MET 116 HA MET 116 -4.008 -4.763 -7.811 631 1HB MET 116 2HB MET 116 -6.258 -6.345 -7.826 632 2HB MET 116 1HB MET 116 -4.971 -7.525 -8.028 633 1HG MET 116 2HG MET 116 -3.943 -6.887 -5.996 634 2HG MET 116 1HG MET 116 -4.961 -5.455 -5.854 635 1HE MET 116 1HE MET 116 -8.238 -6.570 -4.542 636 2HE MET 116 2HE MET 116 -7.349 -5.413 -5.531 637 3HE MET 116 3HE MET 116 -6.904 -5.654 -3.842 638 H ASP 117 H ASP 117 -4.315 -6.378 -10.862 639 HA ASP 117 HA ASP 117 -2.198 -8.171 -10.739 640 1HB ASP 117 2HB ASP 117 -3.912 -6.983 -12.759 641 2HB ASP 117 1HB ASP 117 -2.291 -7.266 -13.360 642 H GLU 118 H GLU 118 -2.161 -4.734 -10.836 643 HA GLU 118 HA GLU 118 0.519 -4.589 -11.946 644 1HB GLU 118 2HB GLU 118 -1.382 -2.498 -10.895 645 2HB GLU 118 1HB GLU 118 0.247 -2.125 -11.440 646 1HG GLU 118 2HG GLU 118 -1.883 -3.409 -13.134 647 2HG GLU 118 1HG GLU 118 -1.474 -1.693 -13.146 648 H LEU 119 H LEU 119 -0.912 -4.985 -8.875 649 HA LEU 119 HA LEU 119 1.228 -3.760 -7.377 650 1HB LEU 119 2HB LEU 119 -0.686 -5.679 -6.139 651 2HB LEU 119 1HB LEU 119 0.007 -4.212 -5.476 652 HG LEU 119 HG LEU 119 -2.178 -4.348 -7.551 653 1HD1 LEU 119 1HD1 LEU 119 -3.701 -3.919 -5.907 654 2HD1 LEU 119 2HD1 LEU 119 -2.512 -3.159 -4.848 655 3HD1 LEU 119 3HD1 LEU 119 -2.554 -4.914 -5.011 656 1HD2 LEU 119 1HD2 LEU 119 -1.203 -1.897 -6.121 657 2HD2 LEU 119 2HD2 LEU 119 -2.248 -2.010 -7.536 658 3HD2 LEU 119 3HD2 LEU 119 -0.535 -2.406 -7.672 659 H GLU 120 H GLU 120 3.163 -4.700 -7.355 660 HA GLU 120 HA GLU 120 3.334 -7.623 -7.357 661 1HB GLU 120 2HB GLU 120 5.596 -5.647 -7.639 662 2HB GLU 120 1HB GLU 120 5.615 -7.357 -8.018 663 1HG GLU 120 2HG GLU 120 3.689 -6.657 -9.675 664 2HG GLU 120 1HG GLU 120 4.487 -5.091 -9.552 665 H GLU 121 H GLU 121 4.776 -8.689 -5.859 666 HA GLU 121 HA GLU 121 4.362 -7.975 -3.202 667 1HB GLU 121 2HB GLU 121 6.378 -9.817 -4.463 668 2HB GLU 121 1HB GLU 121 6.256 -9.606 -2.720 669 1HG GLU 121 2HG GLU 121 4.418 -10.869 -2.573 670 2HG GLU 121 1HG GLU 121 3.707 -10.180 -4.032 671 H GLY 122 H GLY 122 5.876 -7.405 -1.543 672 1HA GLY 122 2HA GLY 122 7.245 -5.802 -0.651 673 2HA GLY 122 1HA GLY 122 8.437 -6.548 -1.691 674 H GLU 123 H GLU 123 5.595 -4.644 -2.615 675 HA GLU 123 HA GLU 123 7.397 -2.862 -4.096 676 1HB GLU 123 2HB GLU 123 4.559 -3.684 -4.414 677 2HB GLU 123 1HB GLU 123 5.013 -2.081 -4.976 678 1HG GLU 123 2HG GLU 123 6.953 -3.383 -6.154 679 2HG GLU 123 1HG GLU 123 5.857 -4.750 -5.974 680 H SER 124 H SER 124 6.727 -0.552 -4.255 681 HA SER 124 HA SER 124 5.726 0.444 -1.668 682 1HB SER 124 2HB SER 124 8.073 1.341 -3.322 683 2HB SER 124 1HB SER 124 7.267 2.466 -2.228 684 HG SER 124 HG SER 124 9.124 0.781 -1.591 685 H TYR 125 H TYR 125 3.842 1.455 -1.925 686 HA TYR 125 HA TYR 125 3.355 2.843 -4.471 687 1HB TYR 125 2HB TYR 125 1.507 1.323 -2.698 688 2HB TYR 125 1HB TYR 125 0.882 2.571 -3.753 689 HD1 TYR 125 1HD TYR 125 1.829 2.429 -6.219 690 HD2 TYR 125 2HD TYR 125 1.518 -0.855 -3.548 691 HE1 TYR 125 1HE TYR 125 1.843 0.908 -8.121 692 HE2 TYR 125 2HE TYR 125 1.528 -2.409 -5.451 693 HH TYR 125 HH TYR 125 2.569 -2.093 -8.080 694 H VAL 126 H VAL 126 1.980 4.651 -4.446 695 HA VAL 126 HA VAL 126 2.216 6.233 -1.958 696 HB VAL 126 HB VAL 126 2.718 6.999 -4.802 697 1HG1 VAL 126 1HG1 VAL 126 1.144 8.652 -4.512 698 2HG1 VAL 126 2HG1 VAL 126 2.580 9.447 -3.866 699 3HG1 VAL 126 3HG1 VAL 126 1.397 8.737 -2.767 700 1HG2 VAL 126 1HG2 VAL 126 4.736 7.625 -4.038 701 2HG2 VAL 126 2HG2 VAL 126 4.325 6.608 -2.657 702 3HG2 VAL 126 3HG2 VAL 126 4.070 8.351 -2.575 703 H CYS 127 H CYS 127 0.443 7.284 -1.212 704 HA CYS 127 HA CYS 127 -2.080 6.659 -2.536 705 1HB CYS 127 2HB CYS 127 -1.302 7.502 0.224 706 2HB CYS 127 1HB CYS 127 -2.948 7.796 -0.326 707 HG CYS 127 HG CYS 127 -1.724 4.941 -0.138 708 H SER 128 H SER 128 -3.290 8.096 -3.588 709 HA SER 128 HA SER 128 -2.670 10.955 -3.279 710 1HB SER 128 2HB SER 128 -3.242 9.522 -5.887 711 2HB SER 128 1HB SER 128 -2.986 11.259 -5.698 712 HG SER 128 HG SER 128 -1.067 9.340 -4.892 713 H SER 129 H SER 129 -4.420 12.374 -4.076 714 HA SER 129 HA SER 129 -7.070 11.221 -4.262 715 1HB SER 129 2HB SER 129 -6.173 11.879 -1.740 716 2HB SER 129 1HB SER 129 -7.031 13.339 -2.231 717 HG SER 129 HG SER 129 -8.127 11.247 -1.252 718 H ASP 130 H ASP 130 -5.260 14.232 -3.761 719 HA ASP 130 HA ASP 130 -6.446 15.358 -6.162 720 1HB ASP 130 2HB ASP 130 -6.843 16.532 -3.410 721 2HB ASP 130 1HB ASP 130 -6.972 17.504 -4.872 722 H ASN 131 H ASN 131 -4.364 15.867 -3.359 723 HA ASN 131 HA ASN 131 -2.791 17.950 -4.160 724 1HB ASN 131 2HB ASN 131 -0.908 16.575 -2.924 725 2HB ASN 131 1HB ASN 131 -2.276 17.232 -2.035 726 1HD2 ASN 131 1HD2 ASN 131 -1.855 14.339 -4.062 727 2HD2 ASN 131 2HD2 ASN 131 -2.397 13.219 -2.864 728 H PHE 132 H PHE 132 -0.563 17.981 -4.992 729 HA PHE 132 HA PHE 132 -0.383 16.400 -7.421 730 1HB PHE 132 2HB PHE 132 0.203 18.994 -6.932 731 2HB PHE 132 1HB PHE 132 1.798 18.279 -6.718 732 HD1 PHE 132 1HD PHE 132 3.027 18.858 -8.583 733 HD2 PHE 132 2HD PHE 132 -0.943 17.410 -9.080 734 HE1 PHE 132 1HE PHE 132 3.344 18.839 -11.024 735 HE2 PHE 132 2HE PHE 132 -0.633 17.387 -11.522 736 HZ PHE 132 HZ PHE 132 1.513 18.101 -12.495 737 H PHE 133 H PHE 133 1.384 15.072 -7.966 738 HA PHE 133 HA PHE 133 2.488 13.636 -5.755 739 1HB PHE 133 2HB PHE 133 1.847 12.558 -7.906 740 2HB PHE 133 1HB PHE 133 3.188 13.391 -8.687 741 HD1 PHE 133 1HD PHE 133 5.536 12.998 -7.602 742 HD2 PHE 133 2HD PHE 133 2.176 10.439 -7.069 743 HE1 PHE 133 1HE PHE 133 7.042 11.159 -6.974 744 HE2 PHE 133 2HE PHE 133 3.679 8.594 -6.442 745 HZ PHE 133 HZ PHE 133 6.114 8.952 -6.393 746 H LYS 134 H LYS 134 4.319 13.984 -4.714 747 HA LYS 134 HA LYS 134 6.284 15.824 -5.900 748 1HB LYS 134 2HB LYS 134 5.723 15.113 -3.017 749 2HB LYS 134 1HB LYS 134 7.084 16.099 -3.534 750 1HG LYS 134 2HG LYS 134 5.032 17.399 -4.729 751 2HG LYS 134 1HG LYS 134 4.242 16.781 -3.277 752 1HD LYS 134 2HD LYS 134 5.065 18.653 -2.331 753 2HD LYS 134 1HD LYS 134 6.557 17.716 -2.232 754 1HE LYS 134 2HE LYS 134 5.816 19.547 -4.511 755 2HE LYS 134 1HE LYS 134 6.884 19.983 -3.177 756 1HZ LYS 134 1HZ LYS 134 7.906 19.142 -5.362 757 2HZ LYS 134 2HZ LYS 134 7.451 17.604 -4.824 758 3HZ LYS 134 3HZ LYS 134 8.517 18.540 -3.903 759 H LYS 135 H LYS 135 8.313 15.147 -6.305 760 HA LYS 135 HA LYS 135 8.895 12.340 -6.068 761 1HB LYS 135 2HB LYS 135 10.837 14.471 -6.933 762 2HB LYS 135 1HB LYS 135 10.821 12.770 -7.377 763 1HG LYS 135 2HG LYS 135 8.727 14.771 -8.200 764 2HG LYS 135 1HG LYS 135 10.098 14.277 -9.193 765 1HD LYS 135 2HD LYS 135 7.986 12.411 -8.119 766 2HD LYS 135 1HD LYS 135 8.007 13.076 -9.754 767 1HE LYS 135 2HE LYS 135 9.109 11.174 -10.241 768 2HE LYS 135 1HE LYS 135 10.501 12.052 -9.608 769 1HZ LYS 135 1HZ LYS 135 8.906 9.935 -8.328 770 2HZ LYS 135 2HZ LYS 135 9.728 11.057 -7.366 771 3HZ LYS 135 3HZ LYS 135 10.587 10.083 -8.450 772 H VAL 136 H VAL 136 9.167 11.769 -3.955 773 HA VAL 136 HA VAL 136 11.387 13.075 -2.518 774 HB VAL 136 HB VAL 136 9.962 11.789 -0.544 775 1HG1 VAL 136 1HG1 VAL 136 9.097 14.204 -0.118 776 2HG1 VAL 136 2HG1 VAL 136 10.135 14.614 -1.486 777 3HG1 VAL 136 3HG1 VAL 136 10.827 13.858 -0.049 778 1HG2 VAL 136 1HG2 VAL 136 7.637 12.458 -0.775 779 2HG2 VAL 136 2HG2 VAL 136 8.096 11.378 -2.092 780 3HG2 VAL 136 3HG2 VAL 136 7.964 13.113 -2.379 781 H GLU 137 H GLU 137 12.243 11.562 -0.718 782 HA GLU 137 HA GLU 137 13.149 9.176 -2.036 783 1HB GLU 137 2HB GLU 137 13.716 10.352 0.689 784 2HB GLU 137 1HB GLU 137 14.412 8.832 0.147 785 1HG GLU 137 2HG GLU 137 16.018 9.895 -0.938 786 2HG GLU 137 1HG GLU 137 14.840 10.846 -1.840 787 H TYR 138 H TYR 138 10.863 8.519 -2.170 788 HA TYR 138 HA TYR 138 9.347 7.595 -0.041 789 1HB TYR 138 2HB TYR 138 9.557 6.931 -2.943 790 2HB TYR 138 1HB TYR 138 8.456 6.005 -1.914 791 HD1 TYR 138 1HD TYR 138 7.193 7.859 -0.190 792 HD2 TYR 138 2HD TYR 138 8.421 8.464 -4.218 793 HE1 TYR 138 1HE TYR 138 5.507 9.636 -0.431 794 HE2 TYR 138 2HE TYR 138 6.736 10.238 -4.472 795 HH TYR 138 HH TYR 138 4.246 10.652 -2.892 796 H THR 139 H THR 139 12.199 6.219 -1.466 797 HA THR 139 HA THR 139 12.079 4.040 0.460 798 HB THR 139 HB THR 139 12.214 2.267 -1.040 799 HG1 THR 139 1HG THR 139 13.787 2.959 -2.424 800 1HG2 THR 139 1HG2 THR 139 9.976 3.409 -1.164 801 2HG2 THR 139 2HG2 THR 139 10.398 2.378 -2.530 802 3HG2 THR 139 3HG2 THR 139 10.529 4.130 -2.676 803 H LYS 140 H LYS 140 13.802 6.493 -0.590 804 HA LYS 140 HA LYS 140 16.347 5.297 -1.120 805 1HB LYS 140 2HB LYS 140 15.242 7.864 -1.327 806 2HB LYS 140 1HB LYS 140 16.520 8.010 -0.127 807 1HG LYS 140 2HG LYS 140 16.832 6.894 -2.905 808 2HG LYS 140 1HG LYS 140 17.329 8.501 -2.370 809 1HD LYS 140 2HD LYS 140 19.192 7.724 -1.379 810 2HD LYS 140 1HD LYS 140 18.368 6.304 -0.729 811 1HE LYS 140 2HE LYS 140 18.413 5.379 -3.092 812 2HE LYS 140 1HE LYS 140 19.531 6.688 -3.477 813 1HZ LYS 140 1HZ LYS 140 20.316 4.304 -2.626 814 2HZ LYS 140 2HZ LYS 140 20.181 5.092 -1.135 815 3HZ LYS 140 3HZ LYS 140 21.195 5.721 -2.335 816 H ASN 141 H ASN 141 17.662 4.424 0.249 817 HA ASN 141 HA ASN 141 18.790 3.915 2.134 818 1HB ASN 141 2HB ASN 141 17.695 6.483 3.281 819 2HB ASN 141 1HB ASN 141 19.096 5.586 3.856 820 1HD2 ASN 141 1HD2 ASN 141 20.615 5.084 1.821 821 2HD2 ASN 141 2HD2 ASN 141 21.065 6.507 0.951 822 H VAL 142 H VAL 142 15.735 3.535 1.761 823 HA VAL 142 HA VAL 142 14.888 3.174 4.520 824 HB VAL 142 HB VAL 142 13.376 2.504 1.992 825 1HG1 VAL 142 1HG1 VAL 142 12.467 2.874 4.845 826 2HG1 VAL 142 2HG1 VAL 142 12.521 1.355 3.949 827 3HG1 VAL 142 3HG1 VAL 142 11.402 2.628 3.462 828 1HG2 VAL 142 1HG2 VAL 142 13.330 5.020 3.657 829 2HG2 VAL 142 2HG2 VAL 142 12.207 4.645 2.350 830 3HG2 VAL 142 3HG2 VAL 142 13.922 4.865 2.002 831 H ASN 143 H ASN 143 15.834 1.254 1.733 832 HA ASN 143 HA ASN 143 16.426 -0.933 1.525 833 1HB ASN 143 2HB ASN 143 16.835 -0.360 4.368 834 2HB ASN 143 1HB ASN 143 16.513 -2.061 4.041 835 1HD2 ASN 143 1HD2 ASN 143 18.538 -2.801 4.457 836 2HD2 ASN 143 2HD2 ASN 143 19.916 -2.414 3.489 837 HA PRO 144 HA PRO 144 12.166 -2.451 1.647 838 1HB PRO 144 2HB PRO 144 13.176 -4.462 -0.242 839 2HB PRO 144 1HB PRO 144 11.904 -3.258 -0.460 840 1HG PRO 144 2HG PRO 144 14.279 -3.059 -1.704 841 2HG PRO 144 1HG PRO 144 13.381 -1.631 -1.156 842 1HD PRO 144 2HD PRO 144 15.728 -2.996 0.116 843 2HD PRO 144 1HD PRO 144 15.403 -1.260 -0.076 844 H ASN 145 H ASN 145 13.513 -3.180 3.854 845 HA ASN 145 HA ASN 145 13.799 -6.075 3.904 846 1HB ASN 145 2HB ASN 145 14.437 -5.663 6.315 847 2HB ASN 145 1HB ASN 145 15.489 -4.912 5.118 848 1HD2 ASN 145 1HD2 ASN 145 16.188 -3.087 5.963 849 2HD2 ASN 145 2HD2 ASN 145 15.210 -1.880 6.721 850 H TRP 146 H TRP 146 11.312 -3.886 4.249 851 HA TRP 146 HA TRP 146 9.893 -5.060 6.423 852 1HB TRP 146 2HB TRP 146 7.913 -3.807 5.213 853 2HB TRP 146 1HB TRP 146 9.157 -2.908 6.073 854 HD1 TRP 146 HD TRP 146 10.747 -1.354 4.656 855 HE1 TRP 146 1HE TRP 146 10.690 -0.538 2.217 856 HE3 TRP 146 3HE TRP 146 7.249 -4.589 2.792 857 HZ2 TRP 146 2HZ TRP 146 9.340 -1.175 -0.177 858 HZ3 TRP 146 3HZ TRP 146 6.629 -4.412 0.423 859 HH2 TRP 146 HH TRP 146 7.655 -2.745 -1.032 860 H SER 147 H SER 147 10.278 -5.903 3.114 861 HA SER 147 HA SER 147 7.839 -7.464 2.992 862 1HB SER 147 2HB SER 147 9.328 -6.229 1.072 863 2HB SER 147 1HB SER 147 9.885 -7.895 0.911 864 HG SER 147 HG SER 147 7.169 -7.067 0.893 865 H VAL 148 H VAL 148 9.888 -8.143 5.019 866 HA VAL 148 HA VAL 148 10.961 -10.680 4.104 867 HB VAL 148 HB VAL 148 11.958 -10.807 6.372 868 1HG1 VAL 148 1HG1 VAL 148 13.462 -8.780 6.067 869 2HG1 VAL 148 2HG1 VAL 148 12.453 -8.375 4.679 870 3HG1 VAL 148 3HG1 VAL 148 13.347 -9.895 4.704 871 1HG2 VAL 148 1HG2 VAL 148 11.051 -9.617 8.019 872 2HG2 VAL 148 2HG2 VAL 148 10.076 -8.691 6.879 873 3HG2 VAL 148 3HG2 VAL 148 11.712 -8.165 7.268 874 H ASN 149 H ASN 149 8.049 -9.651 5.343 875 HA ASN 149 HA ASN 149 7.577 -12.013 6.983 876 1HB ASN 149 2HB ASN 149 6.163 -9.428 6.530 877 2HB ASN 149 1HB ASN 149 5.202 -10.813 7.038 878 1HD2 ASN 149 1HD2 ASN 149 6.385 -12.084 8.877 879 2HD2 ASN 149 2HD2 ASN 149 6.918 -11.100 10.192 880 H VAL 150 H VAL 150 8.080 -12.788 4.442 881 HA VAL 150 HA VAL 150 5.454 -13.763 3.576 882 HB VAL 150 HB VAL 150 6.234 -13.555 1.181 883 1HG1 VAL 150 1HG1 VAL 150 5.824 -10.974 2.687 884 2HG1 VAL 150 2HG1 VAL 150 4.544 -12.079 2.190 885 3HG1 VAL 150 3HG1 VAL 150 5.513 -11.249 0.972 886 1HG2 VAL 150 1HG2 VAL 150 8.638 -12.894 2.268 887 2HG2 VAL 150 2HG2 VAL 150 7.989 -11.305 1.864 888 3HG2 VAL 150 3HG2 VAL 150 8.153 -12.535 0.611 Start of MODEL 10 1 1H GLY 38 1HT GLY 38 -8.408 -30.109 -17.375 2 2H GLY 38 2HT GLY 38 -8.078 -28.479 -17.067 3 3H GLY 38 3HT GLY 38 -7.866 -29.104 -18.624 4 1HA GLY 38 1HA GLY 38 -9.866 -27.975 -18.797 5 2HA GLY 38 2HA GLY 38 -10.335 -29.652 -18.566 6 H ALA 39 H ALA 39 -10.887 -26.545 -17.573 7 HA ALA 39 HA ALA 39 -12.241 -27.500 -15.147 8 1HB ALA 39 1HB ALA 39 -11.486 -25.711 -13.827 9 2HB ALA 39 2HB ALA 39 -10.859 -24.834 -15.222 10 3HB ALA 39 3HB ALA 39 -10.048 -26.297 -14.663 11 H MET 40 H MET 40 -11.899 -24.783 -17.418 12 HA MET 40 HA MET 40 -14.792 -24.624 -17.640 13 1HB MET 40 2HB MET 40 -13.123 -22.597 -16.275 14 2HB MET 40 1HB MET 40 -14.304 -21.973 -17.417 15 1HG MET 40 2HG MET 40 -16.054 -22.516 -16.116 16 2HG MET 40 1HG MET 40 -15.301 -24.000 -15.534 17 1HE MET 40 1HE MET 40 -16.017 -23.399 -12.637 18 2HE MET 40 2HE MET 40 -17.031 -22.624 -13.855 19 3HE MET 40 3HE MET 40 -16.372 -21.675 -12.522 20 H ASP 41 H ASP 41 -11.828 -22.833 -18.504 21 HA ASP 41 HA ASP 41 -12.258 -23.343 -21.304 22 1HB ASP 41 2HB ASP 41 -13.626 -21.203 -20.417 23 2HB ASP 41 1HB ASP 41 -12.072 -20.435 -20.733 24 HA PRO 42 HA PRO 42 -7.846 -22.701 -20.181 25 1HB PRO 42 2HB PRO 42 -6.894 -25.049 -21.017 26 2HB PRO 42 1HB PRO 42 -7.756 -24.911 -19.479 27 1HG PRO 42 2HG PRO 42 -8.734 -25.924 -22.117 28 2HG PRO 42 1HG PRO 42 -9.042 -26.556 -20.489 29 1HD PRO 42 2HD PRO 42 -10.778 -24.929 -21.916 30 2HD PRO 42 1HD PRO 42 -10.797 -25.132 -20.154 31 H GLU 43 H GLU 43 -9.104 -21.571 -22.465 32 HA GLU 43 HA GLU 43 -7.724 -22.453 -24.830 33 1HB GLU 43 2HB GLU 43 -9.510 -20.099 -24.229 34 2HB GLU 43 1HB GLU 43 -8.734 -20.315 -25.791 35 1HG GLU 43 2HG GLU 43 -10.384 -22.513 -24.627 36 2HG GLU 43 1HG GLU 43 -11.158 -21.146 -25.426 37 H PHE 44 H PHE 44 -7.265 -20.044 -22.355 38 HA PHE 44 HA PHE 44 -4.584 -19.544 -23.291 39 1HB PHE 44 2HB PHE 44 -4.940 -17.036 -23.285 40 2HB PHE 44 1HB PHE 44 -5.647 -17.899 -24.647 41 HD1 PHE 44 1HD PHE 44 -8.146 -18.614 -24.334 42 HD2 PHE 44 2HD PHE 44 -6.228 -15.518 -22.135 43 HE1 PHE 44 1HE PHE 44 -10.340 -17.621 -23.826 44 HE2 PHE 44 2HE PHE 44 -8.417 -14.518 -21.622 45 HZ PHE 44 HZ PHE 44 -10.477 -15.570 -22.468 46 H ALA 45 H ALA 45 -7.163 -18.547 -21.070 47 HA ALA 45 HA ALA 45 -7.127 -17.884 -18.882 48 1HB ALA 45 1HB ALA 45 -6.487 -20.419 -18.978 49 2HB ALA 45 2HB ALA 45 -6.395 -19.531 -17.458 50 3HB ALA 45 3HB ALA 45 -4.929 -19.839 -18.389 51 H LEU 46 H LEU 46 -5.711 -16.079 -20.298 52 HA LEU 46 HA LEU 46 -3.074 -15.706 -19.194 53 1HB LEU 46 2HB LEU 46 -4.748 -14.434 -21.243 54 2HB LEU 46 1HB LEU 46 -3.736 -13.313 -20.352 55 HG LEU 46 HG LEU 46 -1.740 -14.518 -21.002 56 1HD1 LEU 46 1HD1 LEU 46 -3.698 -16.562 -21.796 57 2HD1 LEU 46 2HD1 LEU 46 -2.038 -16.736 -21.226 58 3HD1 LEU 46 3HD1 LEU 46 -2.354 -16.327 -22.913 59 1HD2 LEU 46 1HD2 LEU 46 -1.632 -13.616 -23.067 60 2HD2 LEU 46 2HD2 LEU 46 -3.205 -12.952 -22.626 61 3HD2 LEU 46 3HD2 LEU 46 -3.109 -14.412 -23.611 62 H SER 47 H SER 47 -2.456 -13.724 -18.043 63 HA SER 47 HA SER 47 -2.602 -12.335 -16.249 64 1HB SER 47 2HB SER 47 -5.088 -11.902 -17.757 65 2HB SER 47 1HB SER 47 -5.189 -11.435 -16.059 66 HG SER 47 HG SER 47 -3.161 -10.266 -16.481 67 H ASN 48 H ASN 48 -4.361 -11.837 -14.296 68 HA ASN 48 HA ASN 48 -5.266 -12.644 -12.372 69 1HB ASN 48 2HB ASN 48 -6.656 -13.904 -14.335 70 2HB ASN 48 1HB ASN 48 -5.987 -15.289 -13.476 71 1HD2 ASN 48 1HD2 ASN 48 -7.505 -12.166 -12.730 72 2HD2 ASN 48 2HD2 ASN 48 -8.541 -12.775 -11.488 73 H GLU 49 H GLU 49 -4.514 -13.688 -10.588 74 HA GLU 49 HA GLU 49 -2.944 -16.081 -10.747 75 1HB GLU 49 2HB GLU 49 -1.631 -13.447 -10.678 76 2HB GLU 49 1HB GLU 49 -1.059 -14.578 -9.458 77 1HG GLU 49 2HG GLU 49 -1.304 -15.724 -12.137 78 2HG GLU 49 1HG GLU 49 -0.132 -14.413 -12.008 79 H LYS 50 H LYS 50 -2.407 -16.937 -8.671 80 HA LYS 50 HA LYS 50 -4.231 -16.017 -6.600 81 1HB LYS 50 2HB LYS 50 -3.752 -18.125 -5.494 82 2HB LYS 50 1HB LYS 50 -4.136 -18.414 -7.185 83 1HG LYS 50 2HG LYS 50 -1.853 -18.794 -7.724 84 2HG LYS 50 1HG LYS 50 -1.324 -18.238 -6.135 85 1HD LYS 50 2HD LYS 50 -1.751 -20.221 -5.169 86 2HD LYS 50 1HD LYS 50 -3.264 -20.432 -6.054 87 1HE LYS 50 2HE LYS 50 -1.653 -22.162 -6.650 88 2HE LYS 50 1HE LYS 50 -2.014 -21.130 -8.033 89 1HZ LYS 50 1HZ LYS 50 0.104 -19.881 -7.009 90 2HZ LYS 50 2HZ LYS 50 0.212 -21.074 -8.202 91 3HZ LYS 50 3HZ LYS 50 0.471 -21.476 -6.580 92 H LYS 51 H LYS 51 -3.034 -16.758 -4.285 93 HA LYS 51 HA LYS 51 -1.579 -16.101 -2.664 94 1HB LYS 51 2HB LYS 51 0.049 -16.491 -4.977 95 2HB LYS 51 1HB LYS 51 0.633 -15.065 -4.130 96 1HG LYS 51 2HG LYS 51 0.426 -16.650 -2.034 97 2HG LYS 51 1HG LYS 51 0.587 -17.904 -3.265 98 1HD LYS 51 2HD LYS 51 2.794 -17.601 -3.031 99 2HD LYS 51 1HD LYS 51 2.551 -16.130 -3.975 100 1HE LYS 51 2HE LYS 51 2.091 -15.977 -1.048 101 2HE LYS 51 1HE LYS 51 3.758 -16.122 -1.603 102 1HZ LYS 51 1HZ LYS 51 1.906 -13.903 -1.859 103 2HZ LYS 51 2HZ LYS 51 2.855 -14.215 -3.224 104 3HZ LYS 51 3HZ LYS 51 3.593 -13.899 -1.736 105 H ALA 52 H ALA 52 -1.033 -14.229 -1.538 106 HA ALA 52 HA ALA 52 -2.249 -11.820 -2.561 107 1HB ALA 52 1HB ALA 52 -2.547 -12.528 -0.217 108 2HB ALA 52 2HB ALA 52 -1.866 -10.907 -0.353 109 3HB ALA 52 3HB ALA 52 -0.824 -12.269 0.060 110 H LYS 53 H LYS 53 -0.837 -9.758 -1.624 111 HA LYS 53 HA LYS 53 1.906 -9.989 -2.606 112 1HB LYS 53 2HB LYS 53 0.064 -7.808 -3.589 113 2HB LYS 53 1HB LYS 53 1.708 -8.136 -4.116 114 1HG LYS 53 2HG LYS 53 -0.522 -10.111 -4.490 115 2HG LYS 53 1HG LYS 53 -0.159 -8.849 -5.669 116 1HD LYS 53 2HD LYS 53 2.112 -9.708 -5.907 117 2HD LYS 53 1HD LYS 53 1.778 -10.952 -4.700 118 1HE LYS 53 2HE LYS 53 0.918 -12.283 -6.256 119 2HE LYS 53 1HE LYS 53 -0.237 -11.037 -6.728 120 1HZ LYS 53 1HZ LYS 53 2.527 -10.812 -7.679 121 2HZ LYS 53 2HZ LYS 53 1.090 -10.319 -8.422 122 3HZ LYS 53 3HZ LYS 53 1.518 -11.955 -8.414 123 H LYS 54 H LYS 54 3.289 -8.894 -1.354 124 HA LYS 54 HA LYS 54 2.219 -7.187 0.728 125 1HB LYS 54 2HB LYS 54 4.406 -9.019 0.537 126 2HB LYS 54 1HB LYS 54 5.043 -7.431 0.941 127 1HG LYS 54 2HG LYS 54 4.574 -7.965 3.047 128 2HG LYS 54 1HG LYS 54 2.892 -7.641 2.620 129 1HD LYS 54 2HD LYS 54 3.258 -10.228 1.758 130 2HD LYS 54 1HD LYS 54 4.220 -10.167 3.236 131 1HE LYS 54 2HE LYS 54 1.764 -8.839 3.741 132 2HE LYS 54 1HE LYS 54 1.395 -10.372 2.952 133 1HZ LYS 54 1HZ LYS 54 3.215 -11.155 4.725 134 2HZ LYS 54 2HZ LYS 54 1.554 -11.139 5.046 135 3HZ LYS 54 3HZ LYS 54 2.528 -9.862 5.576 136 H VAL 55 H VAL 55 2.240 -5.108 0.561 137 HA VAL 55 HA VAL 55 4.269 -3.797 -1.124 138 HB VAL 55 HB VAL 55 2.596 -2.069 -1.716 139 1HG1 VAL 55 1HG1 VAL 55 3.112 -4.235 -3.064 140 2HG1 VAL 55 2HG1 VAL 55 1.792 -3.166 -3.545 141 3HG1 VAL 55 3HG1 VAL 55 1.447 -4.648 -2.650 142 1HG2 VAL 55 1HG2 VAL 55 0.974 -2.155 -0.065 143 2HG2 VAL 55 2HG2 VAL 55 0.784 -3.904 -0.204 144 3HG2 VAL 55 3HG2 VAL 55 0.162 -2.848 -1.472 145 H ARG 56 H ARG 56 4.860 -1.716 -0.537 146 HA ARG 56 HA ARG 56 4.282 -1.006 2.252 147 1HB ARG 56 2HB ARG 56 6.693 -1.421 1.595 148 2HB ARG 56 1HB ARG 56 6.574 -0.024 0.534 149 1HG ARG 56 2HG ARG 56 7.584 0.775 2.483 150 2HG ARG 56 1HG ARG 56 5.901 1.292 2.602 151 1HD ARG 56 2HD ARG 56 5.517 -0.841 3.943 152 2HD ARG 56 1HD ARG 56 7.274 -0.957 4.046 153 HE ARG 56 HE ARG 56 6.221 1.588 4.875 154 1HH1 ARG 56 1HH1 ARG 56 7.016 -1.655 5.890 155 2HH1 ARG 56 2HH1 ARG 56 7.187 -1.225 7.558 156 1HH2 ARG 56 1HH2 ARG 56 6.445 2.155 7.069 157 2HH2 ARG 56 2HH2 ARG 56 6.862 0.939 8.228 158 H PHE 57 H PHE 57 2.606 0.383 2.232 159 HA PHE 57 HA PHE 57 2.257 2.150 -0.031 160 1HB PHE 57 2HB PHE 57 0.586 1.531 2.392 161 2HB PHE 57 1HB PHE 57 0.165 2.825 1.279 162 HD1 PHE 57 1HD PHE 57 1.415 0.904 -1.082 163 HD2 PHE 57 2HD PHE 57 -1.659 0.616 1.856 164 HE1 PHE 57 1HE PHE 57 0.213 -0.685 -2.499 165 HE2 PHE 57 2HE PHE 57 -2.858 -0.992 0.437 166 HZ PHE 57 HZ PHE 57 -1.926 -1.644 -1.745 167 H TYR 58 H TYR 58 2.750 4.157 -0.150 168 HA TYR 58 HA TYR 58 3.550 5.644 2.259 169 1HB TYR 58 2HB TYR 58 4.519 6.137 -0.545 170 2HB TYR 58 1HB TYR 58 5.091 6.907 0.917 171 HD1 TYR 58 1HD TYR 58 7.052 6.145 1.859 172 HD2 TYR 58 2HD TYR 58 4.780 3.476 -0.550 173 HE1 TYR 58 1HE TYR 58 8.814 4.447 2.090 174 HE2 TYR 58 2HE TYR 58 6.535 1.770 -0.325 175 HH TYR 58 HH TYR 58 8.433 1.198 0.742 176 H ARG 59 H ARG 59 2.887 7.775 2.417 177 HA ARG 59 HA ARG 59 0.546 8.406 0.779 178 1HB ARG 59 2HB ARG 59 1.426 9.056 3.522 179 2HB ARG 59 1HB ARG 59 0.618 10.366 2.670 180 1HG ARG 59 2HG ARG 59 -1.385 9.271 2.597 181 2HG ARG 59 1HG ARG 59 -0.639 7.672 2.653 182 1HD ARG 59 2HD ARG 59 -1.852 8.296 4.734 183 2HD ARG 59 1HD ARG 59 -0.150 7.911 4.985 184 HE ARG 59 HE ARG 59 -0.544 10.701 4.596 185 1HH1 ARG 59 1HH1 ARG 59 -0.828 8.152 6.962 186 2HH1 ARG 59 2HH1 ARG 59 -0.648 9.217 8.316 187 1HH2 ARG 59 1HH2 ARG 59 -0.310 12.106 6.377 188 2HH2 ARG 59 2HH2 ARG 59 -0.355 11.460 7.984 189 H ASN 60 H ASN 60 0.821 9.653 -0.899 190 HA ASN 60 HA ASN 60 3.048 10.916 -1.778 191 1HB ASN 60 2HB ASN 60 1.146 10.639 -3.203 192 2HB ASN 60 1HB ASN 60 0.160 11.678 -2.193 193 1HD2 ASN 60 1HD2 ASN 60 0.051 12.304 -4.675 194 2HD2 ASN 60 2HD2 ASN 60 1.016 13.675 -5.075 195 H GLY 61 H GLY 61 4.273 12.496 -1.078 196 1HA GLY 61 2HA GLY 61 4.947 14.474 -0.112 197 2HA GLY 61 1HA GLY 61 3.272 14.998 -0.181 198 H ASP 62 H ASP 62 4.932 12.374 1.569 199 HA ASP 62 HA ASP 62 3.571 13.259 4.004 200 1HB ASP 62 2HB ASP 62 4.320 11.014 4.899 201 2HB ASP 62 1HB ASP 62 3.162 10.955 3.575 202 H ARG 63 H ARG 63 6.786 12.060 3.018 203 HA ARG 63 HA ARG 63 8.876 12.586 3.716 204 1HB ARG 63 2HB ARG 63 7.318 15.026 4.095 205 2HB ARG 63 1HB ARG 63 8.721 14.934 5.153 206 1HG ARG 63 2HG ARG 63 10.190 15.129 3.447 207 2HG ARG 63 1HG ARG 63 9.157 14.248 2.317 208 1HD ARG 63 2HD ARG 63 9.095 16.407 1.478 209 2HD ARG 63 1HD ARG 63 7.634 16.334 2.461 210 HE ARG 63 HE ARG 63 9.500 17.310 4.169 211 1HH1 ARG 63 1HH1 ARG 63 8.425 18.251 0.985 212 2HH1 ARG 63 2HH1 ARG 63 8.766 19.931 1.229 213 1HH2 ARG 63 1HH2 ARG 63 9.948 19.520 4.493 214 2HH2 ARG 63 2HH2 ARG 63 9.630 20.652 3.220 215 H TYR 64 H TYR 64 6.970 13.962 6.398 216 HA TYR 64 HA TYR 64 8.646 12.981 8.415 217 1HB TYR 64 2HB TYR 64 5.805 13.964 8.401 218 2HB TYR 64 1HB TYR 64 6.548 13.365 9.880 219 HD1 TYR 64 1HD TYR 64 7.562 14.909 11.262 220 HD2 TYR 64 2HD TYR 64 7.307 15.750 7.099 221 HE1 TYR 64 1HE TYR 64 8.575 17.115 11.651 222 HE2 TYR 64 2HE TYR 64 8.320 17.956 7.476 223 HH TYR 64 HH TYR 64 9.769 19.056 9.155 224 H PHE 65 H PHE 65 5.935 11.532 6.765 225 HA PHE 65 HA PHE 65 5.630 9.353 8.609 226 1HB PHE 65 2HB PHE 65 3.890 10.370 6.939 227 2HB PHE 65 1HB PHE 65 4.653 9.303 5.767 228 HD1 PHE 65 1HD PHE 65 3.144 7.628 5.321 229 HD2 PHE 65 2HD PHE 65 3.839 8.757 9.365 230 HE1 PHE 65 1HE PHE 65 1.739 5.758 6.077 231 HE2 PHE 65 2HE PHE 65 2.433 6.888 10.131 232 HZ PHE 65 HZ PHE 65 1.380 5.383 8.486 233 H LYS 66 H LYS 66 5.430 7.231 6.644 234 HA LYS 66 HA LYS 66 7.980 6.948 5.367 235 1HB LYS 66 2HB LYS 66 7.383 5.585 7.964 236 2HB LYS 66 1HB LYS 66 8.343 4.743 6.755 237 1HG LYS 66 2HG LYS 66 9.340 7.402 7.056 238 2HG LYS 66 1HG LYS 66 9.197 6.648 8.644 239 1HD LYS 66 2HD LYS 66 10.922 5.276 8.253 240 2HD LYS 66 1HD LYS 66 10.321 4.852 6.648 241 1HE LYS 66 2HE LYS 66 11.494 6.530 5.614 242 2HE LYS 66 1HE LYS 66 11.519 7.546 7.054 243 1HZ LYS 66 1HZ LYS 66 12.972 5.437 7.848 244 2HZ LYS 66 2HZ LYS 66 13.629 6.852 7.193 245 3HZ LYS 66 3HZ LYS 66 13.377 5.501 6.206 246 H GLY 67 H GLY 67 4.997 5.423 6.505 247 1HA GLY 67 2HA GLY 67 3.633 4.650 4.518 248 2HA GLY 67 1HA GLY 67 5.056 3.710 4.103 249 H ILE 68 H ILE 68 2.460 2.668 4.508 250 HA ILE 68 HA ILE 68 2.933 0.997 6.887 251 HB ILE 68 HB ILE 68 1.015 2.437 7.299 252 1HG1 ILE 68 2HG1 ILE 68 0.110 -0.388 6.710 253 2HG1 ILE 68 1HG1 ILE 68 1.003 0.107 8.145 254 1HG2 ILE 68 1HG2 ILE 68 -0.658 1.214 5.194 255 2HG2 ILE 68 2HG2 ILE 68 0.522 2.416 4.674 256 3HG2 ILE 68 3HG2 ILE 68 -0.698 2.843 5.878 257 1HD1 ILE 68 1HD1 ILE 68 -1.267 1.787 7.895 258 2HD1 ILE 68 2HD1 ILE 68 -0.893 0.609 9.154 259 3HD1 ILE 68 3HD1 ILE 68 -1.787 0.111 7.718 260 H VAL 69 H VAL 69 2.753 -1.193 6.627 261 HA VAL 69 HA VAL 69 2.766 -2.157 3.899 262 HB VAL 69 HB VAL 69 3.045 -3.828 6.391 263 1HG1 VAL 69 1HG1 VAL 69 4.634 -4.963 4.545 264 2HG1 VAL 69 2HG1 VAL 69 3.406 -4.260 3.493 265 3HG1 VAL 69 3HG1 VAL 69 2.937 -5.392 4.761 266 1HG2 VAL 69 1HG2 VAL 69 4.633 -1.859 6.297 267 2HG2 VAL 69 2HG2 VAL 69 5.319 -2.599 4.851 268 3HG2 VAL 69 3HG2 VAL 69 5.379 -3.454 6.393 269 H TYR 70 H TYR 70 1.255 -3.310 2.890 270 HA TYR 70 HA TYR 70 -0.983 -4.414 4.393 271 1HB TYR 70 2HB TYR 70 -1.124 -2.178 2.538 272 2HB TYR 70 1HB TYR 70 -2.155 -3.513 2.036 273 HD1 TYR 70 1HD TYR 70 -1.293 -1.892 5.306 274 HD2 TYR 70 2HD TYR 70 -4.329 -3.280 2.670 275 HE1 TYR 70 1HE TYR 70 -3.005 -1.230 6.939 276 HE2 TYR 70 2HE TYR 70 -6.052 -2.615 4.292 277 HH TYR 70 HH TYR 70 -6.292 -2.177 6.642 278 H ALA 71 H ALA 71 -1.878 -6.206 3.555 279 HA ALA 71 HA ALA 71 -0.440 -7.471 1.333 280 1HB ALA 71 1HB ALA 71 -2.178 -8.701 3.470 281 2HB ALA 71 2HB ALA 71 -0.417 -8.753 3.393 282 3HB ALA 71 3HB ALA 71 -1.379 -9.584 2.170 283 H VAL 72 H VAL 72 -1.412 -7.362 -0.562 284 HA VAL 72 HA VAL 72 -4.280 -6.935 -0.689 285 HB VAL 72 HB VAL 72 -2.516 -6.877 -3.104 286 1HG1 VAL 72 1HG1 VAL 72 -5.056 -5.524 -2.236 287 2HG1 VAL 72 2HG1 VAL 72 -4.820 -6.653 -3.570 288 3HG1 VAL 72 3HG1 VAL 72 -4.150 -5.025 -3.664 289 1HG2 VAL 72 1HG2 VAL 72 -2.475 -4.983 -0.824 290 2HG2 VAL 72 2HG2 VAL 72 -2.489 -4.289 -2.445 291 3HG2 VAL 72 3HG2 VAL 72 -1.204 -5.401 -1.973 292 H SER 73 H SER 73 -5.586 -8.473 -1.125 293 HA SER 73 HA SER 73 -4.958 -10.580 -3.003 294 1HB SER 73 2HB SER 73 -5.928 -12.193 -1.055 295 2HB SER 73 1HB SER 73 -4.205 -11.940 -1.337 296 HG SER 73 HG SER 73 -4.144 -10.499 0.332 297 H SER 74 H SER 74 -6.812 -11.764 -3.687 298 HA SER 74 HA SER 74 -9.151 -10.222 -3.889 299 1HB SER 74 2HB SER 74 -10.132 -12.397 -4.824 300 2HB SER 74 1HB SER 74 -8.723 -11.735 -5.651 301 HG SER 74 HG SER 74 -8.027 -13.716 -5.358 302 H ASP 75 H ASP 75 -8.106 -12.279 -1.377 303 HA ASP 75 HA ASP 75 -10.727 -13.025 -0.468 304 1HB ASP 75 2HB ASP 75 -7.962 -13.665 0.162 305 2HB ASP 75 1HB ASP 75 -8.932 -13.445 1.607 306 H ARG 76 H ARG 76 -8.417 -10.482 0.150 307 HA ARG 76 HA ARG 76 -9.925 -9.551 2.470 308 1HB ARG 76 2HB ARG 76 -7.299 -8.719 1.251 309 2HB ARG 76 1HB ARG 76 -8.077 -7.789 2.523 310 1HG ARG 76 2HG ARG 76 -8.038 -9.815 3.955 311 2HG ARG 76 1HG ARG 76 -7.121 -10.638 2.691 312 1HD ARG 76 2HD ARG 76 -5.215 -9.586 3.229 313 2HD ARG 76 1HD ARG 76 -6.024 -8.036 3.454 314 HE ARG 76 HE ARG 76 -5.390 -9.972 5.481 315 1HH1 ARG 76 1HH1 ARG 76 -7.473 -7.309 4.618 316 2HH1 ARG 76 2HH1 ARG 76 -7.830 -6.893 6.261 317 1HH2 ARG 76 1HH2 ARG 76 -5.860 -9.427 7.642 318 2HH2 ARG 76 2HH2 ARG 76 -6.916 -8.097 7.978 319 H PHE 77 H PHE 77 -9.101 -8.555 -0.814 320 HA PHE 77 HA PHE 77 -11.206 -6.512 -0.634 321 1HB PHE 77 2HB PHE 77 -8.744 -6.084 -2.306 322 2HB PHE 77 1HB PHE 77 -9.913 -4.896 -1.741 323 HD1 PHE 77 1HD PHE 77 -9.928 -4.246 0.667 324 HD2 PHE 77 2HD PHE 77 -6.847 -6.640 -1.028 325 HE1 PHE 77 1HE PHE 77 -8.477 -3.730 2.586 326 HE2 PHE 77 2HE PHE 77 -5.389 -6.128 0.887 327 HZ PHE 77 HZ PHE 77 -6.204 -4.671 2.697 328 H ARG 78 H ARG 78 -12.754 -6.858 -2.064 329 HA ARG 78 HA ARG 78 -12.603 -8.846 -4.052 330 1HB ARG 78 2HB ARG 78 -14.570 -7.009 -2.958 331 2HB ARG 78 1HB ARG 78 -14.756 -7.215 -4.687 332 1HG ARG 78 2HG ARG 78 -14.349 -9.734 -3.297 333 2HG ARG 78 1HG ARG 78 -15.775 -8.857 -2.737 334 1HD ARG 78 2HD ARG 78 -15.587 -8.787 -5.613 335 2HD ARG 78 1HD ARG 78 -15.549 -10.449 -5.023 336 HE ARG 78 HE ARG 78 -17.613 -9.376 -3.658 337 1HH1 ARG 78 1HH1 ARG 78 -16.798 -9.437 -7.051 338 2HH1 ARG 78 2HH1 ARG 78 -18.448 -9.397 -7.576 339 1HH2 ARG 78 1HH2 ARG 78 -19.783 -9.324 -4.346 340 2HH2 ARG 78 2HH2 ARG 78 -20.142 -9.331 -6.041 341 H SER 79 H SER 79 -11.804 -5.489 -4.035 342 HA SER 79 HA SER 79 -10.751 -5.643 -6.690 343 1HB SER 79 2HB SER 79 -13.416 -4.941 -6.584 344 2HB SER 79 1HB SER 79 -12.607 -3.376 -6.622 345 HG SER 79 HG SER 79 -11.379 -4.344 -8.450 346 H PHE 80 H PHE 80 -9.927 -3.388 -7.381 347 HA PHE 80 HA PHE 80 -8.156 -2.462 -5.420 348 1HB PHE 80 2HB PHE 80 -8.414 -2.134 -8.142 349 2HB PHE 80 1HB PHE 80 -8.751 -0.516 -7.534 350 HD1 PHE 80 1HD PHE 80 -6.256 -3.214 -7.659 351 HD2 PHE 80 2HD PHE 80 -7.016 0.840 -6.609 352 HE1 PHE 80 1HE PHE 80 -3.843 -2.829 -7.408 353 HE2 PHE 80 2HE PHE 80 -4.606 1.230 -6.358 354 HZ PHE 80 HZ PHE 80 -3.012 -0.604 -6.756 355 H ASP 81 H ASP 81 -11.343 -1.361 -6.376 356 HA ASP 81 HA ASP 81 -11.325 1.145 -5.108 357 1HB ASP 81 2HB ASP 81 -13.346 -0.677 -6.218 358 2HB ASP 81 1HB ASP 81 -13.941 0.333 -4.904 359 H ALA 82 H ALA 82 -12.114 -2.087 -3.946 360 HA ALA 82 HA ALA 82 -13.000 -1.281 -1.369 361 1HB ALA 82 1HB ALA 82 -13.615 -3.404 -1.308 362 2HB ALA 82 2HB ALA 82 -11.924 -3.902 -1.271 363 3HB ALA 82 3HB ALA 82 -12.751 -3.700 -2.816 364 H LEU 83 H LEU 83 -9.891 -2.100 -2.762 365 HA LEU 83 HA LEU 83 -8.441 -2.339 -0.344 366 1HB LEU 83 2HB LEU 83 -7.633 -3.080 -2.587 367 2HB LEU 83 1HB LEU 83 -7.458 -1.400 -3.044 368 HG LEU 83 HG LEU 83 -5.792 -1.119 -1.218 369 1HD1 LEU 83 1HD1 LEU 83 -6.666 -3.090 0.099 370 2HD1 LEU 83 2HD1 LEU 83 -4.913 -2.960 -0.037 371 3HD1 LEU 83 3HD1 LEU 83 -5.792 -4.117 -1.037 372 1HD2 LEU 83 1HD2 LEU 83 -5.448 -2.086 -3.731 373 2HD2 LEU 83 2HD2 LEU 83 -4.650 -3.329 -2.767 374 3HD2 LEU 83 3HD2 LEU 83 -4.137 -1.647 -2.636 375 H LEU 84 H LEU 84 -9.020 0.302 -2.597 376 HA LEU 84 HA LEU 84 -7.591 2.297 -1.248 377 1HB LEU 84 2HB LEU 84 -9.870 2.310 -3.192 378 2HB LEU 84 1HB LEU 84 -9.380 3.812 -2.427 379 HG LEU 84 HG LEU 84 -7.465 2.056 -3.953 380 1HD1 LEU 84 1HD1 LEU 84 -8.836 2.640 -5.684 381 2HD1 LEU 84 2HD1 LEU 84 -7.786 4.056 -5.635 382 3HD1 LEU 84 3HD1 LEU 84 -9.386 4.119 -4.898 383 1HD2 LEU 84 1HD2 LEU 84 -6.134 4.122 -4.027 384 2HD2 LEU 84 2HD2 LEU 84 -6.430 3.577 -2.374 385 3HD2 LEU 84 3HD2 LEU 84 -7.353 4.927 -3.038 386 H ALA 85 H ALA 85 -10.865 1.030 -0.820 387 HA ALA 85 HA ALA 85 -11.790 3.050 0.946 388 1HB ALA 85 1HB ALA 85 -12.608 0.149 0.903 389 2HB ALA 85 2HB ALA 85 -13.223 1.368 -0.214 390 3HB ALA 85 3HB ALA 85 -13.544 1.513 1.514 391 H ASP 86 H ASP 86 -10.220 -0.073 1.476 392 HA ASP 86 HA ASP 86 -10.180 0.139 4.319 393 1HB ASP 86 2HB ASP 86 -9.743 -1.902 2.534 394 2HB ASP 86 1HB ASP 86 -8.108 -1.544 3.080 395 H LEU 87 H LEU 87 -8.060 1.014 1.696 396 HA LEU 87 HA LEU 87 -5.718 1.539 3.159 397 1HB LEU 87 2HB LEU 87 -6.796 2.679 0.581 398 2HB LEU 87 1HB LEU 87 -5.230 3.133 1.214 399 HG LEU 87 HG LEU 87 -6.001 0.799 -0.322 400 1HD1 LEU 87 1HD1 LEU 87 -4.195 2.488 -0.775 401 2HD1 LEU 87 2HD1 LEU 87 -3.724 0.796 -0.934 402 3HD1 LEU 87 3HD1 LEU 87 -3.262 1.710 0.502 403 1HD2 LEU 87 1HD2 LEU 87 -5.959 -0.242 1.951 404 2HD2 LEU 87 2HD2 LEU 87 -4.269 0.246 2.081 405 3HD2 LEU 87 3HD2 LEU 87 -4.765 -0.891 0.828 406 H THR 88 H THR 88 -8.504 3.564 2.378 407 HA THR 88 HA THR 88 -7.510 5.976 3.414 408 HB THR 88 HB THR 88 -10.347 5.713 3.890 409 HG1 THR 88 1HG THR 88 -10.931 5.184 1.743 410 1HG2 THR 88 1HG2 THR 88 -8.710 7.646 2.925 411 2HG2 THR 88 2HG2 THR 88 -10.470 7.659 2.809 412 3HG2 THR 88 3HG2 THR 88 -9.502 7.082 1.453 413 H ARG 89 H ARG 89 -9.138 3.239 4.880 414 HA ARG 89 HA ARG 89 -9.502 4.385 7.443 415 1HB ARG 89 2HB ARG 89 -9.731 1.683 6.246 416 2HB ARG 89 1HB ARG 89 -9.518 1.757 7.990 417 1HG ARG 89 2HG ARG 89 -11.539 2.800 8.332 418 2HG ARG 89 1HG ARG 89 -11.595 3.460 6.696 419 1HD ARG 89 2HD ARG 89 -12.288 1.445 5.771 420 2HD ARG 89 1HD ARG 89 -11.703 0.502 7.143 421 HE ARG 89 HE ARG 89 -13.654 2.019 8.234 422 1HH1 ARG 89 1HH1 ARG 89 -13.550 -0.067 5.439 423 2HH1 ARG 89 2HH1 ARG 89 -15.223 -0.501 5.544 424 1HH2 ARG 89 1HH2 ARG 89 -15.855 1.451 8.375 425 2HH2 ARG 89 2HH2 ARG 89 -16.533 0.361 7.211 426 H SER 90 H SER 90 -6.972 2.212 6.128 427 HA SER 90 HA SER 90 -5.599 2.085 8.639 428 1HB SER 90 2HB SER 90 -5.490 0.665 6.247 429 2HB SER 90 1HB SER 90 -3.922 1.470 6.352 430 HG SER 90 HG SER 90 -3.651 0.551 8.405 431 H LEU 91 H LEU 91 -5.190 3.992 5.697 432 HA LEU 91 HA LEU 91 -2.852 5.282 6.823 433 1HB LEU 91 2HB LEU 91 -4.011 4.887 4.169 434 2HB LEU 91 1HB LEU 91 -3.375 6.490 4.423 435 HG LEU 91 HG LEU 91 -1.905 3.873 4.503 436 1HD1 LEU 91 1HD1 LEU 91 -0.464 5.737 3.072 437 2HD1 LEU 91 2HD1 LEU 91 -2.141 6.096 2.660 438 3HD1 LEU 91 3HD1 LEU 91 -1.498 4.473 2.408 439 1HD2 LEU 91 1HD2 LEU 91 -0.867 4.785 6.315 440 2HD2 LEU 91 2HD2 LEU 91 -1.210 6.444 5.821 441 3HD2 LEU 91 3HD2 LEU 91 0.077 5.536 5.027 442 H SER 92 H SER 92 -6.104 5.664 7.098 443 HA SER 92 HA SER 92 -6.986 8.116 6.586 444 1HB SER 92 2HB SER 92 -7.994 8.097 8.988 445 2HB SER 92 1HB SER 92 -8.451 6.829 7.853 446 HG SER 92 HG SER 92 -7.002 5.447 8.859 447 H ASP 93 H ASP 93 -6.378 10.128 6.827 448 HA ASP 93 HA ASP 93 -5.060 11.067 9.212 449 1HB ASP 93 2HB ASP 93 -3.559 10.455 6.786 450 2HB ASP 93 1HB ASP 93 -3.364 12.132 7.278 451 H ASN 94 H ASN 94 -4.155 13.520 8.221 452 HA ASN 94 HA ASN 94 -6.137 14.770 6.587 453 1HB ASN 94 2HB ASN 94 -7.015 16.295 8.342 454 2HB ASN 94 1HB ASN 94 -7.479 14.615 8.595 455 1HD2 ASN 94 1HD2 ASN 94 -6.778 13.548 10.383 456 2HD2 ASN 94 2HD2 ASN 94 -5.890 14.298 11.661 457 H ILE 95 H ILE 95 -3.234 14.511 6.837 458 HA ILE 95 HA ILE 95 -2.531 17.359 7.023 459 HB ILE 95 HB ILE 95 -0.986 14.913 7.850 460 1HG1 ILE 95 2HG1 ILE 95 -0.530 16.884 9.689 461 2HG1 ILE 95 1HG1 ILE 95 -2.157 17.283 9.145 462 1HG2 ILE 95 1HG2 ILE 95 0.706 15.873 6.662 463 2HG2 ILE 95 2HG2 ILE 95 0.896 16.704 8.206 464 3HG2 ILE 95 3HG2 ILE 95 0.078 17.506 6.865 465 1HD1 ILE 95 1HD1 ILE 95 -3.036 15.281 9.913 466 2HD1 ILE 95 2HD1 ILE 95 -1.872 15.724 11.161 467 3HD1 ILE 95 3HD1 ILE 95 -1.458 14.495 9.966 468 H ASN 96 H ASN 96 -1.399 14.276 5.632 469 HA ASN 96 HA ASN 96 -0.427 15.688 3.272 470 1HB ASN 96 2HB ASN 96 -0.164 12.756 3.964 471 2HB ASN 96 1HB ASN 96 0.730 13.643 2.736 472 1HD2 ASN 96 1HD2 ASN 96 1.374 12.150 5.339 473 2HD2 ASN 96 2HD2 ASN 96 2.461 13.220 6.150 474 H LEU 97 H LEU 97 -2.892 13.441 4.301 475 HA LEU 97 HA LEU 97 -3.857 13.200 1.534 476 1HB LEU 97 2HB LEU 97 -3.986 11.445 3.922 477 2HB LEU 97 1HB LEU 97 -5.375 11.428 2.854 478 HG LEU 97 HG LEU 97 -2.533 10.812 2.043 479 1HD1 LEU 97 1HD1 LEU 97 -3.357 9.022 3.370 480 2HD1 LEU 97 2HD1 LEU 97 -3.492 8.522 1.684 481 3HD1 LEU 97 3HD1 LEU 97 -4.923 9.060 2.562 482 1HD2 LEU 97 1HD2 LEU 97 -4.609 9.985 0.216 483 2HD2 LEU 97 2HD2 LEU 97 -3.161 10.943 -0.086 484 3HD2 LEU 97 3HD2 LEU 97 -4.640 11.729 0.468 485 HA PRO 98 HA PRO 98 -6.675 16.528 2.974 486 1HB PRO 98 2HB PRO 98 -7.650 15.722 0.252 487 2HB PRO 98 1HB PRO 98 -7.519 17.329 0.961 488 1HG PRO 98 2HG PRO 98 -5.683 16.479 -0.750 489 2HG PRO 98 1HG PRO 98 -5.209 17.407 0.685 490 1HD PRO 98 2HD PRO 98 -4.905 14.503 0.124 491 2HD PRO 98 1HD PRO 98 -3.896 15.575 1.115 492 H GLN 99 H GLN 99 -8.183 14.119 0.844 493 HA GLN 99 HA GLN 99 -10.327 13.803 2.812 494 1HB GLN 99 2HB GLN 99 -10.127 13.144 -0.124 495 2HB GLN 99 1HB GLN 99 -11.466 12.595 0.874 496 1HG GLN 99 2HG GLN 99 -12.171 14.820 1.301 497 2HG GLN 99 1HG GLN 99 -10.702 15.487 0.592 498 1HE2 GLN 99 1HE2 GLN 99 -10.413 14.291 -1.737 499 2HE2 GLN 99 2HE2 GLN 99 -11.776 14.548 -2.768 500 H GLY 100 H GLY 100 -7.817 12.000 1.163 501 1HA GLY 100 2HA GLY 100 -7.118 10.124 2.792 502 2HA GLY 100 1HA GLY 100 -8.725 9.522 2.402 503 H VAL 101 H VAL 101 -7.089 7.752 1.792 504 HA VAL 101 HA VAL 101 -5.662 7.998 -0.657 505 HB VAL 101 HB VAL 101 -6.658 5.432 0.588 506 1HG1 VAL 101 1HG1 VAL 101 -5.051 4.332 -0.680 507 2HG1 VAL 101 2HG1 VAL 101 -4.137 5.809 -0.982 508 3HG1 VAL 101 3HG1 VAL 101 -5.678 5.546 -1.794 509 1HG2 VAL 101 1HG2 VAL 101 -4.947 5.416 2.094 510 2HG2 VAL 101 2HG2 VAL 101 -5.215 7.156 2.004 511 3HG2 VAL 101 3HG2 VAL 101 -3.902 6.418 1.087 512 H ARG 102 H ARG 102 -6.781 8.597 -2.381 513 HA ARG 102 HA ARG 102 -9.308 7.273 -3.004 514 1HB ARG 102 2HB ARG 102 -8.195 9.901 -3.490 515 2HB ARG 102 1HB ARG 102 -8.803 9.181 -4.973 516 1HG ARG 102 2HG ARG 102 -10.492 9.096 -2.528 517 2HG ARG 102 1HG ARG 102 -10.360 10.602 -3.441 518 1HD ARG 102 2HD ARG 102 -12.205 8.785 -3.992 519 2HD ARG 102 1HD ARG 102 -11.462 9.770 -5.246 520 HE ARG 102 HE ARG 102 -9.893 7.759 -5.528 521 1HH1 ARG 102 1HH1 ARG 102 -13.240 7.476 -4.518 522 2HH1 ARG 102 2HH1 ARG 102 -13.409 5.870 -5.139 523 1HH2 ARG 102 1HH2 ARG 102 -10.137 5.658 -6.337 524 2HH2 ARG 102 2HH2 ARG 102 -11.654 4.840 -6.170 525 H TYR 103 H TYR 103 -6.079 7.797 -4.299 526 HA TYR 103 HA TYR 103 -6.550 5.542 -6.091 527 1HB TYR 103 2HB TYR 103 -5.606 8.260 -7.006 528 2HB TYR 103 1HB TYR 103 -5.435 6.803 -7.952 529 HD1 TYR 103 1HD TYR 103 -7.827 9.236 -6.642 530 HD2 TYR 103 2HD TYR 103 -7.308 5.748 -9.019 531 HE1 TYR 103 1HE TYR 103 -10.087 9.535 -7.563 532 HE2 TYR 103 2HE TYR 103 -9.560 6.035 -9.951 533 HH TYR 103 HH TYR 103 -11.766 7.204 -9.111 534 H ILE 104 H ILE 104 -4.739 4.373 -6.644 535 HA ILE 104 HA ILE 104 -2.387 4.938 -4.991 536 HB ILE 104 HB ILE 104 -3.067 2.378 -6.434 537 1HG1 ILE 104 2HG1 ILE 104 -3.682 3.319 -3.635 538 2HG1 ILE 104 1HG1 ILE 104 -4.800 2.691 -4.841 539 1HG2 ILE 104 1HG2 ILE 104 -1.180 2.785 -4.132 540 2HG2 ILE 104 2HG2 ILE 104 -0.667 2.871 -5.818 541 3HG2 ILE 104 3HG2 ILE 104 -1.343 1.373 -5.178 542 1HD1 ILE 104 1HD1 ILE 104 -3.532 0.495 -4.631 543 2HD1 ILE 104 2HD1 ILE 104 -4.554 0.973 -3.275 544 3HD1 ILE 104 3HD1 ILE 104 -2.806 1.190 -3.183 545 H TYR 105 H TYR 105 -0.618 5.687 -5.898 546 HA TYR 105 HA TYR 105 -0.313 5.495 -8.793 547 1HB TYR 105 2HB TYR 105 0.120 7.611 -6.864 548 2HB TYR 105 1HB TYR 105 1.524 7.357 -7.902 549 HD1 TYR 105 1HD TYR 105 -1.871 8.570 -7.723 550 HD2 TYR 105 2HD TYR 105 1.280 7.466 -10.342 551 HE1 TYR 105 1HE TYR 105 -2.997 9.738 -9.554 552 HE2 TYR 105 2HE TYR 105 0.179 8.625 -12.182 553 HH TYR 105 HH TYR 105 -2.464 10.754 -11.707 554 H THR 106 H THR 106 1.900 5.481 -9.638 555 HA THR 106 HA THR 106 3.332 3.266 -8.524 556 HB THR 106 HB THR 106 5.048 4.051 -10.350 557 HG1 THR 106 1HG THR 106 4.150 5.372 -11.893 558 1HG2 THR 106 1HG2 THR 106 2.995 3.363 -12.066 559 2HG2 THR 106 2HG2 THR 106 2.572 2.578 -10.544 560 3HG2 THR 106 3HG2 THR 106 4.138 2.266 -11.293 561 H ILE 107 H ILE 107 5.565 3.286 -7.852 562 HA ILE 107 HA ILE 107 6.170 4.955 -5.785 563 HB ILE 107 HB ILE 107 7.381 2.853 -6.357 564 1HG1 ILE 107 2HG1 ILE 107 9.590 3.645 -5.522 565 2HG1 ILE 107 1HG1 ILE 107 9.064 5.303 -5.792 566 1HG2 ILE 107 1HG2 ILE 107 7.763 3.503 -8.755 567 2HG2 ILE 107 2HG2 ILE 107 9.159 2.818 -7.922 568 3HG2 ILE 107 3HG2 ILE 107 9.055 4.559 -8.182 569 1HD1 ILE 107 1HD1 ILE 107 8.894 4.200 -3.428 570 2HD1 ILE 107 2HD1 ILE 107 7.396 3.532 -4.080 571 3HD1 ILE 107 3HD1 ILE 107 7.629 5.280 -4.013 572 H ASP 108 H ASP 108 6.567 5.604 -9.177 573 HA ASP 108 HA ASP 108 8.115 8.024 -8.635 574 1HB ASP 108 2HB ASP 108 8.229 6.188 -10.696 575 2HB ASP 108 1HB ASP 108 7.349 7.532 -11.417 576 H GLY 109 H GLY 109 4.928 6.959 -9.529 577 1HA GLY 109 2HA GLY 109 2.980 8.245 -9.268 578 2HA GLY 109 1HA GLY 109 3.964 9.699 -9.259 579 H SER 110 H SER 110 4.704 7.528 -11.785 580 HA SER 110 HA SER 110 3.951 9.389 -13.782 581 1HB SER 110 2HB SER 110 4.508 6.479 -14.316 582 2HB SER 110 1HB SER 110 4.857 7.871 -15.339 583 HG SER 110 HG SER 110 6.435 8.501 -13.815 584 H ARG 111 H ARG 111 2.558 6.296 -12.741 585 HA ARG 111 HA ARG 111 0.000 7.112 -13.851 586 1HB ARG 111 2HB ARG 111 -0.235 4.685 -14.711 587 2HB ARG 111 1HB ARG 111 0.691 5.828 -15.674 588 1HG ARG 111 2HG ARG 111 2.681 4.800 -15.240 589 2HG ARG 111 1HG ARG 111 2.147 4.182 -13.676 590 1HD ARG 111 2HD ARG 111 0.532 3.020 -15.718 591 2HD ARG 111 1HD ARG 111 2.226 2.840 -16.169 592 HE ARG 111 HE ARG 111 0.858 1.529 -14.011 593 1HH1 ARG 111 1HH1 ARG 111 3.963 2.595 -15.196 594 2HH1 ARG 111 2HH1 ARG 111 4.855 1.438 -14.267 595 1HH2 ARG 111 1HH2 ARG 111 2.030 0.006 -12.788 596 2HH2 ARG 111 2HH2 ARG 111 3.759 -0.032 -12.899 597 H LYS 112 H LYS 112 -1.759 6.166 -12.846 598 HA LYS 112 HA LYS 112 -1.159 4.995 -10.254 599 1HB LYS 112 2HB LYS 112 -3.161 5.826 -9.456 600 2HB LYS 112 1HB LYS 112 -2.713 7.034 -10.640 601 1HG LYS 112 2HG LYS 112 -4.976 6.715 -11.008 602 2HG LYS 112 1HG LYS 112 -4.211 5.752 -12.269 603 1HD LYS 112 2HD LYS 112 -6.208 4.772 -10.908 604 2HD LYS 112 1HD LYS 112 -4.827 3.745 -11.287 605 1HE LYS 112 2HE LYS 112 -4.102 3.694 -9.115 606 2HE LYS 112 1HE LYS 112 -4.790 5.269 -8.732 607 1HZ LYS 112 1HZ LYS 112 -5.949 2.660 -8.470 608 2HZ LYS 112 2HZ LYS 112 -6.967 3.740 -9.281 609 3HZ LYS 112 3HZ LYS 112 -6.395 4.117 -7.735 610 H ILE 113 H ILE 113 -1.893 3.061 -9.540 611 HA ILE 113 HA ILE 113 -2.434 1.097 -11.565 612 HB ILE 113 HB ILE 113 -2.347 0.758 -8.569 613 1HG1 ILE 113 2HG1 ILE 113 -0.273 1.719 -9.865 614 2HG1 ILE 113 1HG1 ILE 113 -0.061 0.460 -8.654 615 1HG2 ILE 113 1HG2 ILE 113 -3.209 -1.232 -9.169 616 2HG2 ILE 113 2HG2 ILE 113 -1.528 -1.593 -9.561 617 3HG2 ILE 113 3HG2 ILE 113 -2.644 -1.100 -10.835 618 1HD1 ILE 113 1HD1 ILE 113 -0.517 -0.526 -11.372 619 2HD1 ILE 113 2HD1 ILE 113 0.658 -1.032 -10.156 620 3HD1 ILE 113 3HD1 ILE 113 0.971 0.394 -11.149 621 H GLY 114 H GLY 114 -4.360 0.475 -12.229 622 1HA GLY 114 2HA GLY 114 -6.703 1.044 -10.534 623 2HA GLY 114 1HA GLY 114 -6.739 0.874 -12.284 624 H SER 115 H SER 115 -4.752 -1.487 -11.688 625 HA SER 115 HA SER 115 -6.847 -3.443 -11.009 626 1HB SER 115 2HB SER 115 -6.112 -4.903 -12.697 627 2HB SER 115 1HB SER 115 -6.057 -3.317 -13.468 628 HG SER 115 HG SER 115 -3.962 -4.968 -12.624 629 H MET 116 H MET 116 -6.339 -5.029 -9.611 630 HA MET 116 HA MET 116 -4.182 -4.712 -7.843 631 1HB MET 116 2HB MET 116 -6.546 -6.120 -7.848 632 2HB MET 116 1HB MET 116 -5.346 -7.401 -7.939 633 1HG MET 116 2HG MET 116 -5.613 -7.171 -5.677 634 2HG MET 116 1HG MET 116 -4.224 -6.129 -5.976 635 1HE MET 116 1HE MET 116 -8.417 -5.593 -5.709 636 2HE MET 116 2HE MET 116 -8.073 -5.186 -4.027 637 3HE MET 116 3HE MET 116 -7.498 -6.711 -4.702 638 H ASP 117 H ASP 117 -4.523 -6.460 -10.813 639 HA ASP 117 HA ASP 117 -2.520 -8.376 -10.506 640 1HB ASP 117 2HB ASP 117 -4.159 -7.273 -12.635 641 2HB ASP 117 1HB ASP 117 -2.551 -7.691 -13.195 642 H GLU 118 H GLU 118 -2.281 -4.968 -10.839 643 HA GLU 118 HA GLU 118 0.389 -5.059 -11.970 644 1HB GLU 118 2HB GLU 118 -1.463 -2.842 -11.151 645 2HB GLU 118 1HB GLU 118 0.226 -2.524 -11.522 646 1HG GLU 118 2HG GLU 118 -0.047 -3.315 -13.759 647 2HG GLU 118 1HG GLU 118 -1.678 -3.885 -13.410 648 H LEU 119 H LEU 119 -0.981 -5.289 -8.883 649 HA LEU 119 HA LEU 119 1.174 -4.007 -7.457 650 1HB LEU 119 2HB LEU 119 -0.716 -5.931 -6.172 651 2HB LEU 119 1HB LEU 119 0.017 -4.487 -5.506 652 HG LEU 119 HG LEU 119 -2.216 -4.543 -7.535 653 1HD1 LEU 119 1HD1 LEU 119 -3.684 -3.991 -5.812 654 2HD1 LEU 119 2HD1 LEU 119 -2.377 -3.563 -4.708 655 3HD1 LEU 119 3HD1 LEU 119 -2.669 -5.253 -5.114 656 1HD2 LEU 119 1HD2 LEU 119 -2.017 -2.329 -7.785 657 2HD2 LEU 119 2HD2 LEU 119 -0.368 -2.567 -7.211 658 3HD2 LEU 119 3HD2 LEU 119 -1.630 -2.068 -6.085 659 H GLU 120 H GLU 120 3.127 -4.933 -7.449 660 HA GLU 120 HA GLU 120 3.322 -7.853 -7.417 661 1HB GLU 120 2HB GLU 120 5.592 -5.901 -7.742 662 2HB GLU 120 1HB GLU 120 5.553 -7.600 -8.173 663 1HG GLU 120 2HG GLU 120 3.742 -6.984 -9.838 664 2HG GLU 120 1HG GLU 120 4.200 -5.307 -9.543 665 H GLU 121 H GLU 121 4.751 -8.908 -5.927 666 HA GLU 121 HA GLU 121 4.418 -8.157 -3.274 667 1HB GLU 121 2HB GLU 121 6.387 -10.021 -4.576 668 2HB GLU 121 1HB GLU 121 6.340 -9.780 -2.833 669 1HG GLU 121 2HG GLU 121 3.694 -10.284 -3.656 670 2HG GLU 121 1HG GLU 121 4.718 -11.466 -4.470 671 H GLY 122 H GLY 122 6.006 -7.595 -1.663 672 1HA GLY 122 2HA GLY 122 7.385 -5.961 -0.836 673 2HA GLY 122 1HA GLY 122 8.548 -6.720 -1.894 674 H GLU 123 H GLU 123 5.676 -4.866 -2.811 675 HA GLU 123 HA GLU 123 7.406 -3.124 -4.406 676 1HB GLU 123 2HB GLU 123 4.520 -3.862 -4.478 677 2HB GLU 123 1HB GLU 123 4.993 -2.305 -5.141 678 1HG GLU 123 2HG GLU 123 6.410 -4.800 -5.973 679 2HG GLU 123 1HG GLU 123 4.864 -4.357 -6.694 680 H SER 124 H SER 124 6.597 -0.799 -4.613 681 HA SER 124 HA SER 124 5.801 0.273 -1.992 682 1HB SER 124 2HB SER 124 8.048 1.268 -3.760 683 2HB SER 124 1HB SER 124 7.409 2.162 -2.383 684 HG SER 124 HG SER 124 8.819 -0.280 -2.412 685 H TYR 125 H TYR 125 3.941 1.328 -2.244 686 HA TYR 125 HA TYR 125 3.482 2.725 -4.791 687 1HB TYR 125 2HB TYR 125 1.598 1.217 -3.043 688 2HB TYR 125 1HB TYR 125 1.004 2.461 -4.121 689 HD1 TYR 125 1HD TYR 125 1.457 -0.952 -3.896 690 HD2 TYR 125 2HD TYR 125 2.168 2.284 -6.546 691 HE1 TYR 125 1HE TYR 125 1.508 -2.519 -5.785 692 HE2 TYR 125 2HE TYR 125 2.219 0.753 -8.435 693 HH TYR 125 HH TYR 125 1.003 -2.108 -8.534 694 H VAL 126 H VAL 126 2.129 4.545 -4.763 695 HA VAL 126 HA VAL 126 2.381 6.101 -2.259 696 HB VAL 126 HB VAL 126 2.840 6.901 -5.102 697 1HG1 VAL 126 1HG1 VAL 126 2.653 9.301 -4.417 698 2HG1 VAL 126 2HG1 VAL 126 1.847 8.762 -2.944 699 3HG1 VAL 126 3HG1 VAL 126 1.110 8.453 -4.517 700 1HG2 VAL 126 1HG2 VAL 126 4.608 6.377 -3.311 701 2HG2 VAL 126 2HG2 VAL 126 4.173 7.947 -2.635 702 3HG2 VAL 126 3HG2 VAL 126 4.805 7.839 -4.278 703 H CYS 127 H CYS 127 0.640 7.161 -1.480 704 HA CYS 127 HA CYS 127 -1.920 6.563 -2.754 705 1HB CYS 127 2HB CYS 127 -1.267 7.680 -0.021 706 2HB CYS 127 1HB CYS 127 -2.893 7.335 -0.603 707 HG CYS 127 HG CYS 127 -2.286 4.799 -0.613 708 H SER 128 H SER 128 -3.076 8.026 -3.833 709 HA SER 128 HA SER 128 -2.523 10.876 -3.368 710 1HB SER 128 2HB SER 128 -2.918 9.644 -6.103 711 2HB SER 128 1HB SER 128 -2.580 11.341 -5.743 712 HG SER 128 HG SER 128 -0.594 10.431 -4.701 713 H SER 129 H SER 129 -4.220 12.315 -4.052 714 HA SER 129 HA SER 129 -6.814 11.205 -4.671 715 1HB SER 129 2HB SER 129 -6.837 10.942 -2.261 716 2HB SER 129 1HB SER 129 -6.297 12.605 -2.036 717 HG SER 129 HG SER 129 -8.754 11.792 -3.205 718 H ASP 130 H ASP 130 -5.020 14.071 -3.608 719 HA ASP 130 HA ASP 130 -6.069 15.572 -5.857 720 1HB ASP 130 2HB ASP 130 -7.734 15.887 -4.009 721 2HB ASP 130 1HB ASP 130 -6.452 16.616 -3.045 722 H ASN 131 H ASN 131 -3.459 14.572 -4.816 723 HA ASN 131 HA ASN 131 -2.068 17.125 -4.384 724 1HB ASN 131 2HB ASN 131 -0.870 14.381 -4.050 725 2HB ASN 131 1HB ASN 131 -0.286 15.908 -3.397 726 1HD2 ASN 131 1HD2 ASN 131 -2.148 13.158 -2.839 727 2HD2 ASN 131 2HD2 ASN 131 -2.864 13.640 -1.343 728 H PHE 132 H PHE 132 -0.251 17.681 -5.616 729 HA PHE 132 HA PHE 132 -0.287 16.598 -8.315 730 1HB PHE 132 2HB PHE 132 0.180 19.150 -7.188 731 2HB PHE 132 1HB PHE 132 1.680 18.658 -7.966 732 HD1 PHE 132 1HD PHE 132 -1.910 18.149 -8.842 733 HD2 PHE 132 2HD PHE 132 1.875 19.717 -9.990 734 HE1 PHE 132 1HE PHE 132 -2.842 18.786 -11.028 735 HE2 PHE 132 2HE PHE 132 0.950 20.358 -12.177 736 HZ PHE 132 HZ PHE 132 -1.411 19.892 -12.699 737 H PHE 133 H PHE 133 1.075 15.393 -5.763 738 HA PHE 133 HA PHE 133 2.782 13.920 -5.452 739 1HB PHE 133 2HB PHE 133 2.465 13.514 -7.944 740 2HB PHE 133 1HB PHE 133 3.790 14.639 -8.188 741 HD1 PHE 133 1HD PHE 133 2.982 11.594 -6.204 742 HD2 PHE 133 2HD PHE 133 5.916 13.771 -8.384 743 HE1 PHE 133 1HE PHE 133 4.577 9.749 -5.888 744 HE2 PHE 133 2HE PHE 133 7.518 11.930 -8.072 745 HZ PHE 133 HZ PHE 133 6.850 9.915 -6.824 746 H LYS 134 H LYS 134 4.358 14.410 -4.092 747 HA LYS 134 HA LYS 134 5.847 16.901 -4.523 748 1HB LYS 134 2HB LYS 134 5.807 15.263 -1.997 749 2HB LYS 134 1HB LYS 134 6.287 16.943 -2.189 750 1HG LYS 134 2HG LYS 134 3.485 15.969 -2.676 751 2HG LYS 134 1HG LYS 134 4.053 16.561 -1.113 752 1HD LYS 134 2HD LYS 134 3.521 18.612 -1.797 753 2HD LYS 134 1HD LYS 134 4.858 18.502 -2.942 754 1HE LYS 134 2HE LYS 134 2.740 19.142 -4.027 755 2HE LYS 134 1HE LYS 134 3.376 17.616 -4.640 756 1HZ LYS 134 1HZ LYS 134 1.518 17.419 -2.415 757 2HZ LYS 134 2HZ LYS 134 1.653 16.461 -3.803 758 3HZ LYS 134 3HZ LYS 134 0.856 17.951 -3.879 759 H LYS 135 H LYS 135 6.262 13.768 -5.239 760 HA LYS 135 HA LYS 135 8.030 12.284 -5.308 761 1HB LYS 135 2HB LYS 135 9.777 13.109 -6.785 762 2HB LYS 135 1HB LYS 135 8.198 13.652 -7.329 763 1HG LYS 135 2HG LYS 135 9.264 15.638 -5.605 764 2HG LYS 135 1HG LYS 135 10.506 15.191 -6.772 765 1HD LYS 135 2HD LYS 135 8.635 15.427 -8.526 766 2HD LYS 135 1HD LYS 135 7.766 16.306 -7.267 767 1HE LYS 135 2HE LYS 135 9.409 17.989 -7.163 768 2HE LYS 135 1HE LYS 135 10.572 17.020 -8.067 769 1HZ LYS 135 1HZ LYS 135 9.863 18.333 -9.741 770 2HZ LYS 135 2HZ LYS 135 8.357 18.642 -9.034 771 3HZ LYS 135 3HZ LYS 135 8.625 17.184 -9.850 772 H VAL 136 H VAL 136 8.634 11.782 -3.221 773 HA VAL 136 HA VAL 136 10.948 13.285 -2.179 774 HB VAL 136 HB VAL 136 9.985 11.931 0.017 775 1HG1 VAL 136 1HG1 VAL 136 8.893 14.386 0.348 776 2HG1 VAL 136 2HG1 VAL 136 10.042 14.695 -0.955 777 3HG1 VAL 136 3HG1 VAL 136 10.602 14.008 0.570 778 1HG2 VAL 136 1HG2 VAL 136 7.639 12.927 -1.594 779 2HG2 VAL 136 2HG2 VAL 136 7.577 12.598 0.137 780 3HG2 VAL 136 3HG2 VAL 136 7.918 11.291 -0.997 781 H GLU 137 H GLU 137 11.951 11.707 -0.314 782 HA GLU 137 HA GLU 137 13.062 9.538 -1.836 783 1HB GLU 137 2HB GLU 137 13.561 10.649 0.914 784 2HB GLU 137 1HB GLU 137 14.267 9.113 0.430 785 1HG GLU 137 2HG GLU 137 15.675 10.079 -1.095 786 2HG GLU 137 1HG GLU 137 14.629 11.477 -1.338 787 H TYR 138 H TYR 138 10.748 8.765 -1.969 788 HA TYR 138 HA TYR 138 9.305 7.527 -0.021 789 1HB TYR 138 2HB TYR 138 9.813 6.900 -2.902 790 2HB TYR 138 1HB TYR 138 8.730 5.879 -1.949 791 HD1 TYR 138 1HD TYR 138 8.605 8.264 -4.305 792 HD2 TYR 138 2HD TYR 138 7.197 7.655 -0.337 793 HE1 TYR 138 1HE TYR 138 6.783 9.865 -4.711 794 HE2 TYR 138 2HE TYR 138 5.371 9.254 -0.732 795 HH TYR 138 HH TYR 138 4.550 10.380 -3.828 796 H THR 139 H THR 139 11.556 5.735 -2.129 797 HA THR 139 HA THR 139 11.828 3.699 -0.048 798 HB THR 139 HB THR 139 12.678 2.245 -1.770 799 HG1 THR 139 1HG THR 139 13.755 3.147 -3.312 800 1HG2 THR 139 1HG2 THR 139 10.680 3.313 -3.539 801 2HG2 THR 139 2HG2 THR 139 10.113 3.308 -1.868 802 3HG2 THR 139 3HG2 THR 139 10.682 1.813 -2.611 803 H LYS 140 H LYS 140 13.454 6.420 -1.105 804 HA LYS 140 HA LYS 140 16.145 5.492 -0.944 805 1HB LYS 140 2HB LYS 140 14.784 8.109 -1.202 806 2HB LYS 140 1HB LYS 140 16.393 8.141 -0.494 807 1HG LYS 140 2HG LYS 140 17.351 7.877 -2.474 808 2HG LYS 140 1HG LYS 140 16.343 6.479 -2.846 809 1HD LYS 140 2HD LYS 140 14.531 7.998 -3.541 810 2HD LYS 140 1HD LYS 140 15.584 9.377 -3.217 811 1HE LYS 140 2HE LYS 140 16.105 9.192 -5.396 812 2HE LYS 140 1HE LYS 140 17.165 7.896 -4.843 813 1HZ LYS 140 1HZ LYS 140 15.496 7.478 -6.766 814 2HZ LYS 140 2HZ LYS 140 14.372 7.280 -5.518 815 3HZ LYS 140 3HZ LYS 140 15.737 6.284 -5.591 816 H ASN 141 H ASN 141 17.335 5.078 0.720 817 HA ASN 141 HA ASN 141 18.120 4.918 2.825 818 1HB ASN 141 2HB ASN 141 16.797 7.604 2.914 819 2HB ASN 141 1HB ASN 141 17.482 6.911 4.381 820 1HD2 ASN 141 1HD2 ASN 141 18.099 8.898 1.863 821 2HD2 ASN 141 2HD2 ASN 141 19.824 8.813 1.832 822 H VAL 142 H VAL 142 15.222 4.126 2.050 823 HA VAL 142 HA VAL 142 14.012 4.020 4.703 824 HB VAL 142 HB VAL 142 12.876 2.998 2.100 825 1HG1 VAL 142 1HG1 VAL 142 10.716 3.270 3.347 826 2HG1 VAL 142 2HG1 VAL 142 11.669 3.548 4.806 827 3HG1 VAL 142 3HG1 VAL 142 11.774 2.001 3.964 828 1HG2 VAL 142 1HG2 VAL 142 12.631 5.125 1.490 829 2HG2 VAL 142 2HG2 VAL 142 13.239 5.702 3.042 830 3HG2 VAL 142 3HG2 VAL 142 11.527 5.323 2.851 831 H ASN 143 H ASN 143 15.195 1.851 2.165 832 HA ASN 143 HA ASN 143 16.026 -0.273 2.293 833 1HB ASN 143 2HB ASN 143 16.418 0.660 4.872 834 2HB ASN 143 1HB ASN 143 15.500 -0.822 5.114 835 1HD2 ASN 143 1HD2 ASN 143 16.455 -2.275 2.923 836 2HD2 ASN 143 2HD2 ASN 143 18.116 -2.655 3.203 837 HA PRO 144 HA PRO 144 11.861 -2.010 2.054 838 1HB PRO 144 2HB PRO 144 12.356 -3.767 0.084 839 2HB PRO 144 1HB PRO 144 12.181 -2.036 -0.232 840 1HG PRO 144 2HG PRO 144 14.676 -3.673 0.027 841 2HG PRO 144 1HG PRO 144 14.284 -2.413 -1.158 842 1HD PRO 144 2HD PRO 144 15.831 -1.973 1.054 843 2HD PRO 144 1HD PRO 144 14.851 -0.713 0.279 844 H ASN 145 H ASN 145 13.286 -2.833 4.248 845 HA ASN 145 HA ASN 145 13.635 -5.714 4.077 846 1HB ASN 145 2HB ASN 145 13.938 -3.928 6.496 847 2HB ASN 145 1HB ASN 145 14.515 -5.583 6.320 848 1HD2 ASN 145 1HD2 ASN 145 16.265 -3.702 7.090 849 2HD2 ASN 145 2HD2 ASN 145 17.375 -3.340 5.817 850 H TRP 146 H TRP 146 11.008 -3.848 4.304 851 HA TRP 146 HA TRP 146 9.658 -4.990 6.548 852 1HB TRP 146 2HB TRP 146 7.601 -4.063 5.095 853 2HB TRP 146 1HB TRP 146 8.615 -3.021 6.086 854 HD1 TRP 146 HD TRP 146 10.184 -1.293 4.844 855 HE1 TRP 146 1HE TRP 146 10.292 -0.464 2.410 856 HE3 TRP 146 3HE TRP 146 7.273 -4.872 2.628 857 HZ2 TRP 146 2HZ TRP 146 9.278 -1.224 -0.113 858 HZ3 TRP 146 3HZ TRP 146 6.885 -4.737 0.211 859 HH2 TRP 146 HH TRP 146 7.871 -2.961 -1.135 860 H SER 147 H SER 147 10.063 -5.890 3.221 861 HA SER 147 HA SER 147 7.879 -7.777 3.237 862 1HB SER 147 2HB SER 147 9.047 -8.473 1.012 863 2HB SER 147 1HB SER 147 8.237 -6.910 1.103 864 HG SER 147 HG SER 147 11.001 -7.259 1.619 865 H VAL 148 H VAL 148 11.233 -7.799 4.059 866 HA VAL 148 HA VAL 148 11.454 -10.689 3.862 867 HB VAL 148 HB VAL 148 13.754 -10.364 4.651 868 1HG1 VAL 148 1HG1 VAL 148 12.642 -9.072 2.260 869 2HG1 VAL 148 2HG1 VAL 148 13.932 -10.265 2.408 870 3HG1 VAL 148 3HG1 VAL 148 14.272 -8.558 2.697 871 1HG2 VAL 148 1HG2 VAL 148 13.061 -7.433 4.706 872 2HG2 VAL 148 2HG2 VAL 148 14.660 -8.126 4.975 873 3HG2 VAL 148 3HG2 VAL 148 13.356 -8.446 6.118 874 H ASN 149 H ASN 149 10.244 -8.537 6.105 875 HA ASN 149 HA ASN 149 10.420 -10.551 8.211 876 1HB ASN 149 2HB ASN 149 11.507 -7.771 8.365 877 2HB ASN 149 1HB ASN 149 10.777 -8.473 9.806 878 1HD2 ASN 149 1HD2 ASN 149 13.439 -7.749 9.698 879 2HD2 ASN 149 2HD2 ASN 149 14.416 -9.172 9.782 880 H VAL 150 H VAL 150 8.190 -10.772 7.430 881 HA VAL 150 HA VAL 150 6.402 -8.630 8.347 882 HB VAL 150 HB VAL 150 4.640 -9.875 7.067 883 1HG1 VAL 150 1HG1 VAL 150 6.707 -9.322 5.047 884 2HG1 VAL 150 2HG1 VAL 150 6.425 -8.034 6.217 885 3HG1 VAL 150 3HG1 VAL 150 5.091 -8.642 5.236 886 1HG2 VAL 150 1HG2 VAL 150 5.078 -11.735 5.814 887 2HG2 VAL 150 2HG2 VAL 150 6.220 -11.998 7.132 888 3HG2 VAL 150 3HG2 VAL 150 6.780 -11.326 5.601 Start of MODEL 11 1 1H GLY 38 1HT GLY 38 -15.303 -48.223 1.718 2 2H GLY 38 2HT GLY 38 -15.500 -49.888 1.500 3 3H GLY 38 3HT GLY 38 -15.746 -48.830 0.203 4 1HA GLY 38 1HA GLY 38 -13.139 -49.114 1.580 5 2HA GLY 38 2HA GLY 38 -13.583 -50.075 0.178 6 H ALA 39 H ALA 39 -12.669 -46.931 1.336 7 HA ALA 39 HA ALA 39 -11.647 -46.181 -1.216 8 1HB ALA 39 1HB ALA 39 -14.292 -45.703 -1.073 9 2HB ALA 39 2HB ALA 39 -13.170 -44.718 -2.012 10 3HB ALA 39 3HB ALA 39 -13.669 -44.196 -0.403 11 H MET 40 H MET 40 -10.315 -44.352 -1.122 12 HA MET 40 HA MET 40 -9.509 -43.626 1.578 13 1HB MET 40 2HB MET 40 -7.598 -42.498 0.372 14 2HB MET 40 1HB MET 40 -7.700 -44.242 0.165 15 1HG MET 40 2HG MET 40 -8.163 -44.096 -2.038 16 2HG MET 40 1HG MET 40 -9.078 -42.599 -1.861 17 1HE MET 40 1HE MET 40 -5.314 -43.771 -3.196 18 2HE MET 40 2HE MET 40 -5.952 -42.612 -4.361 19 3HE MET 40 3HE MET 40 -6.974 -43.923 -3.771 20 H ASP 41 H ASP 41 -11.158 -42.266 -1.143 21 HA ASP 41 HA ASP 41 -12.248 -40.295 -1.443 22 1HB ASP 41 2HB ASP 41 -11.667 -39.756 1.475 23 2HB ASP 41 1HB ASP 41 -12.908 -38.992 0.486 24 HA PRO 42 HA PRO 42 -8.968 -37.550 -2.585 25 1HB PRO 42 2HB PRO 42 -11.049 -35.434 -2.583 26 2HB PRO 42 1HB PRO 42 -9.969 -35.950 -3.882 27 1HG PRO 42 2HG PRO 42 -12.559 -36.583 -3.923 28 2HG PRO 42 1HG PRO 42 -11.325 -37.728 -4.483 29 1HD PRO 42 2HD PRO 42 -12.836 -37.682 -1.899 30 2HD PRO 42 1HD PRO 42 -12.369 -39.067 -2.909 31 H GLU 43 H GLU 43 -8.078 -37.705 -0.378 32 HA GLU 43 HA GLU 43 -8.851 -35.723 1.560 33 1HB GLU 43 2HB GLU 43 -7.786 -38.105 1.911 34 2HB GLU 43 1HB GLU 43 -6.273 -37.230 1.729 35 1HG GLU 43 2HG GLU 43 -7.317 -35.647 3.526 36 2HG GLU 43 1HG GLU 43 -8.318 -37.054 3.883 37 H PHE 44 H PHE 44 -5.678 -36.371 0.063 38 HA PHE 44 HA PHE 44 -4.907 -33.609 0.449 39 1HB PHE 44 2HB PHE 44 -3.553 -36.140 -0.113 40 2HB PHE 44 1HB PHE 44 -2.900 -34.793 -1.039 41 HD1 PHE 44 1HD PHE 44 -3.362 -36.213 2.291 42 HD2 PHE 44 2HD PHE 44 -1.808 -32.936 0.065 43 HE1 PHE 44 1HE PHE 44 -2.075 -35.491 4.260 44 HE2 PHE 44 2HE PHE 44 -0.518 -32.207 2.029 45 HZ PHE 44 HZ PHE 44 -0.651 -33.487 4.130 46 H ALA 45 H ALA 45 -4.403 -32.137 -1.179 47 HA ALA 45 HA ALA 45 -4.664 -32.781 -3.953 48 1HB ALA 45 1HB ALA 45 -6.722 -30.801 -3.172 49 2HB ALA 45 2HB ALA 45 -7.068 -32.496 -2.831 50 3HB ALA 45 3HB ALA 45 -6.721 -31.983 -4.482 51 H LEU 46 H LEU 46 -3.165 -31.558 -4.868 52 HA LEU 46 HA LEU 46 -2.212 -29.155 -3.596 53 1HB LEU 46 2HB LEU 46 -1.446 -30.457 -6.211 54 2HB LEU 46 1HB LEU 46 -0.623 -29.081 -5.499 55 HG LEU 46 HG LEU 46 -0.272 -30.651 -3.456 56 1HD1 LEU 46 1HD1 LEU 46 -1.314 -32.478 -5.530 57 2HD1 LEU 46 2HD1 LEU 46 -1.398 -32.585 -3.772 58 3HD1 LEU 46 3HD1 LEU 46 0.086 -33.034 -4.612 59 1HD2 LEU 46 1HD2 LEU 46 1.168 -30.766 -6.084 60 2HD2 LEU 46 2HD2 LEU 46 1.732 -31.681 -4.687 61 3HD2 LEU 46 3HD2 LEU 46 1.624 -29.923 -4.604 62 H SER 47 H SER 47 -3.884 -27.667 -3.703 63 HA SER 47 HA SER 47 -5.140 -27.022 -6.215 64 1HB SER 47 2HB SER 47 -5.550 -26.380 -3.401 65 2HB SER 47 1HB SER 47 -5.750 -24.969 -4.440 66 HG SER 47 HG SER 47 -7.167 -26.352 -5.730 67 H ASN 48 H ASN 48 -5.090 -24.892 -7.181 68 HA ASN 48 HA ASN 48 -2.399 -23.860 -7.315 69 1HB ASN 48 2HB ASN 48 -4.128 -24.185 -9.252 70 2HB ASN 48 1HB ASN 48 -4.728 -22.613 -8.734 71 1HD2 ASN 48 1HD2 ASN 48 -3.199 -23.696 -11.141 72 2HD2 ASN 48 2HD2 ASN 48 -1.906 -22.567 -11.341 73 H GLU 49 H GLU 49 -1.647 -21.976 -6.512 74 HA GLU 49 HA GLU 49 -3.377 -19.859 -5.650 75 1HB GLU 49 2HB GLU 49 -2.731 -21.908 -3.775 76 2HB GLU 49 1HB GLU 49 -1.879 -20.448 -3.295 77 1HG GLU 49 2HG GLU 49 -4.373 -19.496 -3.878 78 2HG GLU 49 1HG GLU 49 -4.723 -21.083 -3.195 79 H LYS 50 H LYS 50 -2.123 -18.045 -4.676 80 HA LYS 50 HA LYS 50 0.744 -18.104 -5.132 81 1HB LYS 50 2HB LYS 50 0.647 -16.069 -6.570 82 2HB LYS 50 1HB LYS 50 -0.018 -17.510 -7.327 83 1HG LYS 50 2HG LYS 50 -2.066 -16.043 -5.925 84 2HG LYS 50 1HG LYS 50 -1.228 -15.015 -7.088 85 1HD LYS 50 2HD LYS 50 -2.431 -15.932 -8.718 86 2HD LYS 50 1HD LYS 50 -1.673 -17.487 -8.371 87 1HE LYS 50 2HE LYS 50 -3.467 -17.589 -6.466 88 2HE LYS 50 1HE LYS 50 -4.308 -16.412 -7.473 89 1HZ LYS 50 1HZ LYS 50 -3.297 -18.927 -8.634 90 2HZ LYS 50 2HZ LYS 50 -4.542 -17.926 -9.188 91 3HZ LYS 50 3HZ LYS 50 -4.781 -18.894 -7.822 92 H LYS 51 H LYS 51 -1.249 -17.671 -2.918 93 HA LYS 51 HA LYS 51 -1.649 -16.288 -1.154 94 1HB LYS 51 2HB LYS 51 0.318 -15.492 -0.049 95 2HB LYS 51 1HB LYS 51 0.712 -17.020 -0.820 96 1HG LYS 51 2HG LYS 51 1.273 -14.549 -2.353 97 2HG LYS 51 1HG LYS 51 2.291 -14.891 -0.954 98 1HD LYS 51 2HD LYS 51 1.878 -17.253 -2.582 99 2HD LYS 51 1HD LYS 51 2.577 -15.930 -3.517 100 1HE LYS 51 2HE LYS 51 4.203 -17.501 -2.356 101 2HE LYS 51 1HE LYS 51 4.446 -15.773 -2.101 102 1HZ LYS 51 1HZ LYS 51 3.849 -15.914 0.066 103 2HZ LYS 51 2HZ LYS 51 4.426 -17.494 -0.118 104 3HZ LYS 51 3HZ LYS 51 2.763 -17.189 -0.179 105 H ALA 52 H ALA 52 -0.904 -13.891 -0.290 106 HA ALA 52 HA ALA 52 -2.194 -12.110 -2.167 107 1HB ALA 52 1HB ALA 52 -2.623 -12.200 0.340 108 2HB ALA 52 2HB ALA 52 -2.407 -10.602 -0.373 109 3HB ALA 52 3HB ALA 52 -1.086 -11.354 0.524 110 H LYS 53 H LYS 53 -0.914 -9.687 -1.340 111 HA LYS 53 HA LYS 53 1.809 -9.970 -2.397 112 1HB LYS 53 2HB LYS 53 -0.118 -7.826 -3.306 113 2HB LYS 53 1HB LYS 53 1.514 -8.101 -3.898 114 1HG LYS 53 2HG LYS 53 -0.339 -10.376 -4.148 115 2HG LYS 53 1HG LYS 53 -0.702 -8.966 -5.145 116 1HD LYS 53 2HD LYS 53 1.733 -9.035 -5.866 117 2HD LYS 53 1HD LYS 53 1.807 -10.628 -5.108 118 1HE LYS 53 2HE LYS 53 0.634 -11.604 -6.760 119 2HE LYS 53 1HE LYS 53 -0.468 -10.237 -6.920 120 1HZ LYS 53 1HZ LYS 53 2.012 -10.795 -8.330 121 2HZ LYS 53 2HZ LYS 53 1.754 -9.178 -7.907 122 3HZ LYS 53 3HZ LYS 53 0.619 -9.993 -8.860 123 H LYS 54 H LYS 54 3.263 -8.875 -1.228 124 HA LYS 54 HA LYS 54 2.321 -7.134 0.885 125 1HB LYS 54 2HB LYS 54 4.825 -8.667 0.357 126 2HB LYS 54 1HB LYS 54 4.921 -7.245 1.387 127 1HG LYS 54 2HG LYS 54 2.849 -9.323 1.927 128 2HG LYS 54 1HG LYS 54 4.520 -9.589 2.431 129 1HD LYS 54 2HD LYS 54 3.595 -8.590 4.304 130 2HD LYS 54 1HD LYS 54 4.313 -7.214 3.464 131 1HE LYS 54 2HE LYS 54 2.310 -6.290 2.994 132 2HE LYS 54 1HE LYS 54 1.542 -7.852 2.707 133 1HZ LYS 54 1HZ LYS 54 0.664 -6.682 4.668 134 2HZ LYS 54 2HZ LYS 54 2.190 -6.766 5.394 135 3HZ LYS 54 3HZ LYS 54 1.334 -8.186 5.060 136 H VAL 55 H VAL 55 2.345 -5.056 0.694 137 HA VAL 55 HA VAL 55 4.340 -3.763 -1.043 138 HB VAL 55 HB VAL 55 2.637 -2.086 -1.703 139 1HG1 VAL 55 1HG1 VAL 55 1.416 -4.577 -2.658 140 2HG1 VAL 55 2HG1 VAL 55 3.164 -4.457 -2.865 141 3HG1 VAL 55 3HG1 VAL 55 2.108 -3.224 -3.553 142 1HG2 VAL 55 1HG2 VAL 55 1.003 -2.184 -0.053 143 2HG2 VAL 55 2HG2 VAL 55 0.845 -3.938 -0.183 144 3HG2 VAL 55 3HG2 VAL 55 0.221 -2.900 -1.465 145 H ARG 56 H ARG 56 4.877 -1.631 -0.510 146 HA ARG 56 HA ARG 56 4.237 -0.881 2.261 147 1HB ARG 56 2HB ARG 56 6.690 -1.263 1.482 148 2HB ARG 56 1HB ARG 56 6.507 0.280 0.658 149 1HG ARG 56 2HG ARG 56 6.506 1.471 2.589 150 2HG ARG 56 1HG ARG 56 5.743 0.179 3.516 151 1HD ARG 56 2HD ARG 56 8.234 -0.821 2.721 152 2HD ARG 56 1HD ARG 56 8.533 0.833 3.242 153 HE ARG 56 HE ARG 56 7.583 -1.379 4.885 154 1HH1 ARG 56 1HH1 ARG 56 8.307 2.032 4.645 155 2HH1 ARG 56 2HH1 ARG 56 8.393 2.256 6.360 156 1HH2 ARG 56 1HH2 ARG 56 7.692 -1.077 7.134 157 2HH2 ARG 56 2HH2 ARG 56 8.043 0.495 7.771 158 H PHE 57 H PHE 57 2.544 0.476 2.202 159 HA PHE 57 HA PHE 57 2.229 2.267 -0.058 160 1HB PHE 57 2HB PHE 57 0.472 1.553 2.278 161 2HB PHE 57 1HB PHE 57 0.065 2.857 1.171 162 HD1 PHE 57 1HD PHE 57 -1.863 0.824 1.460 163 HD2 PHE 57 2HD PHE 57 1.613 0.784 -1.005 164 HE1 PHE 57 1HE PHE 57 -2.942 -0.792 -0.048 165 HE2 PHE 57 2HE PHE 57 0.530 -0.815 -2.506 166 HZ PHE 57 HZ PHE 57 -1.750 -1.610 -2.035 167 H TYR 58 H TYR 58 2.667 4.298 -0.109 168 HA TYR 58 HA TYR 58 3.315 5.751 2.370 169 1HB TYR 58 2HB TYR 58 4.435 6.323 -0.361 170 2HB TYR 58 1HB TYR 58 4.927 7.038 1.155 171 HD1 TYR 58 1HD TYR 58 5.658 4.541 -1.227 172 HD2 TYR 58 2HD TYR 58 5.874 5.366 2.941 173 HE1 TYR 58 1HE TYR 58 7.399 2.821 -0.983 174 HE2 TYR 58 2HE TYR 58 7.615 3.649 3.197 175 HH TYR 58 HH TYR 58 8.203 1.301 1.123 176 H ARG 59 H ARG 59 2.601 7.884 2.509 177 HA ARG 59 HA ARG 59 0.387 8.496 0.692 178 1HB ARG 59 2HB ARG 59 -0.326 10.124 2.380 179 2HB ARG 59 1HB ARG 59 -0.134 8.524 3.082 180 1HG ARG 59 2HG ARG 59 2.275 10.151 3.269 181 2HG ARG 59 1HG ARG 59 0.886 10.861 4.088 182 1HD ARG 59 2HD ARG 59 0.736 8.234 4.842 183 2HD ARG 59 1HD ARG 59 2.474 8.504 4.760 184 HE ARG 59 HE ARG 59 2.313 10.025 6.510 185 1HH1 ARG 59 1HH1 ARG 59 -0.857 8.896 5.569 186 2HH1 ARG 59 2HH1 ARG 59 -1.624 9.480 7.006 187 1HH2 ARG 59 1HH2 ARG 59 1.302 10.793 8.394 188 2HH2 ARG 59 2HH2 ARG 59 -0.400 10.556 8.608 189 H ASN 60 H ASN 60 0.755 9.794 -0.947 190 HA ASN 60 HA ASN 60 3.044 11.105 -1.591 191 1HB ASN 60 2HB ASN 60 1.450 10.932 -3.294 192 2HB ASN 60 1HB ASN 60 0.185 11.656 -2.318 193 1HD2 ASN 60 1HD2 ASN 60 -0.229 13.022 -4.126 194 2HD2 ASN 60 2HD2 ASN 60 0.753 14.414 -4.415 195 H GLY 61 H GLY 61 4.098 12.878 -1.023 196 1HA GLY 61 2HA GLY 61 4.585 14.899 -0.031 197 2HA GLY 61 1HA GLY 61 2.857 15.207 0.050 198 H ASP 62 H ASP 62 5.468 13.401 1.634 199 HA ASP 62 HA ASP 62 4.279 14.058 4.216 200 1HB ASP 62 2HB ASP 62 4.537 11.726 5.019 201 2HB ASP 62 1HB ASP 62 3.341 11.871 3.735 202 H ARG 63 H ARG 63 6.976 12.533 2.497 203 HA ARG 63 HA ARG 63 9.166 12.199 3.131 204 1HB ARG 63 2HB ARG 63 10.371 14.332 3.269 205 2HB ARG 63 1HB ARG 63 9.177 14.335 1.981 206 1HG ARG 63 2HG ARG 63 7.671 15.441 3.836 207 2HG ARG 63 1HG ARG 63 9.237 15.873 4.521 208 1HD ARG 63 2HD ARG 63 9.702 17.336 2.863 209 2HD ARG 63 1HD ARG 63 8.925 16.343 1.629 210 HE ARG 63 HE ARG 63 7.072 17.638 1.870 211 1HH1 ARG 63 1HH1 ARG 63 8.914 17.835 4.828 212 2HH1 ARG 63 2HH1 ARG 63 7.849 18.987 5.561 213 1HH2 ARG 63 1HH2 ARG 63 5.671 19.153 2.833 214 2HH2 ARG 63 2HH2 ARG 63 6.007 19.736 4.428 215 H TYR 64 H TYR 64 7.471 11.643 5.332 216 HA TYR 64 HA TYR 64 9.382 11.997 7.477 217 1HB TYR 64 2HB TYR 64 6.884 13.506 7.327 218 2HB TYR 64 1HB TYR 64 7.021 12.567 8.808 219 HD1 TYR 64 1HD TYR 64 8.744 13.076 10.450 220 HD2 TYR 64 2HD TYR 64 8.406 15.338 6.862 221 HE1 TYR 64 1HE TYR 64 10.205 14.805 11.410 222 HE2 TYR 64 2HE TYR 64 9.868 17.073 7.812 223 HH TYR 64 HH TYR 64 11.525 17.353 9.520 224 H PHE 65 H PHE 65 6.062 10.936 6.780 225 HA PHE 65 HA PHE 65 6.220 8.718 8.594 226 1HB PHE 65 2HB PHE 65 4.089 9.888 8.147 227 2HB PHE 65 1HB PHE 65 4.162 9.361 6.469 228 HD1 PHE 65 1HD PHE 65 3.873 8.152 9.955 229 HD2 PHE 65 2HD PHE 65 3.358 7.259 5.828 230 HE1 PHE 65 1HE PHE 65 2.666 6.092 10.554 231 HE2 PHE 65 2HE PHE 65 2.147 5.203 6.415 232 HZ PHE 65 HZ PHE 65 1.801 4.614 8.784 233 H LYS 66 H LYS 66 7.014 6.771 8.163 234 HA LYS 66 HA LYS 66 8.026 6.181 5.538 235 1HB LYS 66 2HB LYS 66 7.992 4.322 7.905 236 2HB LYS 66 1HB LYS 66 9.103 4.323 6.539 237 1HG LYS 66 2HG LYS 66 9.181 6.866 7.871 238 2HG LYS 66 1HG LYS 66 9.443 5.559 9.030 239 1HD LYS 66 2HD LYS 66 11.588 6.071 8.242 240 2HD LYS 66 1HD LYS 66 11.121 4.636 7.326 241 1HE LYS 66 2HE LYS 66 10.793 5.831 5.372 242 2HE LYS 66 1HE LYS 66 10.566 7.358 6.223 243 1HZ LYS 66 1HZ LYS 66 12.766 7.744 6.299 244 2HZ LYS 66 2HZ LYS 66 12.813 6.696 4.972 245 3HZ LYS 66 3HZ LYS 66 13.175 6.117 6.519 246 H GLY 67 H GLY 67 5.190 6.383 5.571 247 1HA GLY 67 2HA GLY 67 3.304 5.291 4.872 248 2HA GLY 67 1HA GLY 67 4.431 4.282 3.983 249 H ILE 68 H ILE 68 2.225 3.075 4.642 250 HA ILE 68 HA ILE 68 2.927 1.386 6.949 251 HB ILE 68 HB ILE 68 0.959 2.630 7.560 252 1HG1 ILE 68 2HG1 ILE 68 -0.051 -0.081 6.706 253 2HG1 ILE 68 1HG1 ILE 68 1.102 0.123 8.021 254 1HG2 ILE 68 1HG2 ILE 68 0.374 2.704 4.887 255 2HG2 ILE 68 2HG2 ILE 68 -0.697 3.234 6.185 256 3HG2 ILE 68 3HG2 ILE 68 -0.853 1.607 5.515 257 1HD1 ILE 68 1HD1 ILE 68 -1.551 0.041 8.364 258 2HD1 ILE 68 2HD1 ILE 68 -1.326 1.779 8.168 259 3HD1 ILE 68 3HD1 ILE 68 -0.455 0.915 9.435 260 H VAL 69 H VAL 69 2.869 -0.807 6.624 261 HA VAL 69 HA VAL 69 2.776 -1.683 3.866 262 HB VAL 69 HB VAL 69 3.310 -3.367 6.314 263 1HG1 VAL 69 1HG1 VAL 69 4.531 -4.792 4.702 264 2HG1 VAL 69 2HG1 VAL 69 3.967 -3.751 3.395 265 3HG1 VAL 69 3HG1 VAL 69 2.807 -4.676 4.349 266 1HG2 VAL 69 1HG2 VAL 69 5.392 -2.567 6.481 267 2HG2 VAL 69 2HG2 VAL 69 4.813 -1.203 5.526 268 3HG2 VAL 69 3HG2 VAL 69 5.621 -2.555 4.734 269 H TYR 70 H TYR 70 1.230 -2.865 2.908 270 HA TYR 70 HA TYR 70 -0.862 -4.063 4.550 271 1HB TYR 70 2HB TYR 70 -1.164 -1.866 2.663 272 2HB TYR 70 1HB TYR 70 -2.182 -3.238 2.246 273 HD1 TYR 70 1HD TYR 70 -4.335 -2.971 2.960 274 HD2 TYR 70 2HD TYR 70 -1.182 -1.596 5.464 275 HE1 TYR 70 1HE TYR 70 -5.982 -2.306 4.659 276 HE2 TYR 70 2HE TYR 70 -2.821 -0.929 7.171 277 HH TYR 70 HH TYR 70 -6.113 -1.874 7.025 278 H ALA 71 H ALA 71 -1.975 -5.735 3.586 279 HA ALA 71 HA ALA 71 -0.493 -7.138 1.476 280 1HB ALA 71 1HB ALA 71 -2.575 -8.499 3.120 281 2HB ALA 71 2HB ALA 71 -1.023 -8.121 3.869 282 3HB ALA 71 3HB ALA 71 -1.084 -9.142 2.432 283 H VAL 72 H VAL 72 -1.617 -7.952 -0.336 284 HA VAL 72 HA VAL 72 -4.447 -7.255 -0.538 285 HB VAL 72 HB VAL 72 -2.758 -6.622 -2.908 286 1HG1 VAL 72 1HG1 VAL 72 -5.399 -5.855 -1.778 287 2HG1 VAL 72 2HG1 VAL 72 -4.963 -6.318 -3.423 288 3HG1 VAL 72 3HG1 VAL 72 -4.569 -4.705 -2.827 289 1HG2 VAL 72 1HG2 VAL 72 -2.892 -4.968 -0.404 290 2HG2 VAL 72 2HG2 VAL 72 -2.641 -4.229 -1.985 291 3HG2 VAL 72 3HG2 VAL 72 -1.481 -5.405 -1.368 292 H SER 73 H SER 73 -5.630 -8.643 -1.618 293 HA SER 73 HA SER 73 -4.546 -10.452 -3.586 294 1HB SER 73 2HB SER 73 -5.214 -12.503 -2.404 295 2HB SER 73 1HB SER 73 -3.994 -11.621 -1.486 296 HG SER 73 HG SER 73 -6.632 -12.146 -0.878 297 H SER 74 H SER 74 -6.557 -12.260 -3.810 298 HA SER 74 HA SER 74 -8.755 -10.577 -4.685 299 1HB SER 74 2HB SER 74 -9.589 -12.887 -5.562 300 2HB SER 74 1HB SER 74 -8.202 -12.124 -6.340 301 HG SER 74 HG SER 74 -8.156 -14.485 -5.562 302 H ASP 75 H ASP 75 -8.040 -12.792 -2.123 303 HA ASP 75 HA ASP 75 -10.791 -13.279 -1.438 304 1HB ASP 75 2HB ASP 75 -8.175 -14.300 -0.695 305 2HB ASP 75 1HB ASP 75 -9.206 -14.054 0.704 306 H ARG 76 H ARG 76 -8.357 -10.953 -0.647 307 HA ARG 76 HA ARG 76 -9.742 -10.109 1.775 308 1HB ARG 76 2HB ARG 76 -7.062 -9.968 0.834 309 2HB ARG 76 1HB ARG 76 -7.632 -8.321 1.064 310 1HG ARG 76 2HG ARG 76 -8.503 -9.639 3.333 311 2HG ARG 76 1HG ARG 76 -6.908 -10.328 3.023 312 1HD ARG 76 2HD ARG 76 -6.699 -7.541 2.617 313 2HD ARG 76 1HD ARG 76 -7.590 -7.777 4.119 314 HE ARG 76 HE ARG 76 -4.817 -8.310 3.657 315 1HH1 ARG 76 1HH1 ARG 76 -7.597 -9.240 5.551 316 2HH1 ARG 76 2HH1 ARG 76 -6.652 -9.840 6.873 317 1HH2 ARG 76 1HH2 ARG 76 -3.573 -9.099 5.393 318 2HH2 ARG 76 2HH2 ARG 76 -4.368 -9.760 6.783 319 H PHE 77 H PHE 77 -8.807 -8.728 -1.369 320 HA PHE 77 HA PHE 77 -11.024 -6.817 -1.081 321 1HB PHE 77 2HB PHE 77 -8.320 -6.235 -2.304 322 2HB PHE 77 1HB PHE 77 -9.671 -5.111 -2.204 323 HD1 PHE 77 1HD PHE 77 -10.455 -4.364 0.066 324 HD2 PHE 77 2HD PHE 77 -6.816 -6.487 -0.527 325 HE1 PHE 77 1HE PHE 77 -9.656 -3.600 2.263 326 HE2 PHE 77 2HE PHE 77 -6.009 -5.726 1.669 327 HZ PHE 77 HZ PHE 77 -7.430 -4.280 3.068 328 H ARG 78 H ARG 78 -12.483 -7.076 -2.614 329 HA ARG 78 HA ARG 78 -12.124 -8.787 -4.819 330 1HB ARG 78 2HB ARG 78 -14.247 -7.218 -3.609 331 2HB ARG 78 1HB ARG 78 -14.345 -7.215 -5.357 332 1HG ARG 78 2HG ARG 78 -14.237 -9.656 -3.601 333 2HG ARG 78 1HG ARG 78 -15.675 -9.009 -4.395 334 1HD ARG 78 2HD ARG 78 -14.024 -9.245 -6.511 335 2HD ARG 78 1HD ARG 78 -13.429 -10.564 -5.504 336 HE ARG 78 HE ARG 78 -15.313 -11.729 -6.028 337 1HH1 ARG 78 1HH1 ARG 78 -15.945 -8.339 -6.567 338 2HH1 ARG 78 2HH1 ARG 78 -17.520 -8.610 -7.233 339 1HH2 ARG 78 1HH2 ARG 78 -17.384 -12.087 -6.906 340 2HH2 ARG 78 2HH2 ARG 78 -18.337 -10.738 -7.427 341 H SER 79 H SER 79 -11.521 -5.409 -4.371 342 HA SER 79 HA SER 79 -10.375 -5.203 -6.985 343 1HB SER 79 2HB SER 79 -13.081 -4.691 -6.916 344 2HB SER 79 1HB SER 79 -12.382 -3.080 -6.758 345 HG SER 79 HG SER 79 -11.029 -3.761 -8.625 346 H PHE 80 H PHE 80 -9.758 -2.810 -7.423 347 HA PHE 80 HA PHE 80 -8.057 -1.960 -5.367 348 1HB PHE 80 2HB PHE 80 -8.339 -1.383 -8.033 349 2HB PHE 80 1HB PHE 80 -8.851 0.125 -7.285 350 HD1 PHE 80 1HD PHE 80 -7.204 1.707 -7.125 351 HD2 PHE 80 2HD PHE 80 -6.148 -2.394 -6.728 352 HE1 PHE 80 1HE PHE 80 -4.854 2.347 -6.826 353 HE2 PHE 80 2HE PHE 80 -3.795 -1.761 -6.424 354 HZ PHE 80 HZ PHE 80 -3.142 0.609 -6.472 355 H ASP 81 H ASP 81 -11.332 -1.026 -6.208 356 HA ASP 81 HA ASP 81 -11.509 1.327 -4.686 357 1HB ASP 81 2HB ASP 81 -13.189 0.066 -6.381 358 2HB ASP 81 1HB ASP 81 -13.922 -0.388 -4.845 359 H ALA 82 H ALA 82 -12.055 -2.055 -3.861 360 HA ALA 82 HA ALA 82 -12.991 -1.582 -1.222 361 1HB ALA 82 1HB ALA 82 -12.615 -3.798 -2.912 362 2HB ALA 82 2HB ALA 82 -13.432 -3.744 -1.349 363 3HB ALA 82 3HB ALA 82 -11.711 -4.119 -1.432 364 H LEU 83 H LEU 83 -9.815 -2.237 -2.620 365 HA LEU 83 HA LEU 83 -8.411 -2.490 -0.177 366 1HB LEU 83 2HB LEU 83 -7.525 -3.185 -2.391 367 2HB LEU 83 1HB LEU 83 -7.406 -1.500 -2.850 368 HG LEU 83 HG LEU 83 -5.800 -1.163 -0.964 369 1HD1 LEU 83 1HD1 LEU 83 -5.857 -4.173 -0.837 370 2HD1 LEU 83 2HD1 LEU 83 -6.481 -3.079 0.396 371 3HD1 LEU 83 3HD1 LEU 83 -4.754 -3.113 0.039 372 1HD2 LEU 83 1HD2 LEU 83 -5.356 -2.715 -3.410 373 2HD2 LEU 83 2HD2 LEU 83 -4.084 -2.871 -2.197 374 3HD2 LEU 83 3HD2 LEU 83 -4.531 -1.277 -2.807 375 H LEU 84 H LEU 84 -8.984 0.177 -2.396 376 HA LEU 84 HA LEU 84 -7.612 2.171 -0.993 377 1HB LEU 84 2HB LEU 84 -9.889 2.189 -2.943 378 2HB LEU 84 1HB LEU 84 -9.380 3.681 -2.173 379 HG LEU 84 HG LEU 84 -7.548 1.904 -3.781 380 1HD1 LEU 84 1HD1 LEU 84 -8.900 2.676 -5.448 381 2HD1 LEU 84 2HD1 LEU 84 -7.769 4.024 -5.330 382 3HD1 LEU 84 3HD1 LEU 84 -9.352 4.131 -4.561 383 1HD2 LEU 84 1HD2 LEU 84 -7.262 4.612 -2.515 384 2HD2 LEU 84 2HD2 LEU 84 -6.199 4.054 -3.805 385 3HD2 LEU 84 3HD2 LEU 84 -6.264 3.177 -2.274 386 H ALA 85 H ALA 85 -10.814 0.776 -0.580 387 HA ALA 85 HA ALA 85 -11.888 2.758 1.129 388 1HB ALA 85 1HB ALA 85 -12.483 -0.193 1.178 389 2HB ALA 85 2HB ALA 85 -13.176 0.937 0.014 390 3HB ALA 85 3HB ALA 85 -13.526 1.115 1.733 391 H ASP 86 H ASP 86 -10.105 -0.230 1.787 392 HA ASP 86 HA ASP 86 -10.120 0.099 4.621 393 1HB ASP 86 2HB ASP 86 -8.943 -1.782 2.674 394 2HB ASP 86 1HB ASP 86 -8.006 -1.563 4.149 395 H LEU 87 H LEU 87 -8.000 0.984 1.996 396 HA LEU 87 HA LEU 87 -5.731 1.703 3.497 397 1HB LEU 87 2HB LEU 87 -6.777 2.601 0.818 398 2HB LEU 87 1HB LEU 87 -5.292 3.249 1.479 399 HG LEU 87 HG LEU 87 -5.853 0.545 0.368 400 1HD1 LEU 87 1HD1 LEU 87 -4.596 2.549 -0.702 401 2HD1 LEU 87 2HD1 LEU 87 -3.953 0.916 -0.874 402 3HD1 LEU 87 3HD1 LEU 87 -3.259 2.016 0.317 403 1HD2 LEU 87 1HD2 LEU 87 -3.727 1.053 2.450 404 2HD2 LEU 87 2HD2 LEU 87 -3.921 -0.419 1.499 405 3HD2 LEU 87 3HD2 LEU 87 -5.158 0.045 2.664 406 H THR 88 H THR 88 -8.660 3.455 2.692 407 HA THR 88 HA THR 88 -7.843 6.014 3.504 408 HB THR 88 HB THR 88 -10.628 5.409 4.152 409 HG1 THR 88 1HG THR 88 -11.248 4.774 2.110 410 1HG2 THR 88 1HG2 THR 88 -9.536 7.640 3.465 411 2HG2 THR 88 2HG2 THR 88 -11.140 7.239 2.853 412 3HG2 THR 88 3HG2 THR 88 -9.727 7.033 1.820 413 H ARG 89 H ARG 89 -9.258 3.312 5.261 414 HA ARG 89 HA ARG 89 -9.489 4.631 7.755 415 1HB ARG 89 2HB ARG 89 -9.509 1.743 6.926 416 2HB ARG 89 1HB ARG 89 -9.610 2.213 8.617 417 1HG ARG 89 2HG ARG 89 -11.811 2.271 8.301 418 2HG ARG 89 1HG ARG 89 -11.524 3.788 7.447 419 1HD ARG 89 2HD ARG 89 -11.012 1.710 5.613 420 2HD ARG 89 1HD ARG 89 -12.516 1.299 6.435 421 HE ARG 89 HE ARG 89 -12.084 3.449 4.580 422 1HH1 ARG 89 1HH1 ARG 89 -14.053 2.319 7.231 423 2HH1 ARG 89 2HH1 ARG 89 -15.416 3.293 6.797 424 1HH2 ARG 89 1HH2 ARG 89 -13.878 4.729 4.007 425 2HH2 ARG 89 2HH2 ARG 89 -15.319 4.658 4.965 426 H SER 90 H SER 90 -6.980 2.448 6.427 427 HA SER 90 HA SER 90 -5.468 2.463 8.852 428 1HB SER 90 2HB SER 90 -5.448 0.956 6.525 429 2HB SER 90 1HB SER 90 -3.917 1.830 6.471 430 HG SER 90 HG SER 90 -3.420 1.000 8.506 431 H LEU 91 H LEU 91 -5.255 4.294 5.830 432 HA LEU 91 HA LEU 91 -2.924 5.699 6.839 433 1HB LEU 91 2HB LEU 91 -4.080 5.096 4.239 434 2HB LEU 91 1HB LEU 91 -3.576 6.760 4.379 435 HG LEU 91 HG LEU 91 -1.913 4.272 4.485 436 1HD1 LEU 91 1HD1 LEU 91 -1.062 5.013 2.564 437 2HD1 LEU 91 2HD1 LEU 91 -0.933 6.672 3.149 438 3HD1 LEU 91 3HD1 LEU 91 -2.468 6.076 2.517 439 1HD2 LEU 91 1HD2 LEU 91 -1.024 5.267 6.376 440 2HD2 LEU 91 2HD2 LEU 91 -1.316 6.902 5.781 441 3HD2 LEU 91 3HD2 LEU 91 -0.015 5.932 5.090 442 H SER 92 H SER 92 -6.189 6.008 7.139 443 HA SER 92 HA SER 92 -7.124 8.410 6.497 444 1HB SER 92 2HB SER 92 -8.069 8.503 8.946 445 2HB SER 92 1HB SER 92 -8.584 7.232 7.840 446 HG SER 92 HG SER 92 -7.798 5.860 9.206 447 H ASP 93 H ASP 93 -6.511 10.421 6.577 448 HA ASP 93 HA ASP 93 -5.221 11.544 8.903 449 1HB ASP 93 2HB ASP 93 -3.704 10.778 6.532 450 2HB ASP 93 1HB ASP 93 -3.528 12.488 6.905 451 H ASN 94 H ASN 94 -4.327 13.928 7.727 452 HA ASN 94 HA ASN 94 -6.338 15.043 6.026 453 1HB ASN 94 2HB ASN 94 -7.161 16.713 7.696 454 2HB ASN 94 1HB ASN 94 -7.664 15.060 8.035 455 1HD2 ASN 94 1HD2 ASN 94 -5.419 17.599 8.932 456 2HD2 ASN 94 2HD2 ASN 94 -5.109 17.019 10.529 457 H ILE 95 H ILE 95 -3.429 14.810 6.249 458 HA ILE 95 HA ILE 95 -2.770 17.659 6.027 459 HB ILE 95 HB ILE 95 -1.320 15.528 7.559 460 1HG1 ILE 95 2HG1 ILE 95 -1.034 18.170 8.599 461 2HG1 ILE 95 1HG1 ILE 95 -2.722 17.936 8.158 462 1HG2 ILE 95 1HG2 ILE 95 0.686 17.029 7.579 463 2HG2 ILE 95 2HG2 ILE 95 -0.046 17.908 6.237 464 3HG2 ILE 95 3HG2 ILE 95 0.376 16.206 6.050 465 1HD1 ILE 95 1HD1 ILE 95 -1.849 17.302 10.536 466 2HD1 ILE 95 2HD1 ILE 95 -1.342 15.820 9.725 467 3HD1 ILE 95 3HD1 ILE 95 -3.040 16.295 9.716 468 H ASN 96 H ASN 96 -1.631 14.356 5.353 469 HA ASN 96 HA ASN 96 -0.306 15.280 2.927 470 1HB ASN 96 2HB ASN 96 -0.341 12.417 3.811 471 2HB ASN 96 1HB ASN 96 0.917 13.307 2.963 472 1HD2 ASN 96 1HD2 ASN 96 2.360 14.561 4.119 473 2HD2 ASN 96 2HD2 ASN 96 2.528 14.436 5.834 474 H LEU 97 H LEU 97 -3.042 13.386 3.992 475 HA LEU 97 HA LEU 97 -3.810 12.983 1.176 476 1HB LEU 97 2HB LEU 97 -4.179 11.194 3.561 477 2HB LEU 97 1HB LEU 97 -5.177 11.036 2.128 478 HG LEU 97 HG LEU 97 -2.245 11.022 1.710 479 1HD1 LEU 97 1HD1 LEU 97 -1.939 9.498 3.334 480 2HD1 LEU 97 2HD1 LEU 97 -2.652 8.392 2.161 481 3HD1 LEU 97 3HD1 LEU 97 -3.652 9.101 3.430 482 1HD2 LEU 97 1HD2 LEU 97 -4.456 10.557 0.155 483 2HD2 LEU 97 2HD2 LEU 97 -3.896 8.931 0.539 484 3HD2 LEU 97 3HD2 LEU 97 -2.804 10.079 -0.231 485 HA PRO 98 HA PRO 98 -7.063 15.903 2.295 486 1HB PRO 98 2HB PRO 98 -8.149 14.612 -0.180 487 2HB PRO 98 1HB PRO 98 -8.106 16.313 0.267 488 1HG PRO 98 2HG PRO 98 -6.358 15.364 -1.475 489 2HG PRO 98 1HG PRO 98 -5.838 16.521 -0.234 490 1HD PRO 98 2HD PRO 98 -5.395 13.575 -0.385 491 2HD PRO 98 1HD PRO 98 -4.335 14.845 0.257 492 H GLN 99 H GLN 99 -8.416 13.059 0.653 493 HA GLN 99 HA GLN 99 -10.320 12.773 2.861 494 1HB GLN 99 2HB GLN 99 -10.396 11.609 0.073 495 2HB GLN 99 1HB GLN 99 -11.657 11.441 1.285 496 1HG GLN 99 2HG GLN 99 -12.436 13.533 0.968 497 2HG GLN 99 1HG GLN 99 -10.838 14.197 0.633 498 1HE2 GLN 99 1HE2 GLN 99 -10.222 14.487 -1.422 499 2HE2 GLN 99 2HE2 GLN 99 -11.151 14.028 -2.805 500 H GLY 100 H GLY 100 -7.458 11.695 2.720 501 1HA GLY 100 2HA GLY 100 -6.735 9.866 4.066 502 2HA GLY 100 1HA GLY 100 -8.189 8.996 3.612 503 H VAL 101 H VAL 101 -8.326 8.315 1.301 504 HA VAL 101 HA VAL 101 -5.930 8.153 -0.273 505 HB VAL 101 HB VAL 101 -6.890 5.646 1.138 506 1HG1 VAL 101 1HG1 VAL 101 -5.676 5.952 -1.439 507 2HG1 VAL 101 2HG1 VAL 101 -6.208 4.484 -0.618 508 3HG1 VAL 101 3HG1 VAL 101 -4.578 5.096 -0.356 509 1HG2 VAL 101 1HG2 VAL 101 -4.444 5.527 1.795 510 2HG2 VAL 101 2HG2 VAL 101 -5.410 6.774 2.582 511 3HG2 VAL 101 3HG2 VAL 101 -4.322 7.202 1.261 512 H ARG 102 H ARG 102 -6.953 8.621 -2.133 513 HA ARG 102 HA ARG 102 -9.427 7.197 -2.783 514 1HB ARG 102 2HB ARG 102 -8.456 9.883 -3.270 515 2HB ARG 102 1HB ARG 102 -9.009 9.114 -4.750 516 1HG ARG 102 2HG ARG 102 -10.713 8.961 -2.319 517 2HG ARG 102 1HG ARG 102 -10.662 10.459 -3.253 518 1HD ARG 102 2HD ARG 102 -12.415 8.588 -3.806 519 2HD ARG 102 1HD ARG 102 -11.645 9.512 -5.088 520 HE ARG 102 HE ARG 102 -10.072 7.563 -5.293 521 1HH1 ARG 102 1HH1 ARG 102 -13.304 7.130 -4.009 522 2HH1 ARG 102 2HH1 ARG 102 -13.390 5.467 -4.474 523 1HH2 ARG 102 1HH2 ARG 102 -10.203 5.381 -5.897 524 2HH2 ARG 102 2HH2 ARG 102 -11.636 4.475 -5.542 525 H TYR 103 H TYR 103 -6.155 7.753 -3.926 526 HA TYR 103 HA TYR 103 -6.559 5.546 -5.801 527 1HB TYR 103 2HB TYR 103 -5.093 8.003 -6.738 528 2HB TYR 103 1HB TYR 103 -5.657 6.633 -7.672 529 HD1 TYR 103 1HD TYR 103 -6.746 9.694 -5.928 530 HD2 TYR 103 2HD TYR 103 -7.836 6.539 -8.562 531 HE1 TYR 103 1HE TYR 103 -8.790 10.919 -6.542 532 HE2 TYR 103 2HE TYR 103 -9.877 7.749 -9.184 533 HH TYR 103 HH TYR 103 -10.979 10.505 -7.465 534 H ILE 104 H ILE 104 -4.555 4.670 -6.663 535 HA ILE 104 HA ILE 104 -2.299 5.062 -4.809 536 HB ILE 104 HB ILE 104 -3.051 2.484 -6.176 537 1HG1 ILE 104 2HG1 ILE 104 -3.659 3.550 -3.430 538 2HG1 ILE 104 1HG1 ILE 104 -4.756 2.810 -4.590 539 1HG2 ILE 104 1HG2 ILE 104 -1.342 1.464 -4.907 540 2HG2 ILE 104 2HG2 ILE 104 -1.120 2.907 -3.916 541 3HG2 ILE 104 3HG2 ILE 104 -0.636 2.917 -5.611 542 1HD1 ILE 104 1HD1 ILE 104 -4.438 1.254 -2.840 543 2HD1 ILE 104 2HD1 ILE 104 -2.687 1.456 -2.885 544 3HD1 ILE 104 3HD1 ILE 104 -3.516 0.656 -4.220 545 H TYR 105 H TYR 105 -0.568 5.834 -5.780 546 HA TYR 105 HA TYR 105 -0.249 5.467 -8.658 547 1HB TYR 105 2HB TYR 105 0.141 7.699 -6.851 548 2HB TYR 105 1HB TYR 105 1.557 7.410 -7.862 549 HD1 TYR 105 1HD TYR 105 -1.832 8.629 -7.765 550 HD2 TYR 105 2HD TYR 105 1.307 7.348 -10.317 551 HE1 TYR 105 1HE TYR 105 -2.958 9.682 -9.662 552 HE2 TYR 105 2HE TYR 105 0.206 8.393 -12.223 553 HH TYR 105 HH TYR 105 -2.852 9.191 -12.382 554 H THR 106 H THR 106 2.012 5.495 -9.462 555 HA THR 106 HA THR 106 3.446 3.337 -8.252 556 HB THR 106 HB THR 106 5.221 4.299 -10.037 557 HG1 THR 106 1HG THR 106 3.690 6.107 -10.386 558 1HG2 THR 106 1HG2 THR 106 2.920 2.494 -10.283 559 2HG2 THR 106 2HG2 THR 106 4.619 2.239 -10.681 560 3HG2 THR 106 3HG2 THR 106 3.572 3.114 -11.799 561 H ILE 107 H ILE 107 5.707 3.431 -7.576 562 HA ILE 107 HA ILE 107 6.205 5.077 -5.467 563 HB ILE 107 HB ILE 107 7.537 3.069 -6.036 564 1HG1 ILE 107 2HG1 ILE 107 9.723 3.990 -5.250 565 2HG1 ILE 107 1HG1 ILE 107 9.083 5.612 -5.496 566 1HG2 ILE 107 1HG2 ILE 107 9.189 4.801 -7.840 567 2HG2 ILE 107 2HG2 ILE 107 7.848 3.836 -8.456 568 3HG2 ILE 107 3HG2 ILE 107 9.211 3.046 -7.662 569 1HD1 ILE 107 1HD1 ILE 107 8.771 3.851 -3.259 570 2HD1 ILE 107 2HD1 ILE 107 7.195 4.288 -3.916 571 3HD1 ILE 107 3HD1 ILE 107 8.325 5.549 -3.421 572 H ASP 108 H ASP 108 6.647 5.819 -8.839 573 HA ASP 108 HA ASP 108 8.021 8.321 -8.196 574 1HB ASP 108 2HB ASP 108 8.133 6.513 -10.387 575 2HB ASP 108 1HB ASP 108 7.519 8.044 -11.001 576 H GLY 109 H GLY 109 4.944 7.073 -9.199 577 1HA GLY 109 2HA GLY 109 2.912 8.231 -9.019 578 2HA GLY 109 1HA GLY 109 3.802 9.744 -8.960 579 H SER 110 H SER 110 4.792 7.657 -11.462 580 HA SER 110 HA SER 110 4.003 9.480 -13.476 581 1HB SER 110 2HB SER 110 5.198 6.721 -13.513 582 2HB SER 110 1HB SER 110 4.717 7.520 -15.009 583 HG SER 110 HG SER 110 6.934 7.878 -13.576 584 H ARG 111 H ARG 111 2.675 6.393 -12.376 585 HA ARG 111 HA ARG 111 0.202 7.011 -13.782 586 1HB ARG 111 2HB ARG 111 0.045 4.720 -14.679 587 2HB ARG 111 1HB ARG 111 1.413 5.600 -15.347 588 1HG ARG 111 2HG ARG 111 2.687 4.424 -13.354 589 2HG ARG 111 1HG ARG 111 1.365 3.266 -13.516 590 1HD ARG 111 2HD ARG 111 2.000 2.636 -15.638 591 2HD ARG 111 1HD ARG 111 2.829 4.158 -15.957 592 HE ARG 111 HE ARG 111 3.928 1.807 -14.717 593 1HH1 ARG 111 1HH1 ARG 111 4.231 5.265 -15.081 594 2HH1 ARG 111 2HH1 ARG 111 5.918 5.283 -14.691 595 1HH2 ARG 111 1HH2 ARG 111 6.146 1.830 -14.203 596 2HH2 ARG 111 2HH2 ARG 111 7.006 3.334 -14.192 597 H LYS 112 H LYS 112 -1.602 6.268 -12.791 598 HA LYS 112 HA LYS 112 -1.242 5.164 -10.119 599 1HB LYS 112 2HB LYS 112 -2.869 6.578 -9.553 600 2HB LYS 112 1HB LYS 112 -2.998 7.100 -11.221 601 1HG LYS 112 2HG LYS 112 -4.581 5.158 -11.575 602 2HG LYS 112 1HG LYS 112 -4.581 4.965 -9.820 603 1HD LYS 112 2HD LYS 112 -6.490 6.312 -10.610 604 2HD LYS 112 1HD LYS 112 -5.423 7.224 -9.541 605 1HE LYS 112 2HE LYS 112 -4.867 8.687 -11.145 606 2HE LYS 112 1HE LYS 112 -4.710 7.427 -12.368 607 1HZ LYS 112 1HZ LYS 112 -6.974 7.513 -12.852 608 2HZ LYS 112 2HZ LYS 112 -6.549 9.140 -12.666 609 3HZ LYS 112 3HZ LYS 112 -7.360 8.332 -11.422 610 H ILE 113 H ILE 113 -2.111 3.259 -9.427 611 HA ILE 113 HA ILE 113 -2.632 1.288 -11.458 612 HB ILE 113 HB ILE 113 -2.680 0.997 -8.456 613 1HG1 ILE 113 2HG1 ILE 113 -0.516 1.836 -9.632 614 2HG1 ILE 113 1HG1 ILE 113 -0.414 0.526 -8.465 615 1HG2 ILE 113 1HG2 ILE 113 -3.577 -0.981 -8.998 616 2HG2 ILE 113 2HG2 ILE 113 -1.924 -1.409 -9.441 617 3HG2 ILE 113 3HG2 ILE 113 -3.059 -0.871 -10.680 618 1HD1 ILE 113 1HD1 ILE 113 0.656 0.515 -10.973 619 2HD1 ILE 113 2HD1 ILE 113 -0.838 -0.396 -11.192 620 3HD1 ILE 113 3HD1 ILE 113 0.341 -0.914 -9.985 621 H GLY 114 H GLY 114 -4.524 0.399 -12.002 622 1HA GLY 114 2HA GLY 114 -6.924 1.288 -10.528 623 2HA GLY 114 1HA GLY 114 -6.893 0.957 -12.255 624 H SER 115 H SER 115 -5.108 -1.434 -11.632 625 HA SER 115 HA SER 115 -7.229 -3.220 -10.641 626 1HB SER 115 2HB SER 115 -5.964 -4.916 -12.224 627 2HB SER 115 1HB SER 115 -7.183 -3.820 -12.873 628 HG SER 115 HG SER 115 -5.043 -3.959 -13.975 629 H MET 116 H MET 116 -6.636 -4.908 -9.338 630 HA MET 116 HA MET 116 -4.387 -4.581 -7.688 631 1HB MET 116 2HB MET 116 -6.730 -6.017 -7.571 632 2HB MET 116 1HB MET 116 -5.523 -7.284 -7.741 633 1HG MET 116 2HG MET 116 -5.863 -6.961 -5.430 634 2HG MET 116 1HG MET 116 -4.299 -6.248 -5.820 635 1HE MET 116 1HE MET 116 -7.142 -4.942 -3.239 636 2HE MET 116 2HE MET 116 -7.494 -6.174 -4.452 637 3HE MET 116 3HE MET 116 -8.196 -4.562 -4.601 638 H ASP 117 H ASP 117 -4.866 -6.318 -10.646 639 HA ASP 117 HA ASP 117 -2.831 -8.214 -10.456 640 1HB ASP 117 2HB ASP 117 -4.584 -7.114 -12.491 641 2HB ASP 117 1HB ASP 117 -3.003 -7.512 -13.134 642 H GLU 118 H GLU 118 -2.622 -4.809 -10.725 643 HA GLU 118 HA GLU 118 -0.033 -4.848 -12.036 644 1HB GLU 118 2HB GLU 118 -1.812 -2.661 -10.992 645 2HB GLU 118 1HB GLU 118 -0.163 -2.335 -11.506 646 1HG GLU 118 2HG GLU 118 -1.588 -3.875 -13.485 647 2HG GLU 118 1HG GLU 118 -2.441 -2.383 -13.092 648 H LEU 119 H LEU 119 -1.213 -5.101 -8.849 649 HA LEU 119 HA LEU 119 1.073 -3.897 -7.570 650 1HB LEU 119 2HB LEU 119 -0.748 -5.760 -6.126 651 2HB LEU 119 1HB LEU 119 0.020 -4.290 -5.561 652 HG LEU 119 HG LEU 119 -2.365 -4.456 -7.402 653 1HD1 LEU 119 1HD1 LEU 119 -3.547 -3.425 -5.511 654 2HD1 LEU 119 2HD1 LEU 119 -2.086 -3.573 -4.536 655 3HD1 LEU 119 3HD1 LEU 119 -2.910 -5.020 -5.116 656 1HD2 LEU 119 1HD2 LEU 119 -0.595 -2.518 -7.611 657 2HD2 LEU 119 2HD2 LEU 119 -1.417 -1.920 -6.170 658 3HD2 LEU 119 3HD2 LEU 119 -2.326 -2.185 -7.656 659 H GLU 120 H GLU 120 2.989 -4.852 -7.509 660 HA GLU 120 HA GLU 120 3.144 -7.777 -7.591 661 1HB GLU 120 2HB GLU 120 5.436 -5.839 -7.865 662 2HB GLU 120 1HB GLU 120 5.378 -7.523 -8.349 663 1HG GLU 120 2HG GLU 120 4.576 -7.021 -10.351 664 2HG GLU 120 1HG GLU 120 3.330 -5.978 -9.670 665 H GLU 121 H GLU 121 4.603 -8.886 -6.130 666 HA GLU 121 HA GLU 121 4.276 -8.200 -3.457 667 1HB GLU 121 2HB GLU 121 6.262 -10.014 -4.803 668 2HB GLU 121 1HB GLU 121 6.219 -9.805 -3.056 669 1HG GLU 121 2HG GLU 121 3.576 -10.338 -3.949 670 2HG GLU 121 1HG GLU 121 4.657 -11.526 -4.676 671 H GLY 122 H GLY 122 5.839 -7.620 -1.842 672 1HA GLY 122 2HA GLY 122 7.189 -5.972 -1.004 673 2HA GLY 122 1HA GLY 122 8.375 -6.737 -2.033 674 H GLU 123 H GLU 123 5.516 -4.796 -2.849 675 HA GLU 123 HA GLU 123 7.233 -3.124 -4.535 676 1HB GLU 123 2HB GLU 123 4.362 -3.865 -4.548 677 2HB GLU 123 1HB GLU 123 4.770 -2.263 -5.148 678 1HG GLU 123 2HG GLU 123 6.413 -4.472 -6.186 679 2HG GLU 123 1HG GLU 123 4.718 -4.474 -6.669 680 H SER 124 H SER 124 6.510 -0.796 -4.741 681 HA SER 124 HA SER 124 5.865 0.344 -2.104 682 1HB SER 124 2HB SER 124 8.044 1.110 -4.038 683 2HB SER 124 1HB SER 124 7.396 2.284 -2.893 684 HG SER 124 HG SER 124 7.878 0.580 -1.267 685 H TYR 125 H TYR 125 4.050 1.517 -2.189 686 HA TYR 125 HA TYR 125 3.377 2.822 -4.738 687 1HB TYR 125 2HB TYR 125 1.621 1.252 -2.912 688 2HB TYR 125 1HB TYR 125 0.943 2.486 -3.952 689 HD1 TYR 125 1HD TYR 125 1.553 2.355 -6.436 690 HD2 TYR 125 2HD TYR 125 1.934 -0.921 -3.765 691 HE1 TYR 125 1HE TYR 125 1.556 0.835 -8.333 692 HE2 TYR 125 2HE TYR 125 1.924 -2.478 -5.664 693 HH TYR 125 HH TYR 125 2.258 -1.413 -8.907 694 H VAL 126 H VAL 126 1.962 4.592 -4.639 695 HA VAL 126 HA VAL 126 2.254 6.149 -2.140 696 HB VAL 126 HB VAL 126 2.440 7.081 -4.999 697 1HG1 VAL 126 1HG1 VAL 126 1.989 8.761 -2.533 698 2HG1 VAL 126 2HG1 VAL 126 0.952 8.649 -3.955 699 3HG1 VAL 126 3HG1 VAL 126 2.543 9.399 -4.082 700 1HG2 VAL 126 1HG2 VAL 126 4.354 6.368 -3.146 701 2HG2 VAL 126 2HG2 VAL 126 4.315 8.130 -3.044 702 3HG2 VAL 126 3HG2 VAL 126 4.618 7.342 -4.594 703 H CYS 127 H CYS 127 0.508 7.289 -1.382 704 HA CYS 127 HA CYS 127 -2.058 6.594 -2.602 705 1HB CYS 127 2HB CYS 127 -1.331 7.640 0.134 706 2HB CYS 127 1HB CYS 127 -2.993 7.456 -0.419 707 HG CYS 127 HG CYS 127 -2.425 4.840 -0.662 708 H SER 128 H SER 128 -3.286 8.031 -3.623 709 HA SER 128 HA SER 128 -2.754 10.895 -3.232 710 1HB SER 128 2HB SER 128 -3.209 9.587 -5.925 711 2HB SER 128 1HB SER 128 -2.886 11.295 -5.624 712 HG SER 128 HG SER 128 -0.824 10.868 -5.319 713 H SER 129 H SER 129 -4.520 12.235 -4.294 714 HA SER 129 HA SER 129 -7.121 10.975 -4.471 715 1HB SER 129 2HB SER 129 -6.805 13.198 -2.460 716 2HB SER 129 1HB SER 129 -8.153 12.080 -2.660 717 HG SER 129 HG SER 129 -5.893 11.811 -1.184 718 H ASP 130 H ASP 130 -5.394 14.053 -4.166 719 HA ASP 130 HA ASP 130 -6.526 14.960 -6.681 720 1HB ASP 130 2HB ASP 130 -7.110 17.203 -5.578 721 2HB ASP 130 1HB ASP 130 -8.217 15.861 -5.304 722 H ASN 131 H ASN 131 -4.504 15.665 -3.883 723 HA ASN 131 HA ASN 131 -2.937 17.711 -4.865 724 1HB ASN 131 2HB ASN 131 -1.110 16.572 -3.366 725 2HB ASN 131 1HB ASN 131 -2.552 17.258 -2.629 726 1HD2 ASN 131 1HD2 ASN 131 -1.810 14.176 -4.248 727 2HD2 ASN 131 2HD2 ASN 131 -2.406 13.175 -2.975 728 H PHE 132 H PHE 132 -0.839 17.766 -5.807 729 HA PHE 132 HA PHE 132 -0.469 15.704 -7.821 730 1HB PHE 132 2HB PHE 132 -0.036 18.486 -7.726 731 2HB PHE 132 1HB PHE 132 1.559 17.756 -7.874 732 HD1 PHE 132 1HD PHE 132 2.139 16.425 -9.832 733 HD2 PHE 132 2HD PHE 132 -1.641 18.350 -9.500 734 HE1 PHE 132 1HE PHE 132 1.771 16.108 -12.244 735 HE2 PHE 132 2HE PHE 132 -2.017 18.037 -11.911 736 HZ PHE 132 HZ PHE 132 -0.310 16.915 -13.286 737 H PHE 133 H PHE 133 1.840 15.031 -8.305 738 HA PHE 133 HA PHE 133 2.943 13.838 -5.946 739 1HB PHE 133 2HB PHE 133 2.906 13.108 -8.554 740 2HB PHE 133 1HB PHE 133 4.529 13.782 -8.443 741 HD1 PHE 133 1HD PHE 133 2.255 11.223 -7.061 742 HD2 PHE 133 2HD PHE 133 6.263 12.620 -7.352 743 HE1 PHE 133 1HE PHE 133 3.056 9.119 -6.067 744 HE2 PHE 133 2HE PHE 133 7.073 10.520 -6.361 745 HZ PHE 133 HZ PHE 133 5.469 8.765 -5.717 746 H LYS 134 H LYS 134 4.743 14.382 -4.815 747 HA LYS 134 HA LYS 134 6.063 16.888 -5.595 748 1HB LYS 134 2HB LYS 134 6.118 15.677 -2.842 749 2HB LYS 134 1HB LYS 134 6.485 17.331 -3.308 750 1HG LYS 134 2HG LYS 134 3.747 16.168 -3.675 751 2HG LYS 134 1HG LYS 134 4.260 16.881 -2.145 752 1HD LYS 134 2HD LYS 134 4.045 18.965 -2.931 753 2HD LYS 134 1HD LYS 134 4.884 18.569 -4.433 754 1HE LYS 134 2HE LYS 134 2.894 17.778 -5.443 755 2HE LYS 134 1HE LYS 134 2.030 17.778 -3.905 756 1HZ LYS 134 1HZ LYS 134 1.902 20.093 -3.898 757 2HZ LYS 134 2HZ LYS 134 1.575 19.679 -5.505 758 3HZ LYS 134 3HZ LYS 134 3.100 20.272 -5.080 759 H LYS 135 H LYS 135 6.581 13.665 -5.710 760 HA LYS 135 HA LYS 135 8.404 12.280 -5.738 761 1HB LYS 135 2HB LYS 135 9.857 14.692 -6.809 762 2HB LYS 135 1HB LYS 135 10.132 13.002 -7.199 763 1HG LYS 135 2HG LYS 135 7.462 14.139 -7.812 764 2HG LYS 135 1HG LYS 135 8.825 14.631 -8.819 765 1HD LYS 135 2HD LYS 135 8.946 11.807 -8.437 766 2HD LYS 135 1HD LYS 135 7.313 12.237 -8.947 767 1HE LYS 135 2HE LYS 135 9.454 13.592 -10.426 768 2HE LYS 135 1HE LYS 135 9.418 11.841 -10.628 769 1HZ LYS 135 1HZ LYS 135 7.442 13.846 -11.430 770 2HZ LYS 135 2HZ LYS 135 6.877 12.316 -10.981 771 3HZ LYS 135 3HZ LYS 135 7.979 12.469 -12.255 772 H VAL 136 H VAL 136 8.897 11.866 -3.605 773 HA VAL 136 HA VAL 136 11.050 13.518 -2.449 774 HB VAL 136 HB VAL 136 9.962 12.223 -0.277 775 1HG1 VAL 136 1HG1 VAL 136 9.779 14.971 -1.397 776 2HG1 VAL 136 2HG1 VAL 136 10.590 14.391 0.057 777 3HG1 VAL 136 3HG1 VAL 136 8.835 14.570 0.037 778 1HG2 VAL 136 1HG2 VAL 136 8.032 11.527 -1.680 779 2HG2 VAL 136 2HG2 VAL 136 7.653 13.230 -1.937 780 3HG2 VAL 136 3HG2 VAL 136 7.579 12.545 -0.313 781 H GLU 137 H GLU 137 12.072 12.147 -0.517 782 HA GLU 137 HA GLU 137 13.283 9.883 -1.810 783 1HB GLU 137 2HB GLU 137 13.675 10.975 0.988 784 2HB GLU 137 1HB GLU 137 14.682 9.756 0.223 785 1HG GLU 137 2HG GLU 137 15.527 11.304 -1.350 786 2HG GLU 137 1HG GLU 137 14.316 12.509 -0.915 787 H TYR 138 H TYR 138 11.068 8.976 -1.929 788 HA TYR 138 HA TYR 138 9.706 7.853 0.214 789 1HB TYR 138 2HB TYR 138 9.953 7.237 -2.699 790 2HB TYR 138 1HB TYR 138 8.959 6.210 -1.660 791 HD1 TYR 138 1HD TYR 138 8.658 8.640 -3.969 792 HD2 TYR 138 2HD TYR 138 7.540 7.944 0.076 793 HE1 TYR 138 1HE TYR 138 6.811 10.243 -4.209 794 HE2 TYR 138 2HE TYR 138 5.687 9.546 -0.154 795 HH TYR 138 HH TYR 138 4.473 10.558 -2.973 796 H THR 139 H THR 139 11.794 6.087 -2.076 797 HA THR 139 HA THR 139 12.148 3.962 -0.118 798 HB THR 139 HB THR 139 12.974 2.624 -1.930 799 HG1 THR 139 1HG THR 139 13.802 3.450 -3.676 800 1HG2 THR 139 1HG2 THR 139 10.533 2.926 -1.892 801 2HG2 THR 139 2HG2 THR 139 11.168 2.636 -3.513 802 3HG2 THR 139 3HG2 THR 139 10.707 4.268 -3.025 803 H LYS 140 H LYS 140 13.744 6.770 -0.894 804 HA LYS 140 HA LYS 140 16.443 5.852 -0.885 805 1HB LYS 140 2HB LYS 140 15.077 8.359 -1.147 806 2HB LYS 140 1HB LYS 140 16.345 8.524 0.060 807 1HG LYS 140 2HG LYS 140 17.958 8.471 -1.473 808 2HG LYS 140 1HG LYS 140 17.233 7.098 -2.311 809 1HD LYS 140 2HD LYS 140 16.312 9.959 -2.572 810 2HD LYS 140 1HD LYS 140 17.371 9.132 -3.715 811 1HE LYS 140 2HE LYS 140 14.878 7.714 -3.074 812 2HE LYS 140 1HE LYS 140 14.668 9.245 -3.922 813 1HZ LYS 140 1HZ LYS 140 16.470 8.320 -5.480 814 2HZ LYS 140 2HZ LYS 140 14.895 7.724 -5.626 815 3HZ LYS 140 3HZ LYS 140 16.071 6.814 -4.820 816 H ASN 141 H ASN 141 17.595 5.152 0.703 817 HA ASN 141 HA ASN 141 18.450 4.798 2.759 818 1HB ASN 141 2HB ASN 141 16.723 7.079 3.732 819 2HB ASN 141 1HB ASN 141 18.140 6.408 4.533 820 1HD2 ASN 141 1HD2 ASN 141 20.145 7.040 3.914 821 2HD2 ASN 141 2HD2 ASN 141 20.444 8.271 2.740 822 H VAL 142 H VAL 142 15.543 4.029 1.808 823 HA VAL 142 HA VAL 142 14.419 3.237 4.383 824 HB VAL 142 HB VAL 142 13.248 2.739 1.647 825 1HG1 VAL 142 1HG1 VAL 142 11.117 2.731 3.009 826 2HG1 VAL 142 2HG1 VAL 142 12.140 2.680 4.445 827 3HG1 VAL 142 3HG1 VAL 142 12.205 1.368 3.268 828 1HG2 VAL 142 1HG2 VAL 142 13.578 5.232 3.034 829 2HG2 VAL 142 2HG2 VAL 142 11.865 4.836 2.904 830 3HG2 VAL 142 3HG2 VAL 142 12.862 4.922 1.453 831 H ASN 143 H ASN 143 14.608 1.241 5.189 832 HA ASN 143 HA ASN 143 16.163 -0.724 3.795 833 1HB ASN 143 2HB ASN 143 15.556 -0.178 6.473 834 2HB ASN 143 1HB ASN 143 14.812 -1.741 6.152 835 1HD2 ASN 143 1HD2 ASN 143 16.173 -3.423 5.276 836 2HD2 ASN 143 2HD2 ASN 143 17.855 -3.448 5.672 837 HA PRO 144 HA PRO 144 12.607 -2.795 2.069 838 1HB PRO 144 2HB PRO 144 13.889 -4.618 0.618 839 2HB PRO 144 1HB PRO 144 14.017 -2.899 0.226 840 1HG PRO 144 2HG PRO 144 15.968 -4.678 1.617 841 2HG PRO 144 1HG PRO 144 16.269 -3.374 0.457 842 1HD PRO 144 2HD PRO 144 16.460 -3.166 3.243 843 2HD PRO 144 1HD PRO 144 16.364 -1.808 2.105 844 H ASN 145 H ASN 145 13.555 -3.596 4.804 845 HA ASN 145 HA ASN 145 13.398 -6.494 4.754 846 1HB ASN 145 2HB ASN 145 13.671 -6.291 7.226 847 2HB ASN 145 1HB ASN 145 14.965 -5.524 6.310 848 1HD2 ASN 145 1HD2 ASN 145 15.402 -4.319 8.228 849 2HD2 ASN 145 2HD2 ASN 145 14.460 -2.923 8.611 850 H TRP 146 H TRP 146 11.125 -4.214 4.431 851 HA TRP 146 HA TRP 146 9.205 -5.029 6.383 852 1HB TRP 146 2HB TRP 146 7.603 -3.810 4.708 853 2HB TRP 146 1HB TRP 146 8.751 -2.884 5.664 854 HD1 TRP 146 HD TRP 146 10.852 -1.819 4.363 855 HE1 TRP 146 1HE TRP 146 11.188 -1.221 1.883 856 HE3 TRP 146 3HE TRP 146 7.034 -4.559 2.332 857 HZ2 TRP 146 2HZ TRP 146 9.990 -1.820 -0.599 858 HZ3 TRP 146 3HZ TRP 146 6.693 -4.476 -0.094 859 HH2 TRP 146 HH TRP 146 8.141 -3.142 -1.531 860 H SER 147 H SER 147 10.025 -6.048 3.154 861 HA SER 147 HA SER 147 7.618 -7.620 2.841 862 1HB SER 147 2HB SER 147 8.785 -6.531 0.911 863 2HB SER 147 1HB SER 147 10.122 -7.659 1.142 864 HG SER 147 HG SER 147 7.456 -8.525 0.759 865 H VAL 148 H VAL 148 10.102 -8.063 4.833 866 HA VAL 148 HA VAL 148 10.662 -10.851 4.234 867 HB VAL 148 HB VAL 148 11.597 -9.251 6.616 868 1HG1 VAL 148 1HG1 VAL 148 12.550 -11.817 5.352 869 2HG1 VAL 148 2HG1 VAL 148 11.850 -11.608 6.957 870 3HG1 VAL 148 3HG1 VAL 148 13.440 -10.935 6.593 871 1HG2 VAL 148 1HG2 VAL 148 12.230 -8.183 4.467 872 2HG2 VAL 148 2HG2 VAL 148 13.042 -9.679 4.002 873 3HG2 VAL 148 3HG2 VAL 148 13.615 -8.760 5.395 874 H ASN 149 H ASN 149 8.361 -9.098 6.000 875 HA ASN 149 HA ASN 149 7.936 -11.198 7.973 876 1HB ASN 149 2HB ASN 149 6.993 -8.403 7.609 877 2HB ASN 149 1HB ASN 149 5.909 -9.508 8.449 878 1HD2 ASN 149 1HD2 ASN 149 9.381 -8.758 8.400 879 2HD2 ASN 149 2HD2 ASN 149 9.566 -8.713 10.118 880 H VAL 150 H VAL 150 7.576 -12.342 5.623 881 HA VAL 150 HA VAL 150 4.701 -12.279 5.030 882 HB VAL 150 HB VAL 150 5.383 -13.732 3.053 883 1HG1 VAL 150 1HG1 VAL 150 6.140 -10.861 3.407 884 2HG1 VAL 150 2HG1 VAL 150 4.808 -11.565 2.489 885 3HG1 VAL 150 3HG1 VAL 150 6.458 -11.681 1.878 886 1HG2 VAL 150 1HG2 VAL 150 7.744 -13.988 4.312 887 2HG2 VAL 150 2HG2 VAL 150 8.120 -12.640 3.238 888 3HG2 VAL 150 3HG2 VAL 150 7.548 -14.169 2.569 Start of MODEL 12 1 1H GLY 38 1HT GLY 38 -17.645 -17.670 -13.525 2 2H GLY 38 2HT GLY 38 -17.880 -16.701 -14.891 3 3H GLY 38 3HT GLY 38 -19.149 -16.944 -13.800 4 1HA GLY 38 1HA GLY 38 -18.545 -15.000 -12.918 5 2HA GLY 38 2HA GLY 38 -17.268 -15.948 -12.172 6 H ALA 39 H ALA 39 -17.765 -14.806 -15.506 7 HA ALA 39 HA ALA 39 -15.816 -12.779 -15.419 8 1HB ALA 39 1HB ALA 39 -14.121 -14.375 -15.163 9 2HB ALA 39 2HB ALA 39 -14.110 -13.994 -16.884 10 3HB ALA 39 3HB ALA 39 -14.865 -15.483 -16.315 11 H MET 40 H MET 40 -15.447 -11.797 -17.494 12 HA MET 40 HA MET 40 -17.656 -12.292 -19.323 13 1HB MET 40 2HB MET 40 -17.131 -9.987 -18.540 14 2HB MET 40 1HB MET 40 -15.590 -10.086 -19.380 15 1HG MET 40 2HG MET 40 -17.185 -8.848 -20.697 16 2HG MET 40 1HG MET 40 -16.774 -10.360 -21.505 17 1HE MET 40 1HE MET 40 -20.811 -9.110 -19.769 18 2HE MET 40 2HE MET 40 -19.679 -8.064 -20.628 19 3HE MET 40 3HE MET 40 -19.258 -8.705 -19.039 20 H ASP 41 H ASP 41 -14.268 -11.380 -19.953 21 HA ASP 41 HA ASP 41 -14.294 -12.898 -22.411 22 1HB ASP 41 2HB ASP 41 -12.499 -10.910 -21.136 23 2HB ASP 41 1HB ASP 41 -11.744 -12.062 -22.234 24 HA PRO 42 HA PRO 42 -12.469 -16.367 -20.171 25 1HB PRO 42 2HB PRO 42 -13.262 -18.301 -21.819 26 2HB PRO 42 1HB PRO 42 -14.425 -17.462 -20.785 27 1HG PRO 42 2HG PRO 42 -13.887 -17.120 -23.702 28 2HG PRO 42 1HG PRO 42 -15.431 -17.076 -22.832 29 1HD PRO 42 2HD PRO 42 -13.939 -14.847 -23.626 30 2HD PRO 42 1HD PRO 42 -15.236 -14.847 -22.417 31 H GLU 43 H GLU 43 -10.298 -15.613 -20.631 32 HA GLU 43 HA GLU 43 -8.916 -17.331 -22.467 33 1HB GLU 43 2HB GLU 43 -9.774 -14.899 -23.503 34 2HB GLU 43 1HB GLU 43 -8.092 -14.607 -23.081 35 1HG GLU 43 2HG GLU 43 -7.511 -16.674 -24.374 36 2HG GLU 43 1HG GLU 43 -9.182 -16.708 -24.933 37 H PHE 44 H PHE 44 -8.615 -14.346 -20.551 38 HA PHE 44 HA PHE 44 -5.888 -15.011 -19.827 39 1HB PHE 44 2HB PHE 44 -7.317 -12.631 -20.076 40 2HB PHE 44 1HB PHE 44 -7.051 -12.800 -18.345 41 HD1 PHE 44 1HD PHE 44 -4.972 -13.617 -21.334 42 HD2 PHE 44 2HD PHE 44 -5.316 -11.456 -17.684 43 HE1 PHE 44 1HE PHE 44 -2.672 -12.788 -21.611 44 HE2 PHE 44 2HE PHE 44 -3.017 -10.623 -17.955 45 HZ PHE 44 HZ PHE 44 -1.692 -11.289 -19.921 46 H ALA 45 H ALA 45 -8.027 -16.806 -18.919 47 HA ALA 45 HA ALA 45 -8.402 -16.343 -16.113 48 1HB ALA 45 1HB ALA 45 -9.301 -18.706 -16.169 49 2HB ALA 45 2HB ALA 45 -8.987 -18.687 -17.904 50 3HB ALA 45 3HB ALA 45 -10.125 -17.538 -17.201 51 H LEU 46 H LEU 46 -5.850 -16.059 -16.144 52 HA LEU 46 HA LEU 46 -4.388 -18.533 -15.909 53 1HB LEU 46 2HB LEU 46 -2.480 -17.108 -15.353 54 2HB LEU 46 1HB LEU 46 -3.283 -16.575 -16.817 55 HG LEU 46 HG LEU 46 -4.514 -15.070 -14.851 56 1HD1 LEU 46 1HD1 LEU 46 -1.565 -15.230 -14.245 57 2HD1 LEU 46 2HD1 LEU 46 -2.866 -15.812 -13.205 58 3HD1 LEU 46 3HD1 LEU 46 -2.712 -14.088 -13.544 59 1HD2 LEU 46 1HD2 LEU 46 -2.996 -13.243 -15.753 60 2HD2 LEU 46 2HD2 LEU 46 -3.964 -14.124 -16.933 61 3HD2 LEU 46 3HD2 LEU 46 -2.251 -14.498 -16.743 62 H SER 47 H SER 47 -4.411 -19.760 -14.157 63 HA SER 47 HA SER 47 -4.500 -20.450 -11.994 64 1HB SER 47 2HB SER 47 -3.786 -17.609 -11.242 65 2HB SER 47 1HB SER 47 -3.499 -19.072 -10.301 66 HG SER 47 HG SER 47 -2.172 -19.728 -12.191 67 H ASN 48 H ASN 48 -6.348 -20.935 -11.034 68 HA ASN 48 HA ASN 48 -8.547 -19.062 -11.034 69 1HB ASN 48 2HB ASN 48 -8.555 -21.680 -11.390 70 2HB ASN 48 1HB ASN 48 -8.693 -21.697 -9.635 71 1HD2 ASN 48 1HD2 ASN 48 -10.418 -21.809 -12.382 72 2HD2 ASN 48 2HD2 ASN 48 -11.921 -21.166 -11.828 73 H GLU 49 H GLU 49 -5.969 -19.257 -9.080 74 HA GLU 49 HA GLU 49 -7.306 -17.923 -6.922 75 1HB GLU 49 2HB GLU 49 -6.629 -19.468 -5.159 76 2HB GLU 49 1HB GLU 49 -7.694 -20.265 -6.309 77 1HG GLU 49 2HG GLU 49 -5.107 -20.719 -7.253 78 2HG GLU 49 1HG GLU 49 -5.025 -20.951 -5.508 79 H LYS 50 H LYS 50 -5.969 -16.200 -7.107 80 HA LYS 50 HA LYS 50 -3.087 -16.590 -7.219 81 1HB LYS 50 2HB LYS 50 -4.542 -13.954 -7.098 82 2HB LYS 50 1HB LYS 50 -2.925 -14.273 -7.714 83 1HG LYS 50 2HG LYS 50 -4.354 -15.851 -9.350 84 2HG LYS 50 1HG LYS 50 -5.550 -14.598 -9.012 85 1HD LYS 50 2HD LYS 50 -4.448 -13.763 -10.877 86 2HD LYS 50 1HD LYS 50 -3.621 -12.954 -9.545 87 1HE LYS 50 2HE LYS 50 -2.010 -14.995 -9.666 88 2HE LYS 50 1HE LYS 50 -2.672 -15.190 -11.289 89 1HZ LYS 50 1HZ LYS 50 -0.571 -13.692 -10.799 90 2HZ LYS 50 2HZ LYS 50 -1.763 -12.523 -10.527 91 3HZ LYS 50 3HZ LYS 50 -1.676 -13.309 -12.022 92 H LYS 51 H LYS 51 -1.632 -15.722 -5.694 93 HA LYS 51 HA LYS 51 -2.609 -15.819 -2.983 94 1HB LYS 51 2HB LYS 51 -0.227 -15.571 -2.367 95 2HB LYS 51 1HB LYS 51 -0.497 -16.890 -3.497 96 1HG LYS 51 2HG LYS 51 0.170 -14.284 -4.697 97 2HG LYS 51 1HG LYS 51 1.451 -15.064 -3.766 98 1HD LYS 51 2HD LYS 51 1.780 -16.626 -5.334 99 2HD LYS 51 1HD LYS 51 0.051 -16.908 -5.535 100 1HE LYS 51 2HE LYS 51 0.204 -14.536 -6.727 101 2HE LYS 51 1HE LYS 51 1.865 -15.067 -6.993 102 1HZ LYS 51 1HZ LYS 51 0.825 -17.189 -7.877 103 2HZ LYS 51 2HZ LYS 51 0.684 -15.810 -8.847 104 3HZ LYS 51 3HZ LYS 51 -0.636 -16.335 -7.930 105 H ALA 52 H ALA 52 -1.290 -14.096 -1.504 106 HA ALA 52 HA ALA 52 -2.506 -11.565 -2.176 107 1HB ALA 52 1HB ALA 52 -2.574 -12.472 0.118 108 2HB ALA 52 2HB ALA 52 -1.850 -10.865 0.042 109 3HB ALA 52 3HB ALA 52 -0.822 -12.288 0.220 110 H LYS 53 H LYS 53 -0.971 -9.612 -1.322 111 HA LYS 53 HA LYS 53 1.682 -9.851 -2.517 112 1HB LYS 53 2HB LYS 53 -0.412 -7.865 -3.403 113 2HB LYS 53 1HB LYS 53 1.298 -7.699 -3.773 114 1HG LYS 53 2HG LYS 53 -0.069 -10.238 -4.494 115 2HG LYS 53 1HG LYS 53 -0.371 -8.801 -5.473 116 1HD LYS 53 2HD LYS 53 1.696 -8.825 -6.367 117 2HD LYS 53 1HD LYS 53 2.456 -9.299 -4.847 118 1HE LYS 53 2HE LYS 53 2.154 -11.548 -5.243 119 2HE LYS 53 1HE LYS 53 0.786 -11.281 -6.324 120 1HZ LYS 53 1HZ LYS 53 2.442 -11.859 -7.782 121 2HZ LYS 53 2HZ LYS 53 3.664 -11.097 -6.894 122 3HZ LYS 53 3HZ LYS 53 2.581 -10.172 -7.807 123 H LYS 54 H LYS 54 3.158 -8.845 -1.303 124 HA LYS 54 HA LYS 54 2.260 -7.143 0.864 125 1HB LYS 54 2HB LYS 54 4.576 -8.885 0.369 126 2HB LYS 54 1HB LYS 54 4.971 -7.372 1.173 127 1HG LYS 54 2HG LYS 54 2.911 -9.358 2.112 128 2HG LYS 54 1HG LYS 54 4.542 -9.178 2.763 129 1HD LYS 54 2HD LYS 54 3.964 -7.406 4.001 130 2HD LYS 54 1HD LYS 54 3.067 -6.665 2.675 131 1HE LYS 54 2HE LYS 54 1.103 -7.430 3.430 132 2HE LYS 54 1HE LYS 54 1.760 -9.028 3.779 133 1HZ LYS 54 1HZ LYS 54 2.444 -6.770 5.534 134 2HZ LYS 54 2HZ LYS 54 2.357 -8.420 5.896 135 3HZ LYS 54 3HZ LYS 54 0.937 -7.522 5.700 136 H VAL 55 H VAL 55 2.347 -5.059 0.726 137 HA VAL 55 HA VAL 55 4.356 -3.791 -1.008 138 HB VAL 55 HB VAL 55 2.700 -2.051 -1.612 139 1HG1 VAL 55 1HG1 VAL 55 1.891 -3.167 -3.426 140 2HG1 VAL 55 2HG1 VAL 55 1.502 -4.620 -2.505 141 3HG1 VAL 55 3HG1 VAL 55 3.179 -4.262 -2.921 142 1HG2 VAL 55 1HG2 VAL 55 0.875 -3.853 -0.071 143 2HG2 VAL 55 2HG2 VAL 55 0.259 -2.792 -1.338 144 3HG2 VAL 55 3HG2 VAL 55 1.093 -2.105 0.062 145 H ARG 56 H ARG 56 4.976 -1.705 -0.444 146 HA ARG 56 HA ARG 56 4.433 -0.981 2.351 147 1HB ARG 56 2HB ARG 56 6.861 -1.222 0.963 148 2HB ARG 56 1HB ARG 56 6.582 0.509 1.079 149 1HG ARG 56 2HG ARG 56 6.016 -0.282 3.611 150 2HG ARG 56 1HG ARG 56 7.272 -1.436 3.158 151 1HD ARG 56 2HD ARG 56 8.615 0.567 2.364 152 2HD ARG 56 1HD ARG 56 7.427 1.567 3.198 153 HE ARG 56 HE ARG 56 8.584 -0.497 4.838 154 1HH1 ARG 56 1HH1 ARG 56 8.919 2.782 3.685 155 2HH1 ARG 56 2HH1 ARG 56 9.906 3.281 5.017 156 1HH2 ARG 56 1HH2 ARG 56 9.882 0.161 6.591 157 2HH2 ARG 56 2HH2 ARG 56 10.453 1.794 6.666 158 H PHE 57 H PHE 57 2.760 0.414 2.365 159 HA PHE 57 HA PHE 57 2.377 2.190 0.110 160 1HB PHE 57 2HB PHE 57 0.731 1.509 2.528 161 2HB PHE 57 1HB PHE 57 0.300 2.850 1.476 162 HD1 PHE 57 1HD PHE 57 1.621 0.845 -0.878 163 HD2 PHE 57 2HD PHE 57 -1.632 0.807 1.878 164 HE1 PHE 57 1HE PHE 57 0.396 -0.685 -2.345 165 HE2 PHE 57 2HE PHE 57 -2.850 -0.739 0.407 166 HZ PHE 57 HZ PHE 57 -1.841 -1.485 -1.707 167 H TYR 58 H TYR 58 2.847 4.197 -0.005 168 HA TYR 58 HA TYR 58 3.698 5.676 2.391 169 1HB TYR 58 2HB TYR 58 4.536 6.220 -0.446 170 2HB TYR 58 1HB TYR 58 5.156 6.983 0.999 171 HD1 TYR 58 1HD TYR 58 4.813 3.536 -0.427 172 HD2 TYR 58 2HD TYR 58 7.204 6.278 1.775 173 HE1 TYR 58 1HE TYR 58 6.611 1.867 -0.312 174 HE2 TYR 58 2HE TYR 58 9.009 4.613 1.899 175 HH TYR 58 HH TYR 58 9.774 2.636 0.740 176 H ARG 59 H ARG 59 3.015 7.790 2.607 177 HA ARG 59 HA ARG 59 0.604 8.439 1.075 178 1HB ARG 59 2HB ARG 59 1.560 8.978 3.802 179 2HB ARG 59 1HB ARG 59 0.815 10.367 3.025 180 1HG ARG 59 2HG ARG 59 -1.251 9.427 3.005 181 2HG ARG 59 1HG ARG 59 -0.624 7.783 2.869 182 1HD ARG 59 2HD ARG 59 -1.721 8.387 5.070 183 2HD ARG 59 1HD ARG 59 -0.107 7.684 5.166 184 HE ARG 59 HE ARG 59 0.162 10.461 5.109 185 1HH1 ARG 59 1HH1 ARG 59 -1.119 7.987 7.211 186 2HH1 ARG 59 2HH1 ARG 59 -0.816 8.885 8.659 187 1HH2 ARG 59 1HH2 ARG 59 0.564 11.641 7.015 188 2HH2 ARG 59 2HH2 ARG 59 0.139 10.960 8.548 189 H ASN 60 H ASN 60 0.818 9.746 -0.603 190 HA ASN 60 HA ASN 60 3.048 11.035 -1.475 191 1HB ASN 60 2HB ASN 60 1.082 10.784 -2.867 192 2HB ASN 60 1HB ASN 60 0.177 11.893 -1.850 193 1HD2 ASN 60 1HD2 ASN 60 0.001 12.664 -4.238 194 2HD2 ASN 60 2HD2 ASN 60 1.104 13.919 -4.672 195 H GLY 61 H GLY 61 4.142 12.854 -1.072 196 1HA GLY 61 2HA GLY 61 4.790 14.806 -0.045 197 2HA GLY 61 1HA GLY 61 3.081 15.185 0.112 198 H ASP 62 H ASP 62 4.963 12.513 1.491 199 HA ASP 62 HA ASP 62 4.742 13.655 4.154 200 1HB ASP 62 2HB ASP 62 2.677 12.117 3.437 201 2HB ASP 62 1HB ASP 62 3.791 10.841 3.921 202 H ARG 63 H ARG 63 7.068 13.659 3.443 203 HA ARG 63 HA ARG 63 8.463 11.165 3.337 204 1HB ARG 63 2HB ARG 63 10.457 12.487 3.179 205 2HB ARG 63 1HB ARG 63 9.211 13.245 2.195 206 1HG ARG 63 2HG ARG 63 8.997 14.411 4.736 207 2HG ARG 63 1HG ARG 63 10.723 14.335 4.373 208 1HD ARG 63 2HD ARG 63 9.675 15.189 1.997 209 2HD ARG 63 1HD ARG 63 8.608 15.965 3.168 210 HE ARG 63 HE ARG 63 10.341 17.326 3.801 211 1HH1 ARG 63 1HH1 ARG 63 11.603 14.684 1.902 212 2HH1 ARG 63 2HH1 ARG 63 13.191 15.363 1.782 213 1HH2 ARG 63 1HH2 ARG 63 12.430 18.221 3.645 214 2HH2 ARG 63 2HH2 ARG 63 13.662 17.371 2.773 215 H TYR 64 H TYR 64 7.083 12.777 5.889 216 HA TYR 64 HA TYR 64 9.069 11.729 7.794 217 1HB TYR 64 2HB TYR 64 7.420 14.183 7.765 218 2HB TYR 64 1HB TYR 64 7.537 13.356 9.313 219 HD1 TYR 64 1HD TYR 64 9.157 15.572 7.026 220 HD2 TYR 64 2HD TYR 64 9.874 12.856 10.222 221 HE1 TYR 64 1HE TYR 64 11.350 16.615 7.414 222 HE2 TYR 64 2HE TYR 64 12.068 13.893 10.620 223 HH TYR 64 HH TYR 64 13.496 16.076 8.418 224 H PHE 65 H PHE 65 7.647 9.792 6.954 225 HA PHE 65 HA PHE 65 6.036 8.987 9.178 226 1HB PHE 65 2HB PHE 65 4.303 10.197 8.049 227 2HB PHE 65 1HB PHE 65 4.728 9.480 6.500 228 HD1 PHE 65 1HD PHE 65 3.338 7.846 5.716 229 HD2 PHE 65 2HD PHE 65 3.749 8.342 9.922 230 HE1 PHE 65 1HE PHE 65 1.683 6.063 6.082 231 HE2 PHE 65 2HE PHE 65 2.095 6.558 10.297 232 HZ PHE 65 HZ PHE 65 1.061 5.415 8.376 233 H LYS 66 H LYS 66 7.290 8.356 5.964 234 HA LYS 66 HA LYS 66 8.354 6.504 5.151 235 1HB LYS 66 2HB LYS 66 7.430 4.957 7.572 236 2HB LYS 66 1HB LYS 66 8.723 4.538 6.459 237 1HG LYS 66 2HG LYS 66 9.090 7.132 7.744 238 2HG LYS 66 1HG LYS 66 9.039 5.776 8.872 239 1HD LYS 66 2HD LYS 66 10.999 4.926 8.141 240 2HD LYS 66 1HD LYS 66 10.670 5.348 6.459 241 1HE LYS 66 2HE LYS 66 12.042 7.083 6.639 242 2HE LYS 66 1HE LYS 66 11.000 7.768 7.885 243 1HZ LYS 66 1HZ LYS 66 12.236 6.279 9.482 244 2HZ LYS 66 2HZ LYS 66 13.115 7.577 8.846 245 3HZ LYS 66 3HZ LYS 66 13.358 6.016 8.243 246 H GLY 67 H GLY 67 5.371 5.511 6.858 247 1HA GLY 67 2HA GLY 67 3.420 5.253 5.276 248 2HA GLY 67 1HA GLY 67 4.513 4.264 4.323 249 H ILE 68 H ILE 68 2.326 3.002 4.841 250 HA ILE 68 HA ILE 68 2.954 1.241 7.119 251 HB ILE 68 HB ILE 68 0.957 2.474 7.680 252 1HG1 ILE 68 2HG1 ILE 68 0.182 -0.311 6.791 253 2HG1 ILE 68 1HG1 ILE 68 1.069 0.062 8.265 254 1HG2 ILE 68 1HG2 ILE 68 -0.835 2.873 6.326 255 2HG2 ILE 68 2HG2 ILE 68 -0.604 1.388 5.399 256 3HG2 ILE 68 3HG2 ILE 68 0.440 2.778 5.110 257 1HD1 ILE 68 1HD1 ILE 68 -1.126 -0.215 8.968 258 2HD1 ILE 68 2HD1 ILE 68 -1.779 0.667 7.587 259 3HD1 ILE 68 3HD1 ILE 68 -0.932 1.535 8.868 260 H VAL 69 H VAL 69 2.916 -0.931 6.760 261 HA VAL 69 HA VAL 69 2.859 -1.785 3.986 262 HB VAL 69 HB VAL 69 3.461 -3.445 6.436 263 1HG1 VAL 69 1HG1 VAL 69 3.390 -5.111 4.949 264 2HG1 VAL 69 2HG1 VAL 69 4.891 -4.446 4.303 265 3HG1 VAL 69 3HG1 VAL 69 3.344 -4.002 3.580 266 1HG2 VAL 69 1HG2 VAL 69 5.693 -2.574 4.742 267 2HG2 VAL 69 2HG2 VAL 69 5.571 -2.676 6.499 268 3HG2 VAL 69 3HG2 VAL 69 4.910 -1.279 5.649 269 H TYR 70 H TYR 70 1.313 -2.983 3.040 270 HA TYR 70 HA TYR 70 -0.710 -4.265 4.697 271 1HB TYR 70 2HB TYR 70 -1.126 -1.977 2.948 272 2HB TYR 70 1HB TYR 70 -2.141 -3.341 2.498 273 HD1 TYR 70 1HD TYR 70 -4.243 -3.300 3.375 274 HD2 TYR 70 2HD TYR 70 -1.052 -1.707 5.695 275 HE1 TYR 70 1HE TYR 70 -5.831 -2.756 5.171 276 HE2 TYR 70 2HE TYR 70 -2.632 -1.158 7.500 277 HH TYR 70 HH TYR 70 -6.071 -1.407 7.076 278 H ALA 71 H ALA 71 -1.816 -5.924 3.715 279 HA ALA 71 HA ALA 71 -0.418 -7.180 1.461 280 1HB ALA 71 1HB ALA 71 -1.755 -8.211 3.880 281 2HB ALA 71 2HB ALA 71 -0.388 -8.861 2.976 282 3HB ALA 71 3HB ALA 71 -2.034 -9.134 2.404 283 H VAL 72 H VAL 72 -1.617 -7.914 -0.344 284 HA VAL 72 HA VAL 72 -4.457 -7.214 -0.380 285 HB VAL 72 HB VAL 72 -2.820 -6.480 -2.769 286 1HG1 VAL 72 1HG1 VAL 72 -4.616 -5.055 -3.269 287 2HG1 VAL 72 2HG1 VAL 72 -5.223 -5.102 -1.613 288 3HG1 VAL 72 3HG1 VAL 72 -5.367 -6.525 -2.645 289 1HG2 VAL 72 1HG2 VAL 72 -3.006 -4.917 -0.211 290 2HG2 VAL 72 2HG2 VAL 72 -2.776 -4.118 -1.766 291 3HG2 VAL 72 3HG2 VAL 72 -1.581 -5.278 -1.186 292 H SER 73 H SER 73 -5.686 -8.612 -1.378 293 HA SER 73 HA SER 73 -4.746 -10.289 -3.524 294 1HB SER 73 2HB SER 73 -4.211 -11.331 -1.119 295 2HB SER 73 1HB SER 73 -5.891 -11.847 -1.257 296 HG SER 73 HG SER 73 -5.313 -12.790 -3.292 297 H SER 74 H SER 74 -6.485 -11.521 -4.508 298 HA SER 74 HA SER 74 -8.851 -10.067 -4.771 299 1HB SER 74 2HB SER 74 -9.675 -12.341 -5.802 300 2HB SER 74 1HB SER 74 -8.408 -11.413 -6.603 301 HG SER 74 HG SER 74 -6.995 -12.917 -6.130 302 H ASP 75 H ASP 75 -7.959 -12.382 -2.389 303 HA ASP 75 HA ASP 75 -10.651 -13.107 -1.684 304 1HB ASP 75 2HB ASP 75 -7.951 -13.956 -1.028 305 2HB ASP 75 1HB ASP 75 -8.973 -13.854 0.395 306 H ARG 76 H ARG 76 -8.307 -10.719 -0.726 307 HA ARG 76 HA ARG 76 -9.805 -10.047 1.684 308 1HB ARG 76 2HB ARG 76 -7.100 -9.517 0.662 309 2HB ARG 76 1HB ARG 76 -7.838 -8.157 1.496 310 1HG ARG 76 2HG ARG 76 -8.393 -10.181 3.212 311 2HG ARG 76 1HG ARG 76 -6.845 -10.706 2.547 312 1HD ARG 76 2HD ARG 76 -5.814 -8.623 3.177 313 2HD ARG 76 1HD ARG 76 -7.365 -7.969 3.701 314 HE ARG 76 HE ARG 76 -6.641 -10.373 5.081 315 1HH1 ARG 76 1HH1 ARG 76 -6.209 -6.912 5.001 316 2HH1 ARG 76 2HH1 ARG 76 -5.818 -6.795 6.683 317 1HH2 ARG 76 1HH2 ARG 76 -6.127 -10.222 7.295 318 2HH2 ARG 76 2HH2 ARG 76 -5.772 -8.675 7.986 319 H PHE 77 H PHE 77 -8.901 -8.587 -1.414 320 HA PHE 77 HA PHE 77 -11.031 -6.603 -1.006 321 1HB PHE 77 2HB PHE 77 -8.428 -6.129 -2.465 322 2HB PHE 77 1HB PHE 77 -9.696 -4.944 -2.165 323 HD1 PHE 77 1HD PHE 77 -10.212 -4.339 0.243 324 HD2 PHE 77 2HD PHE 77 -6.715 -6.464 -0.920 325 HE1 PHE 77 1HE PHE 77 -9.139 -3.729 2.371 326 HE2 PHE 77 2HE PHE 77 -5.635 -5.855 1.205 327 HZ PHE 77 HZ PHE 77 -6.846 -4.487 2.854 328 H ARG 78 H ARG 78 -12.593 -6.785 -2.425 329 HA ARG 78 HA ARG 78 -12.538 -8.552 -4.597 330 1HB ARG 78 2HB ARG 78 -14.400 -6.713 -3.325 331 2HB ARG 78 1HB ARG 78 -14.611 -6.773 -5.061 332 1HG ARG 78 2HG ARG 78 -15.268 -8.971 -5.048 333 2HG ARG 78 1HG ARG 78 -14.399 -9.324 -3.553 334 1HD ARG 78 2HD ARG 78 -16.231 -7.435 -2.766 335 2HD ARG 78 1HD ARG 78 -17.129 -8.376 -3.958 336 HE ARG 78 HE ARG 78 -16.014 -10.278 -2.399 337 1HH1 ARG 78 1HH1 ARG 78 -17.911 -7.436 -1.688 338 2HH1 ARG 78 2HH1 ARG 78 -18.622 -8.114 -0.262 339 1HH2 ARG 78 1HH2 ARG 78 -16.949 -11.172 -0.524 340 2HH2 ARG 78 2HH2 ARG 78 -18.076 -10.235 0.399 341 H SER 79 H SER 79 -11.708 -5.188 -4.285 342 HA SER 79 HA SER 79 -10.574 -5.155 -6.909 343 1HB SER 79 2HB SER 79 -11.963 -3.548 -7.977 344 2HB SER 79 1HB SER 79 -13.052 -4.772 -7.321 345 HG SER 79 HG SER 79 -13.493 -3.384 -5.593 346 H PHE 80 H PHE 80 -10.039 -2.723 -7.484 347 HA PHE 80 HA PHE 80 -8.160 -1.817 -5.620 348 1HB PHE 80 2HB PHE 80 -8.238 -1.369 -8.104 349 2HB PHE 80 1HB PHE 80 -9.470 -0.164 -7.781 350 HD1 PHE 80 1HD PHE 80 -6.007 -1.064 -6.684 351 HD2 PHE 80 2HD PHE 80 -8.837 2.006 -7.511 352 HE1 PHE 80 1HE PHE 80 -4.279 0.636 -6.281 353 HE2 PHE 80 2HE PHE 80 -7.111 3.710 -7.112 354 HZ PHE 80 HZ PHE 80 -4.831 3.026 -6.497 355 H ASP 81 H ASP 81 -11.430 -0.739 -6.335 356 HA ASP 81 HA ASP 81 -11.466 1.548 -4.710 357 1HB ASP 81 2HB ASP 81 -13.497 -0.183 -5.994 358 2HB ASP 81 1HB ASP 81 -14.059 0.777 -4.629 359 H ALA 82 H ALA 82 -12.086 -1.836 -3.992 360 HA ALA 82 HA ALA 82 -13.085 -1.435 -1.363 361 1HB ALA 82 1HB ALA 82 -13.529 -3.588 -1.585 362 2HB ALA 82 2HB ALA 82 -11.805 -3.959 -1.574 363 3HB ALA 82 3HB ALA 82 -12.624 -3.614 -3.099 364 H LEU 83 H LEU 83 -9.884 -2.063 -2.706 365 HA LEU 83 HA LEU 83 -8.517 -2.380 -0.251 366 1HB LEU 83 2HB LEU 83 -7.546 -3.034 -2.398 367 2HB LEU 83 1HB LEU 83 -7.547 -1.371 -2.928 368 HG LEU 83 HG LEU 83 -5.880 -0.786 -1.275 369 1HD1 LEU 83 1HD1 LEU 83 -6.617 -2.360 0.474 370 2HD1 LEU 83 2HD1 LEU 83 -4.876 -2.417 0.192 371 3HD1 LEU 83 3HD1 LEU 83 -5.916 -3.684 -0.456 372 1HD2 LEU 83 1HD2 LEU 83 -5.427 -2.919 -3.251 373 2HD2 LEU 83 2HD2 LEU 83 -4.151 -2.699 -2.054 374 3HD2 LEU 83 3HD2 LEU 83 -4.647 -1.346 -3.071 375 H LEU 84 H LEU 84 -9.040 0.339 -2.407 376 HA LEU 84 HA LEU 84 -7.681 2.292 -0.942 377 1HB LEU 84 2HB LEU 84 -9.917 2.364 -2.934 378 2HB LEU 84 1HB LEU 84 -9.434 3.840 -2.115 379 HG LEU 84 HG LEU 84 -7.542 2.112 -3.707 380 1HD1 LEU 84 1HD1 LEU 84 -8.931 2.897 -5.366 381 2HD1 LEU 84 2HD1 LEU 84 -7.734 4.188 -5.266 382 3HD1 LEU 84 3HD1 LEU 84 -9.308 4.384 -4.496 383 1HD2 LEU 84 1HD2 LEU 84 -6.456 3.460 -2.006 384 2HD2 LEU 84 2HD2 LEU 84 -7.308 4.897 -2.577 385 3HD2 LEU 84 3HD2 LEU 84 -6.115 4.111 -3.611 386 H ALA 85 H ALA 85 -10.923 0.940 -0.601 387 HA ALA 85 HA ALA 85 -11.931 2.919 1.173 388 1HB ALA 85 1HB ALA 85 -12.682 0.004 1.089 389 2HB ALA 85 2HB ALA 85 -13.294 1.212 -0.042 390 3HB ALA 85 3HB ALA 85 -13.664 1.346 1.677 391 H ASP 86 H ASP 86 -10.314 -0.183 1.703 392 HA ASP 86 HA ASP 86 -10.339 0.010 4.549 393 1HB ASP 86 2HB ASP 86 -10.058 -2.092 3.026 394 2HB ASP 86 1HB ASP 86 -8.354 -1.650 3.024 395 H LEU 87 H LEU 87 -8.152 0.915 1.986 396 HA LEU 87 HA LEU 87 -5.859 1.434 3.532 397 1HB LEU 87 2HB LEU 87 -6.844 2.549 0.911 398 2HB LEU 87 1HB LEU 87 -5.323 3.056 1.609 399 HG LEU 87 HG LEU 87 -6.016 0.568 0.193 400 1HD1 LEU 87 1HD1 LEU 87 -3.304 1.740 0.664 401 2HD1 LEU 87 2HD1 LEU 87 -4.432 2.464 -0.482 402 3HD1 LEU 87 3HD1 LEU 87 -3.889 0.801 -0.709 403 1HD2 LEU 87 1HD2 LEU 87 -5.665 -0.258 2.518 404 2HD2 LEU 87 2HD2 LEU 87 -4.050 0.449 2.476 405 3HD2 LEU 87 3HD2 LEU 87 -4.476 -0.849 1.360 406 H THR 88 H THR 88 -8.639 3.437 2.719 407 HA THR 88 HA THR 88 -7.697 5.863 3.758 408 HB THR 88 HB THR 88 -10.539 5.488 4.231 409 HG1 THR 88 1HG THR 88 -9.628 4.879 1.622 410 1HG2 THR 88 1HG2 THR 88 -8.865 7.467 3.193 411 2HG2 THR 88 2HG2 THR 88 -10.612 7.540 3.428 412 3HG2 THR 88 3HG2 THR 88 -9.952 7.008 1.882 413 H ARG 89 H ARG 89 -9.240 3.086 5.242 414 HA ARG 89 HA ARG 89 -9.642 4.240 7.798 415 1HB ARG 89 2HB ARG 89 -9.527 1.391 6.829 416 2HB ARG 89 1HB ARG 89 -9.821 1.801 8.514 417 1HG ARG 89 2HG ARG 89 -11.865 2.853 8.010 418 2HG ARG 89 1HG ARG 89 -11.510 2.885 6.282 419 1HD ARG 89 2HD ARG 89 -12.554 0.940 6.049 420 2HD ARG 89 1HD ARG 89 -11.370 0.187 7.115 421 HE ARG 89 HE ARG 89 -12.971 0.104 8.732 422 1HH1 ARG 89 1HH1 ARG 89 -13.889 2.545 6.414 423 2HH1 ARG 89 2HH1 ARG 89 -15.423 2.852 7.156 424 1HH2 ARG 89 1HH2 ARG 89 -14.989 0.506 9.711 425 2HH2 ARG 89 2HH2 ARG 89 -16.047 1.695 9.028 426 H SER 90 H SER 90 -7.047 2.142 6.496 427 HA SER 90 HA SER 90 -5.641 2.103 8.995 428 1HB SER 90 2HB SER 90 -5.559 0.502 6.827 429 2HB SER 90 1HB SER 90 -4.143 1.508 6.511 430 HG SER 90 HG SER 90 -3.544 0.986 8.759 431 H LEU 91 H LEU 91 -5.340 3.950 6.003 432 HA LEU 91 HA LEU 91 -3.029 5.351 7.047 433 1HB LEU 91 2HB LEU 91 -4.232 4.847 4.428 434 2HB LEU 91 1HB LEU 91 -3.624 6.469 4.626 435 HG LEU 91 HG LEU 91 -2.107 3.882 4.707 436 1HD1 LEU 91 1HD1 LEU 91 -2.437 6.061 2.853 437 2HD1 LEU 91 2HD1 LEU 91 -1.671 4.489 2.624 438 3HD1 LEU 91 3HD1 LEU 91 -0.739 5.836 3.276 439 1HD2 LEU 91 1HD2 LEU 91 -0.136 5.547 5.221 440 2HD2 LEU 91 2HD2 LEU 91 -1.076 4.814 6.522 441 3HD2 LEU 91 3HD2 LEU 91 -1.419 6.466 6.009 442 H SER 92 H SER 92 -6.285 5.648 7.377 443 HA SER 92 HA SER 92 -7.248 8.051 6.794 444 1HB SER 92 2HB SER 92 -8.139 8.077 9.282 445 2HB SER 92 1HB SER 92 -8.685 6.853 8.137 446 HG SER 92 HG SER 92 -6.556 6.534 9.988 447 H ASP 93 H ASP 93 -6.727 10.096 6.965 448 HA ASP 93 HA ASP 93 -5.331 11.145 9.266 449 1HB ASP 93 2HB ASP 93 -3.951 10.550 6.765 450 2HB ASP 93 1HB ASP 93 -3.803 12.244 7.214 451 H ASN 94 H ASN 94 -4.589 13.618 8.118 452 HA ASN 94 HA ASN 94 -6.764 14.725 6.632 453 1HB ASN 94 2HB ASN 94 -7.473 16.314 8.454 454 2HB ASN 94 1HB ASN 94 -7.954 14.638 8.704 455 1HD2 ASN 94 1HD2 ASN 94 -6.071 17.270 9.849 456 2HD2 ASN 94 2HD2 ASN 94 -5.498 16.519 11.295 457 H ILE 95 H ILE 95 -3.846 14.602 6.596 458 HA ILE 95 HA ILE 95 -3.308 17.483 6.499 459 HB ILE 95 HB ILE 95 -1.618 15.302 7.684 460 1HG1 ILE 95 2HG1 ILE 95 -2.976 16.590 9.221 461 2HG1 ILE 95 1HG1 ILE 95 -1.284 17.018 9.451 462 1HG2 ILE 95 1HG2 ILE 95 -0.133 16.251 6.100 463 2HG2 ILE 95 2HG2 ILE 95 0.286 16.924 7.675 464 3HG2 ILE 95 3HG2 ILE 95 -0.630 17.890 6.518 465 1HD1 ILE 95 1HD1 ILE 95 -1.997 18.900 7.676 466 2HD1 ILE 95 2HD1 ILE 95 -2.112 19.105 9.424 467 3HD1 ILE 95 3HD1 ILE 95 -3.539 18.644 8.493 468 H ASN 96 H ASN 96 -2.111 14.287 5.474 469 HA ASN 96 HA ASN 96 -1.087 15.443 3.002 470 1HB ASN 96 2HB ASN 96 -0.890 12.586 3.971 471 2HB ASN 96 1HB ASN 96 0.045 13.341 2.688 472 1HD2 ASN 96 1HD2 ASN 96 -0.531 13.285 6.140 473 2HD2 ASN 96 2HD2 ASN 96 0.998 13.945 6.598 474 H LEU 97 H LEU 97 -3.569 13.269 4.183 475 HA LEU 97 HA LEU 97 -4.549 12.915 1.429 476 1HB LEU 97 2HB LEU 97 -4.964 11.244 3.904 477 2HB LEU 97 1HB LEU 97 -5.866 11.005 2.420 478 HG LEU 97 HG LEU 97 -2.869 10.920 2.400 479 1HD1 LEU 97 1HD1 LEU 97 -3.239 9.321 4.042 480 2HD1 LEU 97 2HD1 LEU 97 -3.241 8.377 2.552 481 3HD1 LEU 97 3HD1 LEU 97 -4.766 8.801 3.330 482 1HD2 LEU 97 1HD2 LEU 97 -4.371 11.005 0.320 483 2HD2 LEU 97 2HD2 LEU 97 -4.796 9.343 0.732 484 3HD2 LEU 97 3HD2 LEU 97 -3.118 9.766 0.391 485 HA PRO 98 HA PRO 98 -7.374 16.190 3.035 486 1HB PRO 98 2HB PRO 98 -8.254 15.607 0.227 487 2HB PRO 98 1HB PRO 98 -8.139 17.152 1.066 488 1HG PRO 98 2HG PRO 98 -6.250 16.420 -0.645 489 2HG PRO 98 1HG PRO 98 -5.823 17.236 0.870 490 1HD PRO 98 2HD PRO 98 -5.507 14.382 0.105 491 2HD PRO 98 1HD PRO 98 -4.530 15.372 1.205 492 H GLN 99 H GLN 99 -8.850 13.987 0.664 493 HA GLN 99 HA GLN 99 -11.005 13.490 2.589 494 1HB GLN 99 2HB GLN 99 -11.062 12.780 -0.335 495 2HB GLN 99 1HB GLN 99 -12.419 13.003 0.760 496 1HG GLN 99 2HG GLN 99 -12.175 15.336 0.763 497 2HG GLN 99 1HG GLN 99 -10.565 15.250 0.048 498 1HE2 GLN 99 1HE2 GLN 99 -10.791 13.717 -2.078 499 2HE2 GLN 99 2HE2 GLN 99 -11.945 14.336 -3.204 500 H GLY 100 H GLY 100 -8.223 12.023 2.045 501 1HA GLY 100 2HA GLY 100 -7.832 9.866 2.986 502 2HA GLY 100 1HA GLY 100 -9.406 9.368 2.383 503 H VAL 101 H VAL 101 -7.408 7.748 1.877 504 HA VAL 101 HA VAL 101 -5.947 8.233 -0.497 505 HB VAL 101 HB VAL 101 -6.746 5.519 0.551 506 1HG1 VAL 101 1HG1 VAL 101 -5.683 5.757 -1.727 507 2HG1 VAL 101 2HG1 VAL 101 -4.850 4.695 -0.591 508 3HG1 VAL 101 3HG1 VAL 101 -4.237 6.320 -0.896 509 1HG2 VAL 101 1HG2 VAL 101 -4.107 6.424 1.336 510 2HG2 VAL 101 2HG2 VAL 101 -5.398 5.719 2.312 511 3HG2 VAL 101 3HG2 VAL 101 -5.378 7.455 1.993 512 H ARG 102 H ARG 102 -6.964 8.701 -2.338 513 HA ARG 102 HA ARG 102 -9.352 7.179 -3.076 514 1HB ARG 102 2HB ARG 102 -8.479 9.913 -3.488 515 2HB ARG 102 1HB ARG 102 -8.974 9.153 -4.994 516 1HG ARG 102 2HG ARG 102 -10.711 8.897 -2.592 517 2HG ARG 102 1HG ARG 102 -10.709 10.401 -3.518 518 1HD ARG 102 2HD ARG 102 -12.369 8.452 -4.104 519 2HD ARG 102 1HD ARG 102 -11.631 9.428 -5.369 520 HE ARG 102 HE ARG 102 -9.939 7.532 -5.514 521 1HH1 ARG 102 1HH1 ARG 102 -13.262 7.019 -4.526 522 2HH1 ARG 102 2HH1 ARG 102 -13.287 5.373 -5.055 523 1HH2 ARG 102 1HH2 ARG 102 -9.990 5.374 -6.206 524 2HH2 ARG 102 2HH2 ARG 102 -11.436 4.440 -6.008 525 H TYR 103 H TYR 103 -6.074 7.852 -4.091 526 HA TYR 103 HA TYR 103 -6.368 5.726 -6.073 527 1HB TYR 103 2HB TYR 103 -4.814 8.192 -6.800 528 2HB TYR 103 1HB TYR 103 -5.402 6.905 -7.833 529 HD1 TYR 103 1HD TYR 103 -7.475 7.022 -8.889 530 HD2 TYR 103 2HD TYR 103 -6.501 9.836 -5.853 531 HE1 TYR 103 1HE TYR 103 -9.441 8.352 -9.507 532 HE2 TYR 103 2HE TYR 103 -8.475 11.176 -6.457 533 HH TYR 103 HH TYR 103 -10.935 10.315 -7.831 534 H ILE 104 H ILE 104 -4.314 4.879 -6.837 535 HA ILE 104 HA ILE 104 -2.153 5.206 -4.864 536 HB ILE 104 HB ILE 104 -3.002 2.630 -6.200 537 1HG1 ILE 104 2HG1 ILE 104 -3.396 3.717 -3.415 538 2HG1 ILE 104 1HG1 ILE 104 -4.619 3.130 -4.536 539 1HG2 ILE 104 1HG2 ILE 104 -1.299 1.534 -5.008 540 2HG2 ILE 104 2HG2 ILE 104 -0.978 2.952 -4.007 541 3HG2 ILE 104 3HG2 ILE 104 -0.538 2.959 -5.715 542 1HD1 ILE 104 1HD1 ILE 104 -2.623 1.526 -2.970 543 2HD1 ILE 104 2HD1 ILE 104 -3.566 0.853 -4.300 544 3HD1 ILE 104 3HD1 ILE 104 -4.383 1.481 -2.870 545 H TYR 105 H TYR 105 -0.331 5.892 -5.773 546 HA TYR 105 HA TYR 105 0.033 5.500 -8.646 547 1HB TYR 105 2HB TYR 105 0.477 7.734 -6.852 548 2HB TYR 105 1HB TYR 105 1.900 7.380 -7.833 549 HD1 TYR 105 1HD TYR 105 -1.331 8.881 -7.777 550 HD2 TYR 105 2HD TYR 105 1.579 7.134 -10.324 551 HE1 TYR 105 1HE TYR 105 -2.392 9.945 -9.703 552 HE2 TYR 105 2HE TYR 105 0.542 8.189 -12.260 553 HH TYR 105 HH TYR 105 -1.257 10.638 -12.289 554 H THR 106 H THR 106 2.189 5.234 -9.480 555 HA THR 106 HA THR 106 3.550 3.117 -8.131 556 HB THR 106 HB THR 106 5.299 3.754 -10.053 557 HG1 THR 106 1HG THR 106 4.018 5.686 -10.519 558 1HG2 THR 106 1HG2 THR 106 4.416 1.706 -10.421 559 2HG2 THR 106 2HG2 THR 106 3.566 2.596 -11.684 560 3HG2 THR 106 3HG2 THR 106 2.758 2.247 -10.156 561 H ILE 107 H ILE 107 5.774 3.092 -7.478 562 HA ILE 107 HA ILE 107 6.489 4.918 -5.589 563 HB ILE 107 HB ILE 107 7.567 2.698 -5.966 564 1HG1 ILE 107 2HG1 ILE 107 9.851 3.462 -5.243 565 2HG1 ILE 107 1HG1 ILE 107 9.343 5.114 -5.583 566 1HG2 ILE 107 1HG2 ILE 107 7.985 3.111 -8.411 567 2HG2 ILE 107 2HG2 ILE 107 9.339 2.421 -7.516 568 3HG2 ILE 107 3HG2 ILE 107 9.337 4.135 -7.928 569 1HD1 ILE 107 1HD1 ILE 107 8.441 5.264 -3.574 570 2HD1 ILE 107 2HD1 ILE 107 8.993 3.628 -3.218 571 3HD1 ILE 107 3HD1 ILE 107 7.393 3.886 -3.913 572 H ASP 108 H ASP 108 6.922 5.209 -9.029 573 HA ASP 108 HA ASP 108 8.632 7.557 -8.714 574 1HB ASP 108 2HB ASP 108 8.778 5.579 -10.526 575 2HB ASP 108 1HB ASP 108 7.733 6.689 -11.408 576 H GLY 109 H GLY 109 5.354 6.691 -9.365 577 1HA GLY 109 2HA GLY 109 3.514 8.120 -9.305 578 2HA GLY 109 1HA GLY 109 4.608 9.493 -9.385 579 H SER 110 H SER 110 5.195 7.079 -11.725 580 HA SER 110 HA SER 110 4.645 8.835 -13.873 581 1HB SER 110 2HB SER 110 6.170 6.614 -13.610 582 2HB SER 110 1HB SER 110 4.781 5.937 -14.461 583 HG SER 110 HG SER 110 5.097 7.810 -15.936 584 H ARG 111 H ARG 111 2.945 5.960 -12.650 585 HA ARG 111 HA ARG 111 0.489 6.967 -13.825 586 1HB ARG 111 2HB ARG 111 -0.033 4.647 -14.681 587 2HB ARG 111 1HB ARG 111 1.195 5.530 -15.575 588 1HG ARG 111 2HG ARG 111 2.338 3.610 -15.415 589 2HG ARG 111 1HG ARG 111 2.747 4.210 -13.807 590 1HD ARG 111 2HD ARG 111 1.722 2.479 -12.870 591 2HD ARG 111 1HD ARG 111 0.215 2.893 -13.687 592 HE ARG 111 HE ARG 111 2.083 0.835 -14.424 593 1HH1 ARG 111 1HH1 ARG 111 -0.458 2.938 -15.563 594 2HH1 ARG 111 2HH1 ARG 111 -0.878 1.916 -16.896 595 1HH2 ARG 111 1HH2 ARG 111 1.532 -0.511 -16.176 596 2HH2 ARG 111 2HH2 ARG 111 0.251 -0.042 -17.243 597 H LYS 112 H LYS 112 -1.365 6.210 -12.841 598 HA LYS 112 HA LYS 112 -0.951 5.140 -10.163 599 1HB LYS 112 2HB LYS 112 -2.553 6.558 -9.529 600 2HB LYS 112 1HB LYS 112 -2.577 7.182 -11.167 601 1HG LYS 112 2HG LYS 112 -4.274 5.331 -11.658 602 2HG LYS 112 1HG LYS 112 -4.396 5.160 -9.905 603 1HD LYS 112 2HD LYS 112 -6.135 6.651 -10.810 604 2HD LYS 112 1HD LYS 112 -5.054 7.490 -9.696 605 1HE LYS 112 2HE LYS 112 -4.122 8.767 -11.338 606 2HE LYS 112 1HE LYS 112 -4.357 7.537 -12.579 607 1HZ LYS 112 1HZ LYS 112 -5.780 9.645 -12.667 608 2HZ LYS 112 2HZ LYS 112 -6.664 8.952 -11.403 609 3HZ LYS 112 3HZ LYS 112 -6.554 8.157 -12.892 610 H ILE 113 H ILE 113 -1.882 3.289 -9.404 611 HA ILE 113 HA ILE 113 -2.577 1.316 -11.385 612 HB ILE 113 HB ILE 113 -2.431 1.109 -8.375 613 1HG1 ILE 113 2HG1 ILE 113 -0.292 1.658 -9.612 614 2HG1 ILE 113 1HG1 ILE 113 -0.263 0.189 -8.645 615 1HG2 ILE 113 1HG2 ILE 113 -2.078 -1.402 -9.181 616 2HG2 ILE 113 2HG2 ILE 113 -3.127 -0.842 -10.484 617 3HG2 ILE 113 3HG2 ILE 113 -3.667 -0.736 -8.808 618 1HD1 ILE 113 1HD1 ILE 113 0.327 -1.000 -10.403 619 2HD1 ILE 113 2HD1 ILE 113 0.399 0.490 -11.348 620 3HD1 ILE 113 3HD1 ILE 113 -1.093 -0.450 -11.296 621 H GLY 114 H GLY 114 -4.530 0.454 -11.789 622 1HA GLY 114 2HA GLY 114 -6.816 1.508 -10.240 623 2HA GLY 114 1HA GLY 114 -6.878 1.172 -11.964 624 H SER 115 H SER 115 -5.208 -1.321 -11.412 625 HA SER 115 HA SER 115 -7.388 -2.970 -10.317 626 1HB SER 115 2HB SER 115 -6.195 -4.720 -11.972 627 2HB SER 115 1HB SER 115 -7.517 -3.672 -12.488 628 HG SER 115 HG SER 115 -6.181 -2.797 -13.835 629 H MET 116 H MET 116 -6.834 -4.783 -9.133 630 HA MET 116 HA MET 116 -4.549 -4.586 -7.510 631 1HB MET 116 2HB MET 116 -6.934 -5.947 -7.403 632 2HB MET 116 1HB MET 116 -5.777 -7.247 -7.650 633 1HG MET 116 2HG MET 116 -4.836 -6.987 -5.612 634 2HG MET 116 1HG MET 116 -5.107 -5.244 -5.587 635 1HE MET 116 1HE MET 116 -6.903 -4.696 -3.151 636 2HE MET 116 2HE MET 116 -8.305 -4.537 -4.207 637 3HE MET 116 3HE MET 116 -6.704 -4.079 -4.790 638 H ASP 117 H ASP 117 -5.146 -6.240 -10.507 639 HA ASP 117 HA ASP 117 -3.155 -8.187 -10.406 640 1HB ASP 117 2HB ASP 117 -4.924 -6.999 -12.377 641 2HB ASP 117 1HB ASP 117 -3.369 -7.422 -13.066 642 H GLU 118 H GLU 118 -2.889 -4.777 -10.686 643 HA GLU 118 HA GLU 118 -0.297 -4.882 -11.993 644 1HB GLU 118 2HB GLU 118 -1.705 -2.488 -10.813 645 2HB GLU 118 1HB GLU 118 -0.357 -2.473 -11.940 646 1HG GLU 118 2HG GLU 118 -2.651 -3.960 -12.932 647 2HG GLU 118 1HG GLU 118 -3.013 -2.269 -12.591 648 H LEU 119 H LEU 119 -1.462 -5.125 -8.825 649 HA LEU 119 HA LEU 119 0.790 -3.868 -7.535 650 1HB LEU 119 2HB LEU 119 -1.052 -5.765 -6.141 651 2HB LEU 119 1HB LEU 119 -0.256 -4.334 -5.518 652 HG LEU 119 HG LEU 119 -2.599 -4.354 -7.419 653 1HD1 LEU 119 1HD1 LEU 119 -3.125 -5.060 -5.109 654 2HD1 LEU 119 2HD1 LEU 119 -3.892 -3.537 -5.562 655 3HD1 LEU 119 3HD1 LEU 119 -2.466 -3.533 -4.524 656 1HD2 LEU 119 1HD2 LEU 119 -1.004 -2.456 -7.708 657 2HD2 LEU 119 2HD2 LEU 119 -1.314 -2.011 -6.030 658 3HD2 LEU 119 3HD2 LEU 119 -2.626 -1.976 -7.208 659 H GLU 120 H GLU 120 2.730 -4.790 -7.500 660 HA GLU 120 HA GLU 120 2.940 -7.710 -7.586 661 1HB GLU 120 2HB GLU 120 5.191 -5.728 -7.869 662 2HB GLU 120 1HB GLU 120 5.161 -7.410 -8.361 663 1HG GLU 120 2HG GLU 120 3.788 -6.978 -10.199 664 2HG GLU 120 1HG GLU 120 3.319 -5.395 -9.581 665 H GLU 121 H GLU 121 4.431 -8.807 -6.158 666 HA GLU 121 HA GLU 121 4.132 -8.166 -3.471 667 1HB GLU 121 2HB GLU 121 6.069 -9.955 -4.905 668 2HB GLU 121 1HB GLU 121 6.153 -9.737 -3.160 669 1HG GLU 121 2HG GLU 121 3.633 -10.362 -3.227 670 2HG GLU 121 1HG GLU 121 4.030 -11.038 -4.807 671 H GLY 122 H GLY 122 5.778 -7.661 -1.873 672 1HA GLY 122 2HA GLY 122 7.072 -5.957 -1.032 673 2HA GLY 122 1HA GLY 122 8.271 -6.734 -2.037 674 H GLU 123 H GLU 123 5.432 -4.754 -2.842 675 HA GLU 123 HA GLU 123 7.158 -3.121 -4.559 676 1HB GLU 123 2HB GLU 123 4.272 -3.802 -4.525 677 2HB GLU 123 1HB GLU 123 4.701 -2.209 -5.131 678 1HG GLU 123 2HG GLU 123 5.839 -4.800 -6.152 679 2HG GLU 123 1HG GLU 123 4.511 -3.912 -6.899 680 H SER 124 H SER 124 6.441 -0.768 -4.749 681 HA SER 124 HA SER 124 5.878 0.362 -2.089 682 1HB SER 124 2HB SER 124 7.791 1.611 -4.067 683 2HB SER 124 1HB SER 124 7.555 2.032 -2.370 684 HG SER 124 HG SER 124 8.573 0.173 -1.767 685 H TYR 125 H TYR 125 4.030 1.471 -2.171 686 HA TYR 125 HA TYR 125 3.364 2.853 -4.682 687 1HB TYR 125 2HB TYR 125 1.617 1.301 -2.833 688 2HB TYR 125 1HB TYR 125 0.941 2.563 -3.842 689 HD1 TYR 125 1HD TYR 125 1.616 2.456 -6.349 690 HD2 TYR 125 2HD TYR 125 1.727 -0.870 -3.715 691 HE1 TYR 125 1HE TYR 125 1.537 0.961 -8.266 692 HE2 TYR 125 2HE TYR 125 1.636 -2.400 -5.635 693 HH TYR 125 HH TYR 125 2.078 -1.315 -8.864 694 H VAL 126 H VAL 126 1.993 4.652 -4.542 695 HA VAL 126 HA VAL 126 2.323 6.164 -2.022 696 HB VAL 126 HB VAL 126 2.763 7.035 -4.846 697 1HG1 VAL 126 1HG1 VAL 126 2.652 9.446 -3.815 698 2HG1 VAL 126 2HG1 VAL 126 1.499 8.697 -2.711 699 3HG1 VAL 126 3HG1 VAL 126 1.196 8.678 -4.448 700 1HG2 VAL 126 1HG2 VAL 126 4.440 6.535 -2.814 701 2HG2 VAL 126 2HG2 VAL 126 4.145 8.254 -2.542 702 3HG2 VAL 126 3HG2 VAL 126 4.786 7.701 -4.091 703 H CYS 127 H CYS 127 0.578 7.145 -1.175 704 HA CYS 127 HA CYS 127 -1.988 6.597 -2.433 705 1HB CYS 127 2HB CYS 127 -1.171 7.530 0.314 706 2HB CYS 127 1HB CYS 127 -2.853 7.517 -0.206 707 HG CYS 127 HG CYS 127 -2.408 4.843 -0.608 708 H SER 128 H SER 128 -3.106 8.056 -3.527 709 HA SER 128 HA SER 128 -2.590 10.912 -3.036 710 1HB SER 128 2HB SER 128 -2.978 9.675 -5.772 711 2HB SER 128 1HB SER 128 -2.641 11.370 -5.417 712 HG SER 128 HG SER 128 -0.642 10.554 -4.432 713 H SER 129 H SER 129 -4.329 12.318 -3.918 714 HA SER 129 HA SER 129 -6.911 11.081 -4.347 715 1HB SER 129 2HB SER 129 -6.488 11.310 -1.800 716 2HB SER 129 1HB SER 129 -6.710 13.039 -2.070 717 HG SER 129 HG SER 129 -8.688 12.141 -1.549 718 H ASP 130 H ASP 130 -5.247 14.129 -3.604 719 HA ASP 130 HA ASP 130 -6.376 15.316 -6.008 720 1HB ASP 130 2HB ASP 130 -7.819 15.743 -3.828 721 2HB ASP 130 1HB ASP 130 -6.585 16.960 -3.523 722 H ASN 131 H ASN 131 -3.734 14.481 -5.143 723 HA ASN 131 HA ASN 131 -2.360 17.086 -5.051 724 1HB ASN 131 2HB ASN 131 -1.032 14.484 -4.349 725 2HB ASN 131 1HB ASN 131 -0.593 16.116 -3.858 726 1HD2 ASN 131 1HD2 ASN 131 -2.362 13.311 -3.104 727 2HD2 ASN 131 2HD2 ASN 131 -3.092 13.879 -1.644 728 H PHE 132 H PHE 132 -0.497 17.377 -6.358 729 HA PHE 132 HA PHE 132 -0.639 15.904 -8.866 730 1HB PHE 132 2HB PHE 132 -0.585 18.402 -8.829 731 2HB PHE 132 1HB PHE 132 1.049 18.317 -8.181 732 HD1 PHE 132 1HD PHE 132 2.710 18.698 -9.703 733 HD2 PHE 132 2HD PHE 132 -0.854 16.766 -10.997 734 HE1 PHE 132 1HE PHE 132 3.610 18.579 -11.989 735 HE2 PHE 132 2HE PHE 132 0.040 16.641 -13.286 736 HZ PHE 132 HZ PHE 132 2.275 17.548 -13.784 737 H PHE 133 H PHE 133 0.453 14.503 -6.610 738 HA PHE 133 HA PHE 133 2.179 13.117 -6.098 739 1HB PHE 133 2HB PHE 133 2.044 12.566 -8.511 740 2HB PHE 133 1HB PHE 133 3.206 13.847 -8.848 741 HD1 PHE 133 1HD PHE 133 2.828 10.772 -6.780 742 HD2 PHE 133 2HD PHE 133 5.445 13.320 -8.964 743 HE1 PHE 133 1HE PHE 133 4.673 9.187 -6.410 744 HE2 PHE 133 2HE PHE 133 7.294 11.737 -8.600 745 HZ PHE 133 HZ PHE 133 6.910 9.668 -7.321 746 H LYS 134 H LYS 134 4.334 13.117 -5.316 747 HA LYS 134 HA LYS 134 5.789 15.654 -5.523 748 1HB LYS 134 2HB LYS 134 4.686 14.406 -3.050 749 2HB LYS 134 1HB LYS 134 6.257 15.189 -2.948 750 1HG LYS 134 2HG LYS 134 4.100 16.717 -4.265 751 2HG LYS 134 1HG LYS 134 3.959 16.470 -2.525 752 1HD LYS 134 2HD LYS 134 5.248 18.312 -2.400 753 2HD LYS 134 1HD LYS 134 6.565 17.187 -2.734 754 1HE LYS 134 2HE LYS 134 5.794 17.712 -5.243 755 2HE LYS 134 1HE LYS 134 5.311 19.224 -4.476 756 1HZ LYS 134 1HZ LYS 134 7.748 18.789 -5.413 757 2HZ LYS 134 2HZ LYS 134 7.972 18.244 -3.827 758 3HZ LYS 134 3HZ LYS 134 7.438 19.824 -4.111 759 H LYS 135 H LYS 135 7.847 15.307 -6.012 760 HA LYS 135 HA LYS 135 8.934 12.644 -5.963 761 1HB LYS 135 2HB LYS 135 9.839 15.303 -6.973 762 2HB LYS 135 1HB LYS 135 11.043 14.045 -6.725 763 1HG LYS 135 2HG LYS 135 10.515 13.645 -8.898 764 2HG LYS 135 1HG LYS 135 9.320 12.609 -8.115 765 1HD LYS 135 2HD LYS 135 7.582 13.930 -8.723 766 2HD LYS 135 1HD LYS 135 8.521 15.417 -8.568 767 1HE LYS 135 2HE LYS 135 9.759 14.283 -10.677 768 2HE LYS 135 1HE LYS 135 8.130 13.648 -10.896 769 1HZ LYS 135 1HZ LYS 135 8.881 15.980 -11.856 770 2HZ LYS 135 2HZ LYS 135 8.374 16.497 -10.327 771 3HZ LYS 135 3HZ LYS 135 7.294 15.685 -11.346 772 H VAL 136 H VAL 136 9.252 11.977 -3.879 773 HA VAL 136 HA VAL 136 11.224 13.514 -2.318 774 HB VAL 136 HB VAL 136 9.947 11.972 -0.428 775 1HG1 VAL 136 1HG1 VAL 136 10.692 14.266 -0.167 776 2HG1 VAL 136 2HG1 VAL 136 9.019 14.088 0.366 777 3HG1 VAL 136 3HG1 VAL 136 9.374 14.828 -1.196 778 1HG2 VAL 136 1HG2 VAL 136 8.144 11.342 -1.890 779 2HG2 VAL 136 2HG2 VAL 136 7.876 13.021 -2.354 780 3HG2 VAL 136 3HG2 VAL 136 7.534 12.496 -0.705 781 H GLU 137 H GLU 137 12.268 12.058 -0.587 782 HA GLU 137 HA GLU 137 13.473 9.857 -1.987 783 1HB GLU 137 2HB GLU 137 13.947 11.262 0.603 784 2HB GLU 137 1HB GLU 137 14.579 9.631 0.427 785 1HG GLU 137 2HG GLU 137 15.688 10.427 -1.696 786 2HG GLU 137 1HG GLU 137 15.247 12.061 -1.204 787 H TYR 138 H TYR 138 11.275 8.911 -2.140 788 HA TYR 138 HA TYR 138 9.864 7.728 -0.098 789 1HB TYR 138 2HB TYR 138 10.349 7.051 -2.967 790 2HB TYR 138 1HB TYR 138 9.372 5.970 -1.970 791 HD1 TYR 138 1HD TYR 138 9.046 8.334 -4.349 792 HD2 TYR 138 2HD TYR 138 7.694 7.596 -0.384 793 HE1 TYR 138 1HE TYR 138 7.089 9.766 -4.757 794 HE2 TYR 138 2HE TYR 138 5.732 9.026 -0.781 795 HH TYR 138 HH TYR 138 4.743 9.992 -3.814 796 H THR 139 H THR 139 12.042 5.886 -2.219 797 HA THR 139 HA THR 139 12.535 4.009 -0.030 798 HB THR 139 HB THR 139 13.138 2.403 -1.664 799 HG1 THR 139 1HG THR 139 14.409 3.419 -3.087 800 1HG2 THR 139 1HG2 THR 139 10.882 4.039 -2.795 801 2HG2 THR 139 2HG2 THR 139 10.754 2.708 -1.646 802 3HG2 THR 139 3HG2 THR 139 11.299 2.400 -3.294 803 H LYS 140 H LYS 140 13.976 6.713 -1.207 804 HA LYS 140 HA LYS 140 16.689 5.861 -1.413 805 1HB LYS 140 2HB LYS 140 15.405 8.561 -1.043 806 2HB LYS 140 1HB LYS 140 17.149 8.354 -1.119 807 1HG LYS 140 2HG LYS 140 16.270 6.991 -3.338 808 2HG LYS 140 1HG LYS 140 15.169 8.367 -3.250 809 1HD LYS 140 2HD LYS 140 16.791 9.484 -4.325 810 2HD LYS 140 1HD LYS 140 17.587 9.540 -2.751 811 1HE LYS 140 2HE LYS 140 19.279 8.669 -4.017 812 2HE LYS 140 1HE LYS 140 18.488 7.181 -3.500 813 1HZ LYS 140 1HZ LYS 140 18.000 8.556 -6.088 814 2HZ LYS 140 2HZ LYS 140 17.324 7.086 -5.595 815 3HZ LYS 140 3HZ LYS 140 18.987 7.198 -5.881 816 H ASN 141 H ASN 141 17.971 5.250 0.112 817 HA ASN 141 HA ASN 141 18.999 5.011 2.102 818 1HB ASN 141 2HB ASN 141 17.902 7.736 2.253 819 2HB ASN 141 1HB ASN 141 18.226 6.992 3.816 820 1HD2 ASN 141 1HD2 ASN 141 19.679 7.698 0.681 821 2HD2 ASN 141 2HD2 ASN 141 21.295 7.867 1.267 822 H VAL 142 H VAL 142 16.006 4.308 1.563 823 HA VAL 142 HA VAL 142 15.079 3.983 4.311 824 HB VAL 142 HB VAL 142 13.663 3.156 1.777 825 1HG1 VAL 142 1HG1 VAL 142 11.659 3.243 3.189 826 2HG1 VAL 142 2HG1 VAL 142 12.664 3.649 4.580 827 3HG1 VAL 142 3HG1 VAL 142 12.837 2.079 3.795 828 1HG2 VAL 142 1HG2 VAL 142 14.182 5.793 2.794 829 2HG2 VAL 142 2HG2 VAL 142 12.453 5.454 2.842 830 3HG2 VAL 142 3HG2 VAL 142 13.338 5.309 1.324 831 H ASN 143 H ASN 143 14.735 2.012 5.289 832 HA ASN 143 HA ASN 143 16.376 -0.156 4.373 833 1HB ASN 143 2HB ASN 143 14.682 0.364 6.786 834 2HB ASN 143 1HB ASN 143 15.198 -1.284 6.440 835 1HD2 ASN 143 1HD2 ASN 143 17.290 -1.864 6.764 836 2HD2 ASN 143 2HD2 ASN 143 18.474 -0.825 7.473 837 HA PRO 144 HA PRO 144 12.867 -1.949 2.180 838 1HB PRO 144 2HB PRO 144 14.249 -3.519 0.530 839 2HB PRO 144 1HB PRO 144 14.260 -1.762 0.333 840 1HG PRO 144 2HG PRO 144 16.327 -3.546 1.550 841 2HG PRO 144 1HG PRO 144 16.542 -2.138 0.494 842 1HD PRO 144 2HD PRO 144 16.784 -2.110 3.263 843 2HD PRO 144 1HD PRO 144 16.488 -0.683 2.252 844 H ASN 145 H ASN 145 13.971 -3.029 4.795 845 HA ASN 145 HA ASN 145 13.881 -5.903 4.383 846 1HB ASN 145 2HB ASN 145 14.458 -4.131 6.734 847 2HB ASN 145 1HB ASN 145 14.100 -5.838 6.976 848 1HD2 ASN 145 1HD2 ASN 145 16.099 -3.789 4.877 849 2HD2 ASN 145 2HD2 ASN 145 17.505 -4.790 4.955 850 H TRP 146 H TRP 146 11.523 -3.790 4.290 851 HA TRP 146 HA TRP 146 9.723 -4.723 6.301 852 1HB TRP 146 2HB TRP 146 7.996 -3.554 4.757 853 2HB TRP 146 1HB TRP 146 9.197 -2.574 5.589 854 HD1 TRP 146 HD TRP 146 11.067 -1.397 4.103 855 HE1 TRP 146 1HE TRP 146 11.204 -0.888 1.584 856 HE3 TRP 146 3HE TRP 146 7.361 -4.510 2.432 857 HZ2 TRP 146 2HZ TRP 146 9.910 -1.692 -0.790 858 HZ3 TRP 146 3HZ TRP 146 6.870 -4.565 0.032 859 HH2 TRP 146 HH TRP 146 8.119 -3.193 -1.547 860 H SER 147 H SER 147 10.308 -5.522 2.926 861 HA SER 147 HA SER 147 8.045 -7.312 2.799 862 1HB SER 147 2HB SER 147 9.421 -7.933 0.578 863 2HB SER 147 1HB SER 147 8.383 -6.511 0.685 864 HG SER 147 HG SER 147 10.577 -6.156 -0.126 865 H VAL 148 H VAL 148 10.900 -7.575 4.351 866 HA VAL 148 HA VAL 148 11.516 -10.311 3.582 867 HB VAL 148 HB VAL 148 12.785 -8.680 5.781 868 1HG1 VAL 148 1HG1 VAL 148 13.134 -11.126 5.864 869 2HG1 VAL 148 2HG1 VAL 148 14.627 -10.231 5.577 870 3HG1 VAL 148 3HG1 VAL 148 13.822 -11.058 4.243 871 1HG2 VAL 148 1HG2 VAL 148 12.918 -7.561 3.559 872 2HG2 VAL 148 2HG2 VAL 148 13.752 -8.987 2.942 873 3HG2 VAL 148 3HG2 VAL 148 14.487 -8.021 4.221 874 H ASN 149 H ASN 149 9.777 -8.598 6.037 875 HA ASN 149 HA ASN 149 9.679 -10.921 7.796 876 1HB ASN 149 2HB ASN 149 8.976 -8.044 8.035 877 2HB ASN 149 1HB ASN 149 8.029 -9.175 8.998 878 1HD2 ASN 149 1HD2 ASN 149 8.952 -8.124 10.838 879 2HD2 ASN 149 2HD2 ASN 149 10.534 -8.555 11.380 880 H VAL 150 H VAL 150 8.603 -11.836 5.647 881 HA VAL 150 HA VAL 150 5.701 -11.399 5.759 882 HB VAL 150 HB VAL 150 5.716 -12.793 3.626 883 1HG1 VAL 150 1HG1 VAL 150 7.324 -10.347 3.140 884 2HG1 VAL 150 2HG1 VAL 150 5.783 -10.166 3.976 885 3HG1 VAL 150 3HG1 VAL 150 5.835 -10.895 2.371 886 1HG2 VAL 150 1HG2 VAL 150 7.625 -13.501 2.671 887 2HG2 VAL 150 2HG2 VAL 150 8.291 -13.340 4.297 888 3HG2 VAL 150 3HG2 VAL 150 8.509 -12.043 3.122 Start of MODEL 13 1 1H GLY 38 1HT GLY 38 -7.907 -28.496 15.542 2 2H GLY 38 2HT GLY 38 -6.984 -28.621 14.131 3 3H GLY 38 3HT GLY 38 -6.490 -29.421 15.537 4 1HA GLY 38 1HA GLY 38 -8.952 -30.431 15.219 5 2HA GLY 38 2HA GLY 38 -8.450 -30.193 13.553 6 H ALA 39 H ALA 39 -8.661 -32.473 15.792 7 HA ALA 39 HA ALA 39 -6.060 -33.716 15.286 8 1HB ALA 39 1HB ALA 39 -8.286 -34.562 17.139 9 2HB ALA 39 2HB ALA 39 -6.835 -33.669 17.599 10 3HB ALA 39 3HB ALA 39 -6.701 -35.326 17.010 11 H MET 40 H MET 40 -9.448 -34.038 14.523 12 HA MET 40 HA MET 40 -8.795 -36.043 12.523 13 1HB MET 40 2HB MET 40 -10.487 -36.558 14.923 14 2HB MET 40 1HB MET 40 -10.993 -37.261 13.392 15 1HG MET 40 2HG MET 40 -8.241 -37.783 13.645 16 2HG MET 40 1HG MET 40 -8.973 -38.140 15.209 17 1HE MET 40 1HE MET 40 -9.312 -39.764 11.176 18 2HE MET 40 2HE MET 40 -8.220 -40.767 12.130 19 3HE MET 40 3HE MET 40 -7.975 -39.023 12.056 20 H ASP 41 H ASP 41 -9.527 -33.330 12.288 21 HA ASP 41 HA ASP 41 -11.795 -33.606 10.539 22 1HB ASP 41 2HB ASP 41 -13.088 -31.760 11.603 23 2HB ASP 41 1HB ASP 41 -12.994 -33.210 12.600 24 HA PRO 42 HA PRO 42 -9.252 -30.557 8.521 25 1HB PRO 42 2HB PRO 42 -10.847 -30.039 6.407 26 2HB PRO 42 1HB PRO 42 -9.941 -31.549 6.558 27 1HG PRO 42 2HG PRO 42 -12.822 -31.001 7.158 28 2HG PRO 42 1HG PRO 42 -12.099 -32.385 6.318 29 1HD PRO 42 2HD PRO 42 -12.854 -32.472 8.931 30 2HD PRO 42 1HD PRO 42 -11.505 -33.429 8.283 31 H GLU 43 H GLU 43 -12.557 -29.985 9.487 32 HA GLU 43 HA GLU 43 -13.620 -28.126 10.252 33 1HB GLU 43 2HB GLU 43 -10.805 -27.515 10.614 34 2HB GLU 43 1HB GLU 43 -11.736 -26.062 10.280 35 1HG GLU 43 2HG GLU 43 -12.884 -27.908 12.268 36 2HG GLU 43 1HG GLU 43 -11.394 -27.087 12.730 37 H PHE 44 H PHE 44 -13.637 -28.722 7.514 38 HA PHE 44 HA PHE 44 -14.312 -27.848 5.529 39 1HB PHE 44 2HB PHE 44 -14.868 -25.583 7.410 40 2HB PHE 44 1HB PHE 44 -15.045 -25.332 5.677 41 HD1 PHE 44 1HD PHE 44 -16.124 -27.593 8.423 42 HD2 PHE 44 2HD PHE 44 -17.023 -25.902 4.623 43 HE1 PHE 44 1HE PHE 44 -18.369 -28.594 8.514 44 HE2 PHE 44 2HE PHE 44 -19.272 -26.899 4.707 45 HZ PHE 44 HZ PHE 44 -19.947 -28.247 6.654 46 H ALA 45 H ALA 45 -13.097 -27.364 3.831 47 HA ALA 45 HA ALA 45 -11.389 -25.072 3.738 48 1HB ALA 45 1HB ALA 45 -10.204 -27.136 4.996 49 2HB ALA 45 2HB ALA 45 -9.330 -25.944 4.034 50 3HB ALA 45 3HB ALA 45 -9.769 -27.500 3.327 51 H LEU 46 H LEU 46 -12.090 -24.435 1.790 52 HA LEU 46 HA LEU 46 -12.528 -26.342 -0.342 53 1HB LEU 46 2HB LEU 46 -13.115 -24.239 -1.656 54 2HB LEU 46 1HB LEU 46 -14.161 -24.685 -0.326 55 HG LEU 46 HG LEU 46 -13.513 -22.202 -0.662 56 1HD1 LEU 46 1HD1 LEU 46 -13.096 -22.301 2.061 57 2HD1 LEU 46 2HD1 LEU 46 -13.968 -23.795 1.714 58 3HD1 LEU 46 3HD1 LEU 46 -14.655 -22.243 1.238 59 1HD2 LEU 46 1HD2 LEU 46 -11.135 -22.414 -0.853 60 2HD2 LEU 46 2HD2 LEU 46 -11.034 -23.252 0.694 61 3HD2 LEU 46 3HD2 LEU 46 -11.498 -21.553 0.642 62 H SER 47 H SER 47 -9.792 -26.066 0.569 63 HA SER 47 HA SER 47 -7.669 -25.753 -0.202 64 1HB SER 47 2HB SER 47 -7.285 -26.484 -2.469 65 2HB SER 47 1HB SER 47 -8.587 -27.461 -1.792 66 HG SER 47 HG SER 47 -8.866 -25.229 -3.523 67 H ASN 48 H ASN 48 -6.491 -24.632 -2.334 68 HA ASN 48 HA ASN 48 -5.834 -22.658 -3.249 69 1HB ASN 48 2HB ASN 48 -8.685 -22.716 -3.534 70 2HB ASN 48 1HB ASN 48 -8.183 -21.064 -3.188 71 1HD2 ASN 48 1HD2 ASN 48 -6.951 -23.789 -5.106 72 2HD2 ASN 48 2HD2 ASN 48 -6.678 -22.872 -6.543 73 H GLU 49 H GLU 49 -4.701 -21.082 -2.320 74 HA GLU 49 HA GLU 49 -5.812 -19.363 -0.313 75 1HB GLU 49 2HB GLU 49 -4.304 -19.953 1.492 76 2HB GLU 49 1HB GLU 49 -5.251 -21.360 1.026 77 1HG GLU 49 2HG GLU 49 -3.029 -21.619 -0.540 78 2HG GLU 49 1HG GLU 49 -2.369 -20.922 0.940 79 H LYS 50 H LYS 50 -5.143 -17.510 -1.194 80 HA LYS 50 HA LYS 50 -2.489 -17.305 -2.366 81 1HB LYS 50 2HB LYS 50 -4.856 -15.440 -2.266 82 2HB LYS 50 1HB LYS 50 -3.294 -14.946 -2.905 83 1HG LYS 50 2HG LYS 50 -3.439 -16.390 -4.721 84 2HG LYS 50 1HG LYS 50 -4.681 -17.382 -3.952 85 1HD LYS 50 2HD LYS 50 -6.321 -15.657 -4.233 86 2HD LYS 50 1HD LYS 50 -5.096 -14.516 -4.791 87 1HE LYS 50 2HE LYS 50 -5.095 -15.347 -6.880 88 2HE LYS 50 1HE LYS 50 -5.228 -17.015 -6.323 89 1HZ LYS 50 1HZ LYS 50 -7.188 -15.710 -7.562 90 2HZ LYS 50 2HZ LYS 50 -7.593 -15.372 -5.956 91 3HZ LYS 50 3HZ LYS 50 -7.458 -16.977 -6.473 92 H LYS 51 H LYS 51 -0.800 -16.229 -1.502 93 HA LYS 51 HA LYS 51 -0.988 -15.440 1.265 94 1HB LYS 51 2HB LYS 51 1.433 -15.180 -0.507 95 2HB LYS 51 1HB LYS 51 1.385 -15.317 1.244 96 1HG LYS 51 2HG LYS 51 0.117 -17.597 0.050 97 2HG LYS 51 1HG LYS 51 1.730 -17.367 -0.630 98 1HD LYS 51 2HD LYS 51 2.299 -16.988 1.957 99 2HD LYS 51 1HD LYS 51 0.906 -18.058 2.131 100 1HE LYS 51 2HE LYS 51 3.042 -19.285 2.061 101 2HE LYS 51 1HE LYS 51 1.963 -19.725 0.739 102 1HZ LYS 51 1HZ LYS 51 3.887 -17.589 0.236 103 2HZ LYS 51 2HZ LYS 51 3.320 -18.800 -0.800 104 3HZ LYS 51 3HZ LYS 51 4.500 -19.161 0.356 105 H ALA 52 H ALA 52 -1.819 -13.849 -1.430 106 HA ALA 52 HA ALA 52 -2.112 -11.664 -1.994 107 1HB ALA 52 1HB ALA 52 -2.512 -10.115 -0.248 108 2HB ALA 52 2HB ALA 52 -1.502 -11.018 0.882 109 3HB ALA 52 3HB ALA 52 -3.046 -11.685 0.352 110 H LYS 53 H LYS 53 -1.017 -9.561 -2.231 111 HA LYS 53 HA LYS 53 1.882 -9.943 -2.313 112 1HB LYS 53 2HB LYS 53 0.380 -7.643 -3.542 113 2HB LYS 53 1HB LYS 53 1.957 -8.281 -3.988 114 1HG LYS 53 2HG LYS 53 -0.192 -10.236 -4.250 115 2HG LYS 53 1HG LYS 53 -0.408 -8.807 -5.262 116 1HD LYS 53 2HD LYS 53 1.863 -9.123 -6.158 117 2HD LYS 53 1HD LYS 53 2.036 -10.577 -5.172 118 1HE LYS 53 2HE LYS 53 0.735 -11.816 -6.538 119 2HE LYS 53 1HE LYS 53 -0.362 -10.478 -6.877 120 1HZ LYS 53 1HZ LYS 53 2.019 -11.329 -8.301 121 2HZ LYS 53 2HZ LYS 53 1.831 -9.656 -8.138 122 3HZ LYS 53 3HZ LYS 53 0.621 -10.574 -8.881 123 H LYS 54 H LYS 54 3.264 -8.788 -1.086 124 HA LYS 54 HA LYS 54 2.137 -6.956 0.857 125 1HB LYS 54 2HB LYS 54 3.685 -8.833 1.530 126 2HB LYS 54 1HB LYS 54 4.976 -7.967 0.711 127 1HG LYS 54 2HG LYS 54 5.347 -6.823 2.562 128 2HG LYS 54 1HG LYS 54 3.735 -6.117 2.426 129 1HD LYS 54 2HD LYS 54 4.094 -8.836 3.624 130 2HD LYS 54 1HD LYS 54 4.398 -7.392 4.592 131 1HE LYS 54 2HE LYS 54 2.211 -6.858 4.716 132 2HE LYS 54 1HE LYS 54 1.885 -7.379 3.063 133 1HZ LYS 54 1HZ LYS 54 2.413 -9.359 5.184 134 2HZ LYS 54 2HZ LYS 54 1.584 -9.561 3.724 135 3HZ LYS 54 3HZ LYS 54 0.867 -8.700 4.991 136 H VAL 55 H VAL 55 2.231 -4.896 0.600 137 HA VAL 55 HA VAL 55 4.373 -3.715 -1.043 138 HB VAL 55 HB VAL 55 2.747 -1.953 -1.731 139 1HG1 VAL 55 1HG1 VAL 55 1.497 -4.391 -2.775 140 2HG1 VAL 55 2HG1 VAL 55 3.255 -4.329 -2.902 141 3HG1 VAL 55 3HG1 VAL 55 2.272 -3.050 -3.619 142 1HG2 VAL 55 1HG2 VAL 55 1.041 -2.025 -0.159 143 2HG2 VAL 55 2HG2 VAL 55 0.855 -3.776 -0.302 144 3HG2 VAL 55 3HG2 VAL 55 0.303 -2.724 -1.604 145 H ARG 56 H ARG 56 4.916 -1.549 -0.541 146 HA ARG 56 HA ARG 56 4.342 -0.828 2.247 147 1HB ARG 56 2HB ARG 56 6.773 -0.974 0.828 148 2HB ARG 56 1HB ARG 56 6.435 0.743 0.996 149 1HG ARG 56 2HG ARG 56 6.153 -0.971 3.402 150 2HG ARG 56 1HG ARG 56 7.779 -0.604 2.823 151 1HD ARG 56 2HD ARG 56 6.313 1.809 2.769 152 2HD ARG 56 1HD ARG 56 5.983 1.040 4.320 153 HE ARG 56 HE ARG 56 8.482 2.163 3.431 154 1HH1 ARG 56 1HH1 ARG 56 6.952 -0.059 5.646 155 2HH1 ARG 56 2HH1 ARG 56 8.253 -0.011 6.788 156 1HH2 ARG 56 1HH2 ARG 56 10.193 2.226 4.932 157 2HH2 ARG 56 2HH2 ARG 56 10.093 1.285 6.384 158 H PHE 57 H PHE 57 2.614 0.489 2.240 159 HA PHE 57 HA PHE 57 2.225 2.303 0.009 160 1HB PHE 57 2HB PHE 57 0.519 1.445 2.327 161 2HB PHE 57 1HB PHE 57 0.072 2.829 1.336 162 HD1 PHE 57 1HD PHE 57 1.631 0.879 -0.984 163 HD2 PHE 57 2HD PHE 57 -1.861 0.830 1.458 164 HE1 PHE 57 1HE PHE 57 0.534 -0.603 -2.586 165 HE2 PHE 57 2HE PHE 57 -2.958 -0.670 -0.151 166 HZ PHE 57 HZ PHE 57 -1.763 -1.386 -2.179 167 H TYR 58 H TYR 58 2.632 4.336 -0.005 168 HA TYR 58 HA TYR 58 3.269 5.731 2.504 169 1HB TYR 58 2HB TYR 58 4.363 6.389 -0.219 170 2HB TYR 58 1HB TYR 58 4.837 7.096 1.307 171 HD1 TYR 58 1HD TYR 58 6.204 5.818 2.907 172 HD2 TYR 58 2HD TYR 58 5.257 4.255 -0.937 173 HE1 TYR 58 1HE TYR 58 7.991 4.147 3.152 174 HE2 TYR 58 2HE TYR 58 7.038 2.579 -0.699 175 HH TYR 58 HH TYR 58 8.300 1.469 1.085 176 H ARG 59 H ARG 59 2.524 7.821 2.728 177 HA ARG 59 HA ARG 59 0.258 8.461 0.988 178 1HB ARG 59 2HB ARG 59 0.938 9.985 3.484 179 2HB ARG 59 1HB ARG 59 -0.632 9.743 2.731 180 1HG ARG 59 2HG ARG 59 -1.043 8.023 4.058 181 2HG ARG 59 1HG ARG 59 0.424 7.208 3.514 182 1HD ARG 59 2HD ARG 59 0.317 7.596 5.977 183 2HD ARG 59 1HD ARG 59 1.733 8.294 5.193 184 HE ARG 59 HE ARG 59 -0.013 10.348 5.209 185 1HH1 ARG 59 1HH1 ARG 59 1.108 8.182 7.705 186 2HH1 ARG 59 2HH1 ARG 59 0.933 9.350 8.971 187 1HH2 ARG 59 1HH2 ARG 59 -0.242 11.886 6.872 188 2HH2 ARG 59 2HH2 ARG 59 0.166 11.451 8.499 189 H ASN 60 H ASN 60 0.607 9.788 -0.614 190 HA ASN 60 HA ASN 60 2.860 11.131 -1.275 191 1HB ASN 60 2HB ASN 60 1.039 10.872 -2.829 192 2HB ASN 60 1HB ASN 60 0.005 11.909 -1.860 193 1HD2 ASN 60 1HD2 ASN 60 -0.029 12.746 -4.216 194 2HD2 ASN 60 2HD2 ASN 60 1.049 14.057 -4.533 195 H GLY 61 H GLY 61 3.920 12.900 -0.692 196 1HA GLY 61 2HA GLY 61 4.364 14.956 0.274 197 2HA GLY 61 1HA GLY 61 2.642 15.144 0.573 198 H ASP 62 H ASP 62 4.755 12.519 1.639 199 HA ASP 62 HA ASP 62 4.753 13.510 4.370 200 1HB ASP 62 2HB ASP 62 2.639 12.026 3.823 201 2HB ASP 62 1HB ASP 62 3.786 10.702 4.002 202 H ARG 63 H ARG 63 7.008 13.611 3.554 203 HA ARG 63 HA ARG 63 8.425 11.151 3.151 204 1HB ARG 63 2HB ARG 63 10.377 12.519 2.888 205 2HB ARG 63 1HB ARG 63 9.035 13.289 2.051 206 1HG ARG 63 2HG ARG 63 9.515 14.132 4.844 207 2HG ARG 63 1HG ARG 63 10.715 14.614 3.644 208 1HD ARG 63 2HD ARG 63 8.574 15.306 2.276 209 2HD ARG 63 1HD ARG 63 7.845 15.375 3.880 210 HE ARG 63 HE ARG 63 9.069 17.260 4.327 211 1HH1 ARG 63 1HH1 ARG 63 10.346 15.726 1.464 212 2HH1 ARG 63 2HH1 ARG 63 11.395 17.046 1.072 213 1HH2 ARG 63 1HH2 ARG 63 10.449 18.998 3.813 214 2HH2 ARG 63 2HH2 ARG 63 11.454 18.904 2.406 215 H TYR 64 H TYR 64 7.093 12.116 5.876 216 HA TYR 64 HA TYR 64 9.313 11.114 7.515 217 1HB TYR 64 2HB TYR 64 7.751 13.614 7.834 218 2HB TYR 64 1HB TYR 64 8.064 12.689 9.298 219 HD1 TYR 64 1HD TYR 64 10.701 11.722 9.151 220 HD2 TYR 64 2HD TYR 64 9.193 15.393 7.619 221 HE1 TYR 64 1HE TYR 64 12.954 12.699 9.290 222 HE2 TYR 64 2HE TYR 64 11.441 16.379 7.753 223 HH TYR 64 HH TYR 64 13.602 15.836 9.278 224 H PHE 65 H PHE 65 7.919 9.178 6.911 225 HA PHE 65 HA PHE 65 6.359 8.465 9.201 226 1HB PHE 65 2HB PHE 65 4.602 9.624 8.038 227 2HB PHE 65 1HB PHE 65 4.986 8.804 6.531 228 HD1 PHE 65 1HD PHE 65 4.325 7.683 10.034 229 HD2 PHE 65 2HD PHE 65 3.350 7.339 5.906 230 HE1 PHE 65 1HE PHE 65 2.685 5.929 10.571 231 HE2 PHE 65 2HE PHE 65 1.708 5.586 6.433 232 HZ PHE 65 HZ PHE 65 1.373 4.879 8.771 233 H LYS 66 H LYS 66 7.402 7.673 5.927 234 HA LYS 66 HA LYS 66 8.425 5.795 5.124 235 1HB LYS 66 2HB LYS 66 7.870 4.420 7.751 236 2HB LYS 66 1HB LYS 66 9.042 3.962 6.525 237 1HG LYS 66 2HG LYS 66 9.225 6.596 7.940 238 2HG LYS 66 1HG LYS 66 9.892 5.120 8.640 239 1HD LYS 66 2HD LYS 66 11.740 5.711 7.492 240 2HD LYS 66 1HD LYS 66 10.891 4.980 6.128 241 1HE LYS 66 2HE LYS 66 10.086 7.119 5.406 242 2HE LYS 66 1HE LYS 66 10.708 7.898 6.860 243 1HZ LYS 66 1HZ LYS 66 12.021 7.917 4.586 244 2HZ LYS 66 2HZ LYS 66 12.623 6.458 5.193 245 3HZ LYS 66 3HZ LYS 66 12.819 7.885 6.078 246 H GLY 67 H GLY 67 5.295 6.201 5.929 247 1HA GLY 67 2HA GLY 67 3.361 5.269 5.128 248 2HA GLY 67 1HA GLY 67 4.363 4.321 4.043 249 H ILE 68 H ILE 68 2.260 3.038 4.766 250 HA ILE 68 HA ILE 68 3.116 1.205 6.907 251 HB ILE 68 HB ILE 68 1.172 2.411 7.691 252 1HG1 ILE 68 2HG1 ILE 68 0.246 -0.320 6.789 253 2HG1 ILE 68 1HG1 ILE 68 1.375 -0.065 8.116 254 1HG2 ILE 68 1HG2 ILE 68 -0.589 3.019 6.447 255 2HG2 ILE 68 2HG2 ILE 68 -0.737 1.419 5.716 256 3HG2 ILE 68 3HG2 ILE 68 0.421 2.578 5.067 257 1HD1 ILE 68 1HD1 ILE 68 -0.234 0.725 9.510 258 2HD1 ILE 68 2HD1 ILE 68 -1.214 -0.349 8.513 259 3HD1 ILE 68 3HD1 ILE 68 -1.208 1.386 8.197 260 H VAL 69 H VAL 69 3.046 -0.965 6.454 261 HA VAL 69 HA VAL 69 2.757 -1.680 3.661 262 HB VAL 69 HB VAL 69 3.473 -3.521 5.940 263 1HG1 VAL 69 1HG1 VAL 69 3.906 -5.096 4.396 264 2HG1 VAL 69 2HG1 VAL 69 4.621 -3.939 3.274 265 3HG1 VAL 69 3HG1 VAL 69 2.870 -4.124 3.351 266 1HG2 VAL 69 1HG2 VAL 69 4.921 -1.281 5.097 267 2HG2 VAL 69 2HG2 VAL 69 5.723 -2.668 4.361 268 3HG2 VAL 69 3HG2 VAL 69 5.492 -2.607 6.108 269 H TYR 70 H TYR 70 1.165 -2.839 2.762 270 HA TYR 70 HA TYR 70 -0.798 -4.136 4.487 271 1HB TYR 70 2HB TYR 70 -1.252 -1.871 2.715 272 2HB TYR 70 1HB TYR 70 -2.277 -3.242 2.311 273 HD1 TYR 70 1HD TYR 70 -1.096 -1.665 5.505 274 HD2 TYR 70 2HD TYR 70 -4.374 -3.084 3.191 275 HE1 TYR 70 1HE TYR 70 -2.635 -1.092 7.339 276 HE2 TYR 70 2HE TYR 70 -5.919 -2.512 5.016 277 HH TYR 70 HH TYR 70 -6.089 -1.211 6.949 278 H ALA 71 H ALA 71 -1.827 -5.873 3.609 279 HA ALA 71 HA ALA 71 -0.470 -7.110 1.325 280 1HB ALA 71 1HB ALA 71 -1.578 -9.207 2.151 281 2HB ALA 71 2HB ALA 71 -2.155 -8.281 3.536 282 3HB ALA 71 3HB ALA 71 -0.424 -8.492 3.276 283 H VAL 72 H VAL 72 -1.657 -7.887 -0.449 284 HA VAL 72 HA VAL 72 -4.517 -7.289 -0.475 285 HB VAL 72 HB VAL 72 -2.951 -6.525 -2.896 286 1HG1 VAL 72 1HG1 VAL 72 -5.234 -4.982 -1.794 287 2HG1 VAL 72 2HG1 VAL 72 -5.560 -6.586 -2.448 288 3HG1 VAL 72 3HG1 VAL 72 -4.820 -5.353 -3.468 289 1HG2 VAL 72 1HG2 VAL 72 -1.763 -5.415 -1.052 290 2HG2 VAL 72 2HG2 VAL 72 -3.285 -4.719 -0.496 291 3HG2 VAL 72 3HG2 VAL 72 -2.623 -4.257 -2.066 292 H SER 73 H SER 73 -5.715 -8.662 -1.586 293 HA SER 73 HA SER 73 -4.605 -10.419 -3.597 294 1HB SER 73 2HB SER 73 -4.416 -11.353 -1.067 295 2HB SER 73 1HB SER 73 -6.043 -11.902 -1.468 296 HG SER 73 HG SER 73 -5.114 -13.443 -2.531 297 H SER 74 H SER 74 -6.695 -12.291 -3.644 298 HA SER 74 HA SER 74 -8.833 -10.601 -4.669 299 1HB SER 74 2HB SER 74 -9.665 -13.072 -5.304 300 2HB SER 74 1HB SER 74 -8.486 -12.189 -6.274 301 HG SER 74 HG SER 74 -6.952 -13.506 -5.629 302 H ASP 75 H ASP 75 -8.212 -12.772 -2.024 303 HA ASP 75 HA ASP 75 -10.990 -13.098 -1.346 304 1HB ASP 75 2HB ASP 75 -8.436 -14.240 -0.563 305 2HB ASP 75 1HB ASP 75 -9.458 -13.908 0.824 306 H ARG 76 H ARG 76 -8.434 -10.895 -0.579 307 HA ARG 76 HA ARG 76 -9.804 -9.920 1.802 308 1HB ARG 76 2HB ARG 76 -7.097 -9.926 0.868 309 2HB ARG 76 1HB ARG 76 -7.593 -8.267 1.171 310 1HG ARG 76 2HG ARG 76 -8.537 -9.585 3.381 311 2HG ARG 76 1HG ARG 76 -7.023 -10.425 3.040 312 1HD ARG 76 2HD ARG 76 -6.408 -7.736 2.721 313 2HD ARG 76 1HD ARG 76 -7.475 -7.775 4.124 314 HE ARG 76 HE ARG 76 -5.747 -8.658 5.305 315 1HH1 ARG 76 1HH1 ARG 76 -5.242 -9.413 1.935 316 2HH1 ARG 76 2HH1 ARG 76 -3.717 -10.186 2.208 317 1HH2 ARG 76 1HH2 ARG 76 -3.740 -9.673 5.665 318 2HH2 ARG 76 2HH2 ARG 76 -2.863 -10.334 4.324 319 H PHE 77 H PHE 77 -8.792 -8.714 -1.384 320 HA PHE 77 HA PHE 77 -10.841 -6.620 -1.134 321 1HB PHE 77 2HB PHE 77 -8.099 -6.276 -2.360 322 2HB PHE 77 1HB PHE 77 -9.364 -5.051 -2.302 323 HD1 PHE 77 1HD PHE 77 -10.233 -4.428 0.065 324 HD2 PHE 77 2HD PHE 77 -6.513 -6.354 -0.685 325 HE1 PHE 77 1HE PHE 77 -9.406 -3.675 2.256 326 HE2 PHE 77 2HE PHE 77 -5.679 -5.603 1.505 327 HZ PHE 77 HZ PHE 77 -7.126 -4.262 2.979 328 H ARG 78 H ARG 78 -12.315 -6.773 -2.647 329 HA ARG 78 HA ARG 78 -12.148 -8.552 -4.818 330 1HB ARG 78 2HB ARG 78 -14.077 -6.724 -3.641 331 2HB ARG 78 1HB ARG 78 -14.179 -6.749 -5.388 332 1HG ARG 78 2HG ARG 78 -13.999 -9.424 -4.673 333 2HG ARG 78 1HG ARG 78 -15.055 -8.704 -3.456 334 1HD ARG 78 2HD ARG 78 -15.786 -7.674 -6.006 335 2HD ARG 78 1HD ARG 78 -15.672 -9.429 -6.128 336 HE ARG 78 HE ARG 78 -17.524 -9.613 -4.789 337 1HH1 ARG 78 1HH1 ARG 78 -16.305 -6.349 -4.604 338 2HH1 ARG 78 2HH1 ARG 78 -17.671 -5.755 -3.719 339 1HH2 ARG 78 1HH2 ARG 78 -19.322 -8.835 -3.627 340 2HH2 ARG 78 2HH2 ARG 78 -19.383 -7.167 -3.164 341 H SER 79 H SER 79 -11.385 -5.180 -4.431 342 HA SER 79 HA SER 79 -10.047 -5.109 -6.959 343 1HB SER 79 2HB SER 79 -12.627 -3.577 -6.619 344 2HB SER 79 1HB SER 79 -11.410 -3.139 -7.818 345 HG SER 79 HG SER 79 -11.773 -5.001 -8.889 346 H PHE 80 H PHE 80 -9.463 -2.648 -7.435 347 HA PHE 80 HA PHE 80 -7.796 -1.810 -5.347 348 1HB PHE 80 2HB PHE 80 -8.054 -1.200 -8.010 349 2HB PHE 80 1HB PHE 80 -8.576 0.295 -7.244 350 HD1 PHE 80 1HD PHE 80 -6.876 1.837 -7.383 351 HD2 PHE 80 2HD PHE 80 -5.930 -2.184 -6.368 352 HE1 PHE 80 1HE PHE 80 -4.531 2.480 -7.053 353 HE2 PHE 80 2HE PHE 80 -3.579 -1.549 -6.030 354 HZ PHE 80 HZ PHE 80 -2.875 0.784 -6.373 355 H ASP 81 H ASP 81 -11.062 -0.881 -6.224 356 HA ASP 81 HA ASP 81 -11.275 1.449 -4.675 357 1HB ASP 81 2HB ASP 81 -12.915 0.212 -6.422 358 2HB ASP 81 1HB ASP 81 -13.681 -0.267 -4.911 359 H ALA 82 H ALA 82 -11.838 -1.944 -3.897 360 HA ALA 82 HA ALA 82 -12.852 -1.507 -1.286 361 1HB ALA 82 1HB ALA 82 -13.349 -3.634 -1.641 362 2HB ALA 82 2HB ALA 82 -11.662 -4.016 -1.296 363 3HB ALA 82 3HB ALA 82 -12.183 -3.748 -2.959 364 H LEU 83 H LEU 83 -9.617 -2.179 -2.556 365 HA LEU 83 HA LEU 83 -8.314 -2.413 -0.060 366 1HB LEU 83 2HB LEU 83 -7.284 -3.132 -2.164 367 2HB LEU 83 1HB LEU 83 -7.260 -1.480 -2.735 368 HG LEU 83 HG LEU 83 -5.661 -0.872 -0.989 369 1HD1 LEU 83 1HD1 LEU 83 -5.444 -3.778 -0.278 370 2HD1 LEU 83 2HD1 LEU 83 -6.504 -2.677 0.601 371 3HD1 LEU 83 3HD1 LEU 83 -4.766 -2.381 0.559 372 1HD2 LEU 83 1HD2 LEU 83 -5.140 -2.224 -3.278 373 2HD2 LEU 83 2HD2 LEU 83 -4.336 -3.250 -2.090 374 3HD2 LEU 83 3HD2 LEU 83 -3.906 -1.545 -2.218 375 H LEU 84 H LEU 84 -8.798 0.234 -2.309 376 HA LEU 84 HA LEU 84 -7.493 2.242 -0.870 377 1HB LEU 84 2HB LEU 84 -9.711 2.258 -2.890 378 2HB LEU 84 1HB LEU 84 -9.159 3.752 -2.150 379 HG LEU 84 HG LEU 84 -7.394 1.848 -3.688 380 1HD1 LEU 84 1HD1 LEU 84 -8.538 2.714 -5.428 381 2HD1 LEU 84 2HD1 LEU 84 -7.444 4.074 -5.173 382 3HD1 LEU 84 3HD1 LEU 84 -9.080 4.122 -4.516 383 1HD2 LEU 84 1HD2 LEU 84 -5.991 2.972 -2.228 384 2HD2 LEU 84 2HD2 LEU 84 -6.950 4.453 -2.289 385 3HD2 LEU 84 3HD2 LEU 84 -5.952 3.994 -3.668 386 H ALA 85 H ALA 85 -10.747 0.899 -0.607 387 HA ALA 85 HA ALA 85 -11.816 2.903 1.094 388 1HB ALA 85 1HB ALA 85 -13.139 1.161 -0.110 389 2HB ALA 85 2HB ALA 85 -13.545 1.317 1.599 390 3HB ALA 85 3HB ALA 85 -12.538 -0.023 1.050 391 H ASP 86 H ASP 86 -10.179 -0.165 1.735 392 HA ASP 86 HA ASP 86 -10.271 0.089 4.575 393 1HB ASP 86 2HB ASP 86 -9.047 -1.766 2.614 394 2HB ASP 86 1HB ASP 86 -8.233 -1.648 4.170 395 H LEU 87 H LEU 87 -8.047 0.967 2.035 396 HA LEU 87 HA LEU 87 -5.791 1.558 3.609 397 1HB LEU 87 2HB LEU 87 -6.758 2.520 0.930 398 2HB LEU 87 1HB LEU 87 -5.320 3.212 1.648 399 HG LEU 87 HG LEU 87 -5.754 0.450 0.582 400 1HD1 LEU 87 1HD1 LEU 87 -4.033 0.936 -0.829 401 2HD1 LEU 87 2HD1 LEU 87 -3.262 2.040 0.309 402 3HD1 LEU 87 3HD1 LEU 87 -4.691 2.552 -0.586 403 1HD2 LEU 87 1HD2 LEU 87 -3.572 -0.187 1.623 404 2HD2 LEU 87 2HD2 LEU 87 -4.901 -0.016 2.770 405 3HD2 LEU 87 3HD2 LEU 87 -3.691 1.259 2.625 406 H THR 88 H THR 88 -8.608 3.480 2.728 407 HA THR 88 HA THR 88 -7.705 5.952 3.693 408 HB THR 88 HB THR 88 -10.549 5.518 4.163 409 HG1 THR 88 1HG THR 88 -9.571 4.908 1.577 410 1HG2 THR 88 1HG2 THR 88 -8.908 7.536 3.127 411 2HG2 THR 88 2HG2 THR 88 -10.655 7.574 3.369 412 3HG2 THR 88 3HG2 THR 88 -9.990 7.054 1.821 413 H ARG 89 H ARG 89 -9.223 3.207 5.270 414 HA ARG 89 HA ARG 89 -9.618 4.443 7.789 415 1HB ARG 89 2HB ARG 89 -10.790 2.389 6.964 416 2HB ARG 89 1HB ARG 89 -9.295 1.498 7.215 417 1HG ARG 89 2HG ARG 89 -10.115 1.054 9.237 418 2HG ARG 89 1HG ARG 89 -9.648 2.707 9.637 419 1HD ARG 89 2HD ARG 89 -11.960 3.357 8.722 420 2HD ARG 89 1HD ARG 89 -12.346 1.643 8.876 421 HE ARG 89 HE ARG 89 -12.180 3.552 10.980 422 1HH1 ARG 89 1HH1 ARG 89 -11.619 0.192 10.222 423 2HH1 ARG 89 2HH1 ARG 89 -11.851 -0.344 11.852 424 1HH2 ARG 89 1HH2 ARG 89 -12.485 2.849 13.125 425 2HH2 ARG 89 2HH2 ARG 89 -12.343 1.165 13.500 426 H SER 90 H SER 90 -7.038 2.293 6.550 427 HA SER 90 HA SER 90 -5.607 2.363 9.040 428 1HB SER 90 2HB SER 90 -5.569 0.699 6.861 429 2HB SER 90 1HB SER 90 -4.062 1.600 6.666 430 HG SER 90 HG SER 90 -3.259 0.553 8.294 431 H LEU 91 H LEU 91 -5.297 4.022 5.944 432 HA LEU 91 HA LEU 91 -2.952 5.435 6.898 433 1HB LEU 91 2HB LEU 91 -4.106 4.730 4.315 434 2HB LEU 91 1HB LEU 91 -3.508 6.366 4.379 435 HG LEU 91 HG LEU 91 -1.981 3.806 4.727 436 1HD1 LEU 91 1HD1 LEU 91 -2.290 4.715 2.469 437 2HD1 LEU 91 2HD1 LEU 91 -0.599 4.710 2.970 438 3HD1 LEU 91 3HD1 LEU 91 -1.518 6.215 2.983 439 1HD2 LEU 91 1HD2 LEU 91 -1.312 6.520 5.759 440 2HD2 LEU 91 2HD2 LEU 91 -0.024 5.496 5.125 441 3HD2 LEU 91 3HD2 LEU 91 -1.015 4.935 6.474 442 H SER 92 H SER 92 -6.197 5.855 7.185 443 HA SER 92 HA SER 92 -7.090 8.223 6.389 444 1HB SER 92 2HB SER 92 -7.846 8.470 8.978 445 2HB SER 92 1HB SER 92 -8.606 7.356 7.843 446 HG SER 92 HG SER 92 -6.590 6.792 9.752 447 H ASP 93 H ASP 93 -6.709 10.330 6.562 448 HA ASP 93 HA ASP 93 -5.027 11.417 8.651 449 1HB ASP 93 2HB ASP 93 -4.028 10.807 5.985 450 2HB ASP 93 1HB ASP 93 -3.831 12.508 6.375 451 H ASN 94 H ASN 94 -4.499 13.886 7.252 452 HA ASN 94 HA ASN 94 -6.981 14.929 6.261 453 1HB ASN 94 2HB ASN 94 -6.091 15.507 9.070 454 2HB ASN 94 1HB ASN 94 -7.011 16.702 8.159 455 1HD2 ASN 94 1HD2 ASN 94 -8.918 15.520 6.920 456 2HD2 ASN 94 2HD2 ASN 94 -9.916 14.556 7.950 457 H ILE 95 H ILE 95 -3.674 15.447 7.327 458 HA ILE 95 HA ILE 95 -3.545 17.972 5.871 459 HB ILE 95 HB ILE 95 -1.654 16.601 7.780 460 1HG1 ILE 95 2HG1 ILE 95 -1.964 19.016 8.810 461 2HG1 ILE 95 1HG1 ILE 95 -3.441 18.995 7.852 462 1HG2 ILE 95 1HG2 ILE 95 -0.175 18.573 7.492 463 2HG2 ILE 95 2HG2 ILE 95 -1.158 19.051 6.108 464 3HG2 ILE 95 3HG2 ILE 95 -0.266 17.531 6.072 465 1HD1 ILE 95 1HD1 ILE 95 -2.738 16.812 9.788 466 2HD1 ILE 95 2HD1 ILE 95 -4.299 17.154 9.040 467 3HD1 ILE 95 3HD1 ILE 95 -3.640 18.254 10.252 468 H ASN 96 H ASN 96 -2.445 14.657 5.804 469 HA ASN 96 HA ASN 96 -0.754 15.151 3.475 470 1HB ASN 96 2HB ASN 96 -1.198 12.730 5.225 471 2HB ASN 96 1HB ASN 96 -0.267 12.661 3.732 472 1HD2 ASN 96 1HD2 ASN 96 -0.424 14.005 6.950 473 2HD2 ASN 96 2HD2 ASN 96 1.250 14.416 7.070 474 H LEU 97 H LEU 97 -3.775 13.677 4.413 475 HA LEU 97 HA LEU 97 -4.390 13.215 1.574 476 1HB LEU 97 2HB LEU 97 -4.812 11.384 3.912 477 2HB LEU 97 1HB LEU 97 -5.870 11.296 2.516 478 HG LEU 97 HG LEU 97 -2.883 11.064 2.254 479 1HD1 LEU 97 1HD1 LEU 97 -4.868 9.043 3.142 480 2HD1 LEU 97 2HD1 LEU 97 -3.173 9.242 3.591 481 3HD1 LEU 97 3HD1 LEU 97 -3.595 8.534 2.032 482 1HD2 LEU 97 1HD2 LEU 97 -5.218 10.278 0.521 483 2HD2 LEU 97 2HD2 LEU 97 -3.545 9.825 0.198 484 3HD2 LEU 97 3HD2 LEU 97 -4.013 11.525 0.195 485 HA PRO 98 HA PRO 98 -7.377 16.428 2.922 486 1HB PRO 98 2HB PRO 98 -8.223 15.572 0.171 487 2HB PRO 98 1HB PRO 98 -8.194 17.185 0.879 488 1HG PRO 98 2HG PRO 98 -6.253 16.401 -0.754 489 2HG PRO 98 1HG PRO 98 -5.888 17.377 0.680 490 1HD PRO 98 2HD PRO 98 -5.366 14.504 0.171 491 2HD PRO 98 1HD PRO 98 -4.511 15.637 1.235 492 H GLN 99 H GLN 99 -8.752 13.965 0.760 493 HA GLN 99 HA GLN 99 -10.945 13.601 2.664 494 1HB GLN 99 2HB GLN 99 -10.762 12.556 -0.164 495 2HB GLN 99 1HB GLN 99 -12.201 12.668 0.841 496 1HG GLN 99 2HG GLN 99 -12.262 15.016 0.669 497 2HG GLN 99 1HG GLN 99 -10.632 15.085 0.003 498 1HE2 GLN 99 1HE2 GLN 99 -10.537 13.438 -2.004 499 2HE2 GLN 99 2HE2 GLN 99 -11.737 13.773 -3.201 500 H GLY 100 H GLY 100 -8.281 11.896 1.196 501 1HA GLY 100 2HA GLY 100 -7.635 10.041 2.864 502 2HA GLY 100 1HA GLY 100 -9.183 9.376 2.357 503 H VAL 101 H VAL 101 -7.351 7.710 1.900 504 HA VAL 101 HA VAL 101 -5.799 8.018 -0.455 505 HB VAL 101 HB VAL 101 -6.724 5.433 0.810 506 1HG1 VAL 101 1HG1 VAL 101 -4.097 5.447 -0.395 507 2HG1 VAL 101 2HG1 VAL 101 -5.346 5.878 -1.560 508 3HG1 VAL 101 3HG1 VAL 101 -5.457 4.361 -0.668 509 1HG2 VAL 101 1HG2 VAL 101 -5.162 5.612 2.421 510 2HG2 VAL 101 2HG2 VAL 101 -5.316 7.342 2.111 511 3HG2 VAL 101 3HG2 VAL 101 -4.010 6.424 1.360 512 H ARG 102 H ARG 102 -6.925 8.591 -2.231 513 HA ARG 102 HA ARG 102 -9.270 7.021 -2.993 514 1HB ARG 102 2HB ARG 102 -8.441 9.774 -3.367 515 2HB ARG 102 1HB ARG 102 -8.929 9.031 -4.883 516 1HG ARG 102 2HG ARG 102 -10.652 8.727 -2.474 517 2HG ARG 102 1HG ARG 102 -10.683 10.230 -3.400 518 1HD ARG 102 2HD ARG 102 -12.295 8.218 -3.969 519 2HD ARG 102 1HD ARG 102 -11.627 9.251 -5.226 520 HE ARG 102 HE ARG 102 -9.876 7.450 -5.492 521 1HH1 ARG 102 1HH1 ARG 102 -13.077 6.709 -4.268 522 2HH1 ARG 102 2HH1 ARG 102 -13.022 5.063 -4.796 523 1HH2 ARG 102 1HH2 ARG 102 -9.825 5.291 -6.180 524 2HH2 ARG 102 2HH2 ARG 102 -11.182 4.258 -5.878 525 H TYR 103 H TYR 103 -6.036 7.857 -4.086 526 HA TYR 103 HA TYR 103 -6.290 5.713 -6.065 527 1HB TYR 103 2HB TYR 103 -4.888 8.282 -6.772 528 2HB TYR 103 1HB TYR 103 -5.335 6.953 -7.817 529 HD1 TYR 103 1HD TYR 103 -7.466 6.805 -8.818 530 HD2 TYR 103 2HD TYR 103 -6.665 9.828 -5.939 531 HE1 TYR 103 1HE TYR 103 -9.544 7.944 -9.453 532 HE2 TYR 103 2HE TYR 103 -8.749 10.979 -6.560 533 HH TYR 103 HH TYR 103 -10.893 10.473 -7.605 534 H ILE 104 H ILE 104 -4.232 4.943 -6.879 535 HA ILE 104 HA ILE 104 -2.041 5.331 -4.952 536 HB ILE 104 HB ILE 104 -2.777 2.727 -6.288 537 1HG1 ILE 104 2HG1 ILE 104 -3.433 3.866 -3.586 538 2HG1 ILE 104 1HG1 ILE 104 -4.495 3.055 -4.731 539 1HG2 ILE 104 1HG2 ILE 104 -0.365 3.173 -5.701 540 2HG2 ILE 104 2HG2 ILE 104 -1.081 1.723 -4.998 541 3HG2 ILE 104 3HG2 ILE 104 -0.871 3.174 -4.013 542 1HD1 ILE 104 1HD1 ILE 104 -2.507 1.856 -2.840 543 2HD1 ILE 104 2HD1 ILE 104 -3.101 0.960 -4.238 544 3HD1 ILE 104 3HD1 ILE 104 -4.231 1.520 -3.005 545 H TYR 105 H TYR 105 -0.240 6.036 -5.891 546 HA TYR 105 HA TYR 105 0.081 5.665 -8.769 547 1HB TYR 105 2HB TYR 105 0.536 7.885 -6.963 548 2HB TYR 105 1HB TYR 105 1.945 7.550 -7.972 549 HD1 TYR 105 1HD TYR 105 1.631 7.380 -10.447 550 HD2 TYR 105 2HD TYR 105 -1.344 8.967 -7.868 551 HE1 TYR 105 1HE TYR 105 0.554 8.433 -12.362 552 HE2 TYR 105 2HE TYR 105 -2.438 10.039 -9.773 553 HH TYR 105 HH TYR 105 -0.999 10.490 -12.714 554 H THR 106 H THR 106 2.255 5.468 -9.619 555 HA THR 106 HA THR 106 3.631 3.324 -8.336 556 HB THR 106 HB THR 106 5.365 3.887 -10.212 557 HG1 THR 106 1HG THR 106 4.385 5.072 -11.906 558 1HG2 THR 106 1HG2 THR 106 3.722 3.007 -11.984 559 2HG2 THR 106 2HG2 THR 106 2.595 2.854 -10.635 560 3HG2 THR 106 3HG2 THR 106 4.126 1.979 -10.610 561 H ILE 107 H ILE 107 5.859 3.296 -7.692 562 HA ILE 107 HA ILE 107 6.562 5.039 -5.730 563 HB ILE 107 HB ILE 107 7.680 2.867 -6.228 564 1HG1 ILE 107 2HG1 ILE 107 10.050 3.812 -5.659 565 2HG1 ILE 107 1HG1 ILE 107 9.216 5.361 -5.589 566 1HG2 ILE 107 1HG2 ILE 107 9.403 2.675 -7.822 567 2HG2 ILE 107 2HG2 ILE 107 9.431 4.414 -8.118 568 3HG2 ILE 107 3HG2 ILE 107 8.059 3.448 -8.662 569 1HD1 ILE 107 1HD1 ILE 107 7.601 3.775 -4.065 570 2HD1 ILE 107 2HD1 ILE 107 8.862 4.847 -3.452 571 3HD1 ILE 107 3HD1 ILE 107 9.206 3.136 -3.708 572 H ASP 108 H ASP 108 6.950 5.515 -9.155 573 HA ASP 108 HA ASP 108 8.587 7.900 -8.734 574 1HB ASP 108 2HB ASP 108 8.640 5.973 -10.699 575 2HB ASP 108 1HB ASP 108 7.771 7.287 -11.486 576 H GLY 109 H GLY 109 5.362 6.911 -9.605 577 1HA GLY 109 2HA GLY 109 3.463 8.286 -9.375 578 2HA GLY 109 1HA GLY 109 4.503 9.699 -9.449 579 H SER 110 H SER 110 5.136 7.364 -11.855 580 HA SER 110 HA SER 110 4.456 9.147 -13.946 581 1HB SER 110 2HB SER 110 4.896 6.187 -14.303 582 2HB SER 110 1HB SER 110 5.271 7.494 -15.424 583 HG SER 110 HG SER 110 6.779 8.209 -13.699 584 H ARG 111 H ARG 111 2.920 6.188 -12.721 585 HA ARG 111 HA ARG 111 0.403 7.065 -13.874 586 1HB ARG 111 2HB ARG 111 0.056 4.607 -14.619 587 2HB ARG 111 1HB ARG 111 1.010 5.675 -15.640 588 1HG ARG 111 2HG ARG 111 2.998 4.636 -15.103 589 2HG ARG 111 1HG ARG 111 2.368 3.983 -13.590 590 1HD ARG 111 2HD ARG 111 0.943 2.442 -14.850 591 2HD ARG 111 1HD ARG 111 1.572 3.096 -16.362 592 HE ARG 111 HE ARG 111 2.811 1.151 -14.696 593 1HH1 ARG 111 1HH1 ARG 111 3.499 3.813 -16.847 594 2HH1 ARG 111 2HH1 ARG 111 5.068 3.220 -17.280 595 1HH2 ARG 111 1HH2 ARG 111 4.874 0.371 -15.266 596 2HH2 ARG 111 2HH2 ARG 111 5.848 1.266 -16.383 597 H LYS 112 H LYS 112 -1.391 6.281 -12.831 598 HA LYS 112 HA LYS 112 -0.887 5.177 -10.186 599 1HB LYS 112 2HB LYS 112 -2.502 6.545 -9.486 600 2HB LYS 112 1HB LYS 112 -2.606 7.184 -11.114 601 1HG LYS 112 2HG LYS 112 -4.245 5.229 -11.532 602 2HG LYS 112 1HG LYS 112 -4.332 5.146 -9.770 603 1HD LYS 112 2HD LYS 112 -6.123 6.541 -10.713 604 2HD LYS 112 1HD LYS 112 -5.040 7.468 -9.673 605 1HE LYS 112 2HE LYS 112 -4.117 8.628 -11.429 606 2HE LYS 112 1HE LYS 112 -4.480 7.358 -12.598 607 1HZ LYS 112 1HZ LYS 112 -5.885 9.277 -12.952 608 2HZ LYS 112 2HZ LYS 112 -6.454 9.202 -11.362 609 3HZ LYS 112 3HZ LYS 112 -6.826 7.963 -12.452 610 H ILE 113 H ILE 113 -1.757 3.297 -9.422 611 HA ILE 113 HA ILE 113 -2.376 1.310 -11.403 612 HB ILE 113 HB ILE 113 -2.357 1.082 -8.393 613 1HG1 ILE 113 2HG1 ILE 113 -0.200 1.813 -9.623 614 2HG1 ILE 113 1HG1 ILE 113 -0.109 0.484 -8.475 615 1HG2 ILE 113 1HG2 ILE 113 -2.809 -0.848 -10.571 616 2HG2 ILE 113 2HG2 ILE 113 -3.384 -0.855 -8.903 617 3HG2 ILE 113 3HG2 ILE 113 -1.739 -1.374 -9.272 618 1HD1 ILE 113 1HD1 ILE 113 0.563 -0.945 -10.036 619 2HD1 ILE 113 2HD1 ILE 113 0.842 0.476 -11.046 620 3HD1 ILE 113 3HD1 ILE 113 -0.675 -0.413 -11.175 621 H GLY 114 H GLY 114 -4.263 0.220 -11.708 622 1HA GLY 114 2HA GLY 114 -6.632 1.238 -10.267 623 2HA GLY 114 1HA GLY 114 -6.644 0.915 -11.994 624 H SER 115 H SER 115 -4.897 -1.515 -11.458 625 HA SER 115 HA SER 115 -7.016 -3.262 -10.397 626 1HB SER 115 2HB SER 115 -5.872 -4.972 -12.046 627 2HB SER 115 1HB SER 115 -7.074 -3.827 -12.640 628 HG SER 115 HG SER 115 -5.352 -2.484 -13.308 629 H MET 116 H MET 116 -6.386 -5.078 -9.246 630 HA MET 116 HA MET 116 -4.132 -4.807 -7.596 631 1HB MET 116 2HB MET 116 -6.448 -6.283 -7.544 632 2HB MET 116 1HB MET 116 -5.226 -7.520 -7.801 633 1HG MET 116 2HG MET 116 -4.258 -7.190 -5.764 634 2HG MET 116 1HG MET 116 -4.760 -5.502 -5.675 635 1HE MET 116 1HE MET 116 -6.860 -4.681 -5.436 636 2HE MET 116 2HE MET 116 -7.420 -5.089 -3.814 637 3HE MET 116 3HE MET 116 -8.370 -5.567 -5.222 638 H ASP 117 H ASP 117 -4.613 -6.402 -10.641 639 HA ASP 117 HA ASP 117 -2.560 -8.275 -10.582 640 1HB ASP 117 2HB ASP 117 -4.308 -7.042 -12.544 641 2HB ASP 117 1HB ASP 117 -2.723 -7.388 -13.206 642 H GLU 118 H GLU 118 -2.404 -4.841 -10.724 643 HA GLU 118 HA GLU 118 0.241 -4.820 -11.928 644 1HB GLU 118 2HB GLU 118 -1.469 -2.589 -10.824 645 2HB GLU 118 1HB GLU 118 0.093 -2.360 -11.602 646 1HG GLU 118 2HG GLU 118 -1.797 -3.915 -13.191 647 2HG GLU 118 1HG GLU 118 -2.330 -2.270 -12.849 648 H LEU 119 H LEU 119 -1.088 -5.110 -8.810 649 HA LEU 119 HA LEU 119 1.120 -3.890 -7.411 650 1HB LEU 119 2HB LEU 119 -0.795 -5.753 -6.082 651 2HB LEU 119 1HB LEU 119 -0.039 -4.300 -5.456 652 HG LEU 119 HG LEU 119 -2.282 -4.376 -7.471 653 1HD1 LEU 119 1HD1 LEU 119 -2.885 -5.056 -5.151 654 2HD1 LEU 119 2HD1 LEU 119 -3.700 -3.598 -5.715 655 3HD1 LEU 119 3HD1 LEU 119 -2.339 -3.473 -4.600 656 1HD2 LEU 119 1HD2 LEU 119 -2.298 -2.039 -7.434 657 2HD2 LEU 119 2HD2 LEU 119 -0.594 -2.465 -7.589 658 3HD2 LEU 119 3HD2 LEU 119 -1.238 -1.963 -6.026 659 H GLU 120 H GLU 120 3.040 -4.855 -7.373 660 HA GLU 120 HA GLU 120 3.182 -7.780 -7.373 661 1HB GLU 120 2HB GLU 120 5.491 -5.871 -7.680 662 2HB GLU 120 1HB GLU 120 5.410 -7.560 -8.143 663 1HG GLU 120 2HG GLU 120 3.823 -7.026 -9.902 664 2HG GLU 120 1HG GLU 120 3.858 -5.329 -9.426 665 H GLU 121 H GLU 121 4.604 -8.869 -5.883 666 HA GLU 121 HA GLU 121 4.297 -8.116 -3.226 667 1HB GLU 121 2HB GLU 121 6.178 -10.028 -4.574 668 2HB GLU 121 1HB GLU 121 6.269 -9.741 -2.840 669 1HG GLU 121 2HG GLU 121 3.556 -10.261 -3.679 670 2HG GLU 121 1HG GLU 121 4.641 -11.564 -4.157 671 H GLY 122 H GLY 122 5.924 -7.579 -1.628 672 1HA GLY 122 2HA GLY 122 7.317 -5.943 -0.824 673 2HA GLY 122 1HA GLY 122 8.465 -6.729 -1.882 674 H GLU 123 H GLU 123 5.612 -4.786 -2.702 675 HA GLU 123 HA GLU 123 7.339 -3.120 -4.387 676 1HB GLU 123 2HB GLU 123 4.453 -3.821 -4.390 677 2HB GLU 123 1HB GLU 123 4.904 -2.251 -5.037 678 1HG GLU 123 2HG GLU 123 6.443 -4.594 -5.979 679 2HG GLU 123 1HG GLU 123 4.775 -4.438 -6.532 680 H SER 124 H SER 124 6.466 -0.783 -4.629 681 HA SER 124 HA SER 124 5.838 0.362 -1.996 682 1HB SER 124 2HB SER 124 8.031 1.236 -3.887 683 2HB SER 124 1HB SER 124 7.439 2.240 -2.565 684 HG SER 124 HG SER 124 8.419 0.989 -1.157 685 H TYR 125 H TYR 125 4.109 1.663 -2.109 686 HA TYR 125 HA TYR 125 3.549 2.996 -4.666 687 1HB TYR 125 2HB TYR 125 1.686 1.393 -2.982 688 2HB TYR 125 1HB TYR 125 1.077 2.672 -4.010 689 HD1 TYR 125 1HD TYR 125 1.787 -0.758 -3.902 690 HD2 TYR 125 2HD TYR 125 2.017 2.616 -6.462 691 HE1 TYR 125 1HE TYR 125 1.838 -2.250 -5.850 692 HE2 TYR 125 2HE TYR 125 2.074 1.160 -8.409 693 HH TYR 125 HH TYR 125 2.548 -2.230 -8.168 694 H VAL 126 H VAL 126 2.152 4.789 -4.580 695 HA VAL 126 HA VAL 126 2.285 6.237 -2.002 696 HB VAL 126 HB VAL 126 2.936 7.179 -4.760 697 1HG1 VAL 126 1HG1 VAL 126 1.437 8.771 -2.734 698 2HG1 VAL 126 2HG1 VAL 126 1.350 8.817 -4.496 699 3HG1 VAL 126 3HG1 VAL 126 2.709 9.569 -3.659 700 1HG2 VAL 126 1HG2 VAL 126 4.473 6.644 -2.668 701 2HG2 VAL 126 2HG2 VAL 126 4.075 8.317 -2.271 702 3HG2 VAL 126 3HG2 VAL 126 4.859 7.937 -3.804 703 H CYS 127 H CYS 127 0.503 7.320 -1.313 704 HA CYS 127 HA CYS 127 -1.978 6.727 -2.742 705 1HB CYS 127 2HB CYS 127 -1.689 7.913 0.017 706 2HB CYS 127 1HB CYS 127 -3.108 7.136 -0.678 707 HG CYS 127 HG CYS 127 -0.629 5.352 -0.281 708 H SER 128 H SER 128 -3.197 8.218 -3.718 709 HA SER 128 HA SER 128 -2.707 11.063 -3.148 710 1HB SER 128 2HB SER 128 -2.890 9.873 -5.928 711 2HB SER 128 1HB SER 128 -2.796 11.597 -5.541 712 HG SER 128 HG SER 128 -0.764 10.409 -6.099 713 H SER 129 H SER 129 -4.374 12.466 -4.095 714 HA SER 129 HA SER 129 -6.931 11.275 -4.692 715 1HB SER 129 2HB SER 129 -7.912 12.819 -2.771 716 2HB SER 129 1HB SER 129 -7.380 11.173 -2.428 717 HG SER 129 HG SER 129 -6.588 13.148 -1.121 718 H ASP 130 H ASP 130 -5.457 14.303 -3.557 719 HA ASP 130 HA ASP 130 -6.019 15.625 -6.043 720 1HB ASP 130 2HB ASP 130 -8.204 15.597 -4.584 721 2HB ASP 130 1HB ASP 130 -7.400 16.903 -3.717 722 H ASN 131 H ASN 131 -3.771 15.134 -4.114 723 HA ASN 131 HA ASN 131 -3.098 17.929 -3.487 724 1HB ASN 131 2HB ASN 131 -1.477 17.036 -1.883 725 2HB ASN 131 1HB ASN 131 -3.095 16.425 -1.556 726 1HD2 ASN 131 1HD2 ASN 131 -3.600 14.268 -2.335 727 2HD2 ASN 131 2HD2 ASN 131 -2.342 13.085 -2.402 728 H PHE 132 H PHE 132 -2.688 16.130 -6.042 729 HA PHE 132 HA PHE 132 -1.161 16.019 -7.729 730 1HB PHE 132 2HB PHE 132 -1.092 18.453 -7.481 731 2HB PHE 132 1HB PHE 132 0.112 18.305 -6.206 732 HD1 PHE 132 1HD PHE 132 2.377 18.290 -6.719 733 HD2 PHE 132 2HD PHE 132 -0.474 17.589 -9.800 734 HE1 PHE 132 1HE PHE 132 4.171 18.401 -8.399 735 HE2 PHE 132 2HE PHE 132 1.316 17.698 -11.486 736 HZ PHE 132 HZ PHE 132 3.642 18.104 -10.787 737 H PHE 133 H PHE 133 0.794 14.996 -8.246 738 HA PHE 133 HA PHE 133 1.929 13.448 -6.132 739 1HB PHE 133 2HB PHE 133 1.601 12.719 -8.555 740 2HB PHE 133 1HB PHE 133 3.038 13.668 -8.926 741 HD1 PHE 133 1HD PHE 133 1.753 10.687 -7.241 742 HD2 PHE 133 2HD PHE 133 5.223 12.954 -8.202 743 HE1 PHE 133 1HE PHE 133 3.170 8.785 -6.589 744 HE2 PHE 133 2HE PHE 133 6.648 11.056 -7.555 745 HZ PHE 133 HZ PHE 133 5.622 8.967 -6.746 746 H LYS 134 H LYS 134 4.070 13.402 -5.404 747 HA LYS 134 HA LYS 134 5.733 15.736 -6.033 748 1HB LYS 134 2HB LYS 134 4.728 14.887 -3.340 749 2HB LYS 134 1HB LYS 134 6.297 15.670 -3.475 750 1HG LYS 134 2HG LYS 134 5.080 17.513 -4.746 751 2HG LYS 134 1HG LYS 134 3.594 16.779 -4.141 752 1HD LYS 134 2HD LYS 134 3.887 17.643 -2.101 753 2HD LYS 134 1HD LYS 134 5.577 17.135 -2.047 754 1HE LYS 134 2HE LYS 134 6.044 19.109 -3.591 755 2HE LYS 134 1HE LYS 134 4.418 19.661 -3.193 756 1HZ LYS 134 1HZ LYS 134 6.808 19.553 -1.515 757 2HZ LYS 134 2HZ LYS 134 5.319 19.272 -0.764 758 3HZ LYS 134 3HZ LYS 134 5.590 20.725 -1.587 759 H LYS 135 H LYS 135 7.788 15.201 -6.420 760 HA LYS 135 HA LYS 135 8.612 12.459 -6.165 761 1HB LYS 135 2HB LYS 135 9.830 14.939 -7.322 762 2HB LYS 135 1HB LYS 135 10.826 13.514 -7.063 763 1HG LYS 135 2HG LYS 135 10.089 13.434 -9.303 764 2HG LYS 135 1HG LYS 135 9.154 12.224 -8.423 765 1HD LYS 135 2HD LYS 135 7.286 13.803 -8.252 766 2HD LYS 135 1HD LYS 135 8.222 15.003 -9.145 767 1HE LYS 135 2HE LYS 135 7.886 12.334 -10.390 768 2HE LYS 135 1HE LYS 135 6.466 13.376 -10.322 769 1HZ LYS 135 1HZ LYS 135 7.680 13.699 -12.375 770 2HZ LYS 135 2HZ LYS 135 9.088 14.088 -11.523 771 3HZ LYS 135 3HZ LYS 135 7.742 15.108 -11.440 772 H VAL 136 H VAL 136 8.947 11.865 -4.080 773 HA VAL 136 HA VAL 136 11.057 13.318 -2.626 774 HB VAL 136 HB VAL 136 9.665 12.040 -0.625 775 1HG1 VAL 136 1HG1 VAL 136 8.978 14.278 0.047 776 2HG1 VAL 136 2HG1 VAL 136 9.345 14.882 -1.569 777 3HG1 VAL 136 3HG1 VAL 136 10.641 14.266 -0.543 778 1HG2 VAL 136 1HG2 VAL 136 7.805 11.529 -2.132 779 2HG2 VAL 136 2HG2 VAL 136 7.643 13.243 -2.515 780 3HG2 VAL 136 3HG2 VAL 136 7.320 12.671 -0.879 781 H GLU 137 H GLU 137 11.909 11.830 -0.759 782 HA GLU 137 HA GLU 137 12.913 9.472 -2.059 783 1HB GLU 137 2HB GLU 137 13.388 10.652 0.682 784 2HB GLU 137 1HB GLU 137 14.140 9.156 0.143 785 1HG GLU 137 2HG GLU 137 15.492 10.225 -1.382 786 2HG GLU 137 1HG GLU 137 14.425 11.623 -1.506 787 H TYR 138 H TYR 138 10.629 8.772 -2.235 788 HA TYR 138 HA TYR 138 9.051 7.798 -0.208 789 1HB TYR 138 2HB TYR 138 9.560 6.907 -3.026 790 2HB TYR 138 1HB TYR 138 8.345 6.108 -2.020 791 HD1 TYR 138 1HD TYR 138 8.425 8.118 -4.632 792 HD2 TYR 138 2HD TYR 138 7.110 8.322 -0.592 793 HE1 TYR 138 1HE TYR 138 6.803 9.861 -5.254 794 HE2 TYR 138 2HE TYR 138 5.484 10.064 -1.201 795 HH TYR 138 HH TYR 138 5.541 11.651 -4.233 796 H THR 139 H THR 139 11.848 6.282 -1.743 797 HA THR 139 HA THR 139 12.113 4.469 0.496 798 HB THR 139 HB THR 139 10.668 3.144 -0.880 799 HG1 THR 139 1HG THR 139 12.629 2.149 -0.005 800 1HG2 THR 139 1HG2 THR 139 11.038 4.330 -3.015 801 2HG2 THR 139 2HG2 THR 139 11.096 2.573 -3.161 802 3HG2 THR 139 3HG2 THR 139 12.591 3.509 -3.160 803 H LYS 140 H LYS 140 13.580 6.690 -0.973 804 HA LYS 140 HA LYS 140 15.908 5.473 -2.111 805 1HB LYS 140 2HB LYS 140 15.176 8.272 -1.303 806 2HB LYS 140 1HB LYS 140 16.829 7.878 -1.758 807 1HG LYS 140 2HG LYS 140 15.397 6.783 -3.810 808 2HG LYS 140 1HG LYS 140 14.451 8.221 -3.417 809 1HD LYS 140 2HD LYS 140 16.159 9.660 -3.973 810 2HD LYS 140 1HD LYS 140 17.413 8.460 -3.659 811 1HE LYS 140 2HE LYS 140 17.306 7.612 -5.746 812 2HE LYS 140 1HE LYS 140 15.556 7.797 -5.842 813 1HZ LYS 140 1HZ LYS 140 16.660 9.238 -7.418 814 2HZ LYS 140 2HZ LYS 140 17.557 9.965 -6.183 815 3HZ LYS 140 3HZ LYS 140 15.880 10.169 -6.239 816 H ASN 141 H ASN 141 17.448 4.512 -1.075 817 HA ASN 141 HA ASN 141 18.931 3.905 0.509 818 1HB ASN 141 2HB ASN 141 18.482 6.777 1.120 819 2HB ASN 141 1HB ASN 141 19.297 5.810 2.346 820 1HD2 ASN 141 1HD2 ASN 141 19.392 5.944 -1.201 821 2HD2 ASN 141 2HD2 ASN 141 21.107 6.103 -1.318 822 H VAL 142 H VAL 142 15.890 3.767 0.894 823 HA VAL 142 HA VAL 142 15.664 3.614 3.790 824 HB VAL 142 HB VAL 142 13.594 2.947 1.691 825 1HG1 VAL 142 1HG1 VAL 142 12.920 1.919 3.687 826 2HG1 VAL 142 2HG1 VAL 142 12.055 3.457 3.675 827 3HG1 VAL 142 3HG1 VAL 142 13.494 3.263 4.676 828 1HG2 VAL 142 1HG2 VAL 142 14.226 5.258 1.449 829 2HG2 VAL 142 2HG2 VAL 142 14.095 5.518 3.189 830 3HG2 VAL 142 3HG2 VAL 142 12.650 5.178 2.237 831 H ASN 143 H ASN 143 15.300 1.729 4.945 832 HA ASN 143 HA ASN 143 16.448 -0.647 3.828 833 1HB ASN 143 2HB ASN 143 16.187 0.382 6.380 834 2HB ASN 143 1HB ASN 143 15.068 -0.977 6.386 835 1HD2 ASN 143 1HD2 ASN 143 16.716 -1.637 8.037 836 2HD2 ASN 143 2HD2 ASN 143 18.059 -2.567 7.476 837 HA PRO 144 HA PRO 144 12.504 -2.317 2.540 838 1HB PRO 144 2HB PRO 144 13.405 -4.477 1.270 839 2HB PRO 144 1HB PRO 144 13.725 -2.857 0.638 840 1HG PRO 144 2HG PRO 144 15.531 -4.689 2.159 841 2HG PRO 144 1HG PRO 144 15.903 -3.640 0.780 842 1HD PRO 144 2HD PRO 144 16.403 -3.022 3.447 843 2HD PRO 144 1HD PRO 144 16.298 -1.842 2.127 844 H ASN 145 H ASN 145 13.150 -2.759 5.279 845 HA ASN 145 HA ASN 145 12.893 -5.619 5.708 846 1HB ASN 145 2HB ASN 145 13.164 -3.283 7.598 847 2HB ASN 145 1HB ASN 145 12.875 -4.930 8.149 848 1HD2 ASN 145 1HD2 ASN 145 15.034 -3.134 5.981 849 2HD2 ASN 145 2HD2 ASN 145 16.465 -4.002 6.412 850 H TRP 146 H TRP 146 10.817 -5.645 4.553 851 HA TRP 146 HA TRP 146 8.655 -5.648 6.425 852 1HB TRP 146 2HB TRP 146 7.192 -4.183 4.893 853 2HB TRP 146 1HB TRP 146 8.327 -3.376 5.969 854 HD1 TRP 146 HD TRP 146 10.427 -2.160 4.850 855 HE1 TRP 146 1HE TRP 146 10.848 -1.333 2.448 856 HE3 TRP 146 3HE TRP 146 6.743 -4.757 2.434 857 HZ2 TRP 146 2HZ TRP 146 9.765 -1.734 -0.127 858 HZ3 TRP 146 3HZ TRP 146 6.499 -4.472 0.008 859 HH2 TRP 146 HH TRP 146 7.980 -3.000 -1.246 860 H SER 147 H SER 147 9.723 -5.917 3.077 861 HA SER 147 HA SER 147 7.517 -7.646 2.363 862 1HB SER 147 2HB SER 147 8.525 -7.725 0.164 863 2HB SER 147 1HB SER 147 8.551 -6.057 0.734 864 HG SER 147 HG SER 147 10.715 -7.894 0.806 865 H VAL 148 H VAL 148 9.938 -8.217 4.347 866 HA VAL 148 HA VAL 148 10.945 -10.689 3.225 867 HB VAL 148 HB VAL 148 12.271 -10.835 5.290 868 1HG1 VAL 148 1HG1 VAL 148 12.586 -9.050 3.215 869 2HG1 VAL 148 2HG1 VAL 148 13.816 -9.482 4.403 870 3HG1 VAL 148 3HG1 VAL 148 12.819 -8.048 4.648 871 1HG2 VAL 148 1HG2 VAL 148 11.614 -8.144 6.234 872 2HG2 VAL 148 2HG2 VAL 148 11.878 -9.632 7.144 873 3HG2 VAL 148 3HG2 VAL 148 10.301 -9.306 6.423 874 H ASN 149 H ASN 149 8.442 -9.639 5.356 875 HA ASN 149 HA ASN 149 8.131 -12.272 6.563 876 1HB ASN 149 2HB ASN 149 6.946 -9.568 7.045 877 2HB ASN 149 1HB ASN 149 6.067 -10.991 7.594 878 1HD2 ASN 149 1HD2 ASN 149 8.050 -8.683 8.618 879 2HD2 ASN 149 2HD2 ASN 149 8.901 -9.519 9.868 880 H VAL 150 H VAL 150 7.803 -12.769 4.046 881 HA VAL 150 HA VAL 150 4.905 -13.092 3.729 882 HB VAL 150 HB VAL 150 5.247 -12.750 1.226 883 1HG1 VAL 150 1HG1 VAL 150 4.431 -11.062 3.180 884 2HG1 VAL 150 2HG1 VAL 150 4.384 -10.687 1.457 885 3HG1 VAL 150 3HG1 VAL 150 5.729 -10.120 2.446 886 1HG2 VAL 150 1HG2 VAL 150 7.575 -12.772 0.957 887 2HG2 VAL 150 2HG2 VAL 150 7.827 -11.634 2.282 888 3HG2 VAL 150 3HG2 VAL 150 7.126 -11.079 0.762 Start of MODEL 14 1 1H GLY 38 1HT GLY 38 -19.200 -27.265 6.431 2 2H GLY 38 2HT GLY 38 -20.811 -26.784 6.611 3 3H GLY 38 3HT GLY 38 -19.591 -25.997 7.479 4 1HA GLY 38 1HA GLY 38 -20.449 -25.636 4.735 5 2HA GLY 38 2HA GLY 38 -19.747 -24.474 5.851 6 H ALA 39 H ALA 39 -17.456 -26.191 6.468 7 HA ALA 39 HA ALA 39 -16.058 -26.681 4.013 8 1HB ALA 39 1HB ALA 39 -16.058 -24.123 4.404 9 2HB ALA 39 2HB ALA 39 -14.546 -24.924 3.980 10 3HB ALA 39 3HB ALA 39 -14.868 -24.481 5.655 11 H MET 40 H MET 40 -14.309 -27.988 4.316 12 HA MET 40 HA MET 40 -13.143 -28.274 6.961 13 1HB MET 40 2HB MET 40 -13.451 -30.792 6.834 14 2HB MET 40 1HB MET 40 -14.884 -29.852 7.222 15 1HG MET 40 2HG MET 40 -15.939 -30.420 5.320 16 2HG MET 40 1HG MET 40 -14.458 -30.401 4.364 17 1HE MET 40 1HE MET 40 -12.561 -33.079 4.968 18 2HE MET 40 2HE MET 40 -13.186 -31.985 3.734 19 3HE MET 40 3HE MET 40 -13.604 -33.698 3.686 20 H ASP 41 H ASP 41 -11.326 -27.411 5.812 21 HA ASP 41 HA ASP 41 -9.325 -27.569 4.741 22 1HB ASP 41 2HB ASP 41 -9.927 -30.475 5.251 23 2HB ASP 41 1HB ASP 41 -8.460 -29.977 4.415 24 HA PRO 42 HA PRO 42 -9.845 -27.718 0.381 25 1HB PRO 42 2HB PRO 42 -7.391 -29.400 0.203 26 2HB PRO 42 1HB PRO 42 -7.781 -27.886 -0.621 27 1HG PRO 42 2HG PRO 42 -6.067 -27.914 1.413 28 2HG PRO 42 1HG PRO 42 -7.230 -26.588 1.222 29 1HD PRO 42 2HD PRO 42 -7.281 -28.894 3.122 30 2HD PRO 42 1HD PRO 42 -7.797 -27.214 3.372 31 H GLU 43 H GLU 43 -10.653 -29.015 -1.251 32 HA GLU 43 HA GLU 43 -10.484 -31.877 -1.153 33 1HB GLU 43 2HB GLU 43 -12.402 -30.899 0.476 34 2HB GLU 43 1HB GLU 43 -13.307 -30.993 -1.028 35 1HG GLU 43 2HG GLU 43 -11.743 -33.316 0.046 36 2HG GLU 43 1HG GLU 43 -13.411 -32.997 0.520 37 H PHE 44 H PHE 44 -12.399 -29.157 -2.405 38 HA PHE 44 HA PHE 44 -11.749 -29.924 -5.117 39 1HB PHE 44 2HB PHE 44 -13.934 -31.131 -4.202 40 2HB PHE 44 1HB PHE 44 -14.669 -29.591 -4.635 41 HD1 PHE 44 1HD PHE 44 -14.568 -28.800 -6.986 42 HD2 PHE 44 2HD PHE 44 -13.299 -32.699 -5.848 43 HE1 PHE 44 1HE PHE 44 -14.708 -29.525 -9.332 44 HE2 PHE 44 2HE PHE 44 -13.438 -33.433 -8.194 45 HZ PHE 44 HZ PHE 44 -14.142 -31.844 -9.939 46 H ALA 45 H ALA 45 -12.196 -27.575 -2.868 47 HA ALA 45 HA ALA 45 -13.440 -25.559 -4.485 48 1HB ALA 45 1HB ALA 45 -12.268 -24.136 -2.532 49 2HB ALA 45 2HB ALA 45 -12.305 -25.724 -1.766 50 3HB ALA 45 3HB ALA 45 -13.802 -24.983 -2.330 51 H LEU 46 H LEU 46 -11.864 -26.101 -6.302 52 HA LEU 46 HA LEU 46 -9.192 -25.058 -6.039 53 1HB LEU 46 2HB LEU 46 -10.616 -25.771 -8.595 54 2HB LEU 46 1HB LEU 46 -8.887 -25.693 -8.318 55 HG LEU 46 HG LEU 46 -10.613 -27.676 -6.860 56 1HD1 LEU 46 1HD1 LEU 46 -10.656 -29.131 -8.579 57 2HD1 LEU 46 2HD1 LEU 46 -9.102 -28.593 -9.217 58 3HD1 LEU 46 3HD1 LEU 46 -10.563 -27.661 -9.548 59 1HD2 LEU 46 1HD2 LEU 46 -8.599 -27.796 -5.830 60 2HD2 LEU 46 2HD2 LEU 46 -7.724 -27.157 -7.220 61 3HD2 LEU 46 3HD2 LEU 46 -8.233 -28.846 -7.198 62 H SER 47 H SER 47 -8.627 -23.658 -8.227 63 HA SER 47 HA SER 47 -8.635 -21.563 -9.109 64 1HB SER 47 2HB SER 47 -10.635 -20.788 -10.035 65 2HB SER 47 1HB SER 47 -10.929 -22.521 -9.890 66 HG SER 47 HG SER 47 -12.692 -21.619 -8.999 67 H ASN 48 H ASN 48 -10.075 -19.283 -8.620 68 HA ASN 48 HA ASN 48 -10.209 -17.510 -7.202 69 1HB ASN 48 2HB ASN 48 -10.869 -19.794 -5.366 70 2HB ASN 48 1HB ASN 48 -10.726 -18.157 -4.733 71 1HD2 ASN 48 1HD2 ASN 48 -13.058 -19.850 -4.832 72 2HD2 ASN 48 2HD2 ASN 48 -14.243 -19.005 -5.763 73 H GLU 49 H GLU 49 -9.285 -16.747 -4.896 74 HA GLU 49 HA GLU 49 -7.369 -16.002 -3.905 75 1HB GLU 49 2HB GLU 49 -7.753 -18.254 -2.849 76 2HB GLU 49 1HB GLU 49 -6.585 -18.916 -3.983 77 1HG GLU 49 2HG GLU 49 -4.815 -18.001 -2.914 78 2HG GLU 49 1HG GLU 49 -5.721 -16.584 -2.388 79 H LYS 50 H LYS 50 -6.455 -14.787 -5.557 80 HA LYS 50 HA LYS 50 -4.616 -16.093 -7.403 81 1HB LYS 50 2HB LYS 50 -5.740 -13.311 -7.199 82 2HB LYS 50 1HB LYS 50 -4.388 -13.675 -8.263 83 1HG LYS 50 2HG LYS 50 -5.825 -15.434 -9.327 84 2HG LYS 50 1HG LYS 50 -7.174 -14.796 -8.386 85 1HD LYS 50 2HD LYS 50 -5.496 -13.163 -10.287 86 2HD LYS 50 1HD LYS 50 -7.046 -13.897 -10.704 87 1HE LYS 50 2HE LYS 50 -8.219 -12.525 -9.196 88 2HE LYS 50 1HE LYS 50 -6.744 -12.040 -8.363 89 1HZ LYS 50 1HZ LYS 50 -7.912 -10.484 -10.105 90 2HZ LYS 50 2HZ LYS 50 -6.992 -11.384 -11.204 91 3HZ LYS 50 3HZ LYS 50 -6.226 -10.529 -9.962 92 H LYS 51 H LYS 51 -3.919 -16.046 -4.605 93 HA LYS 51 HA LYS 51 -2.106 -15.701 -3.281 94 1HB LYS 51 2HB LYS 51 -0.929 -14.955 -5.952 95 2HB LYS 51 1HB LYS 51 0.019 -14.934 -4.473 96 1HG LYS 51 2HG LYS 51 0.477 -17.009 -5.415 97 2HG LYS 51 1HG LYS 51 -0.728 -17.360 -4.175 98 1HD LYS 51 2HD LYS 51 -1.223 -18.552 -6.250 99 2HD LYS 51 1HD LYS 51 -2.482 -17.372 -5.878 100 1HE LYS 51 2HE LYS 51 -1.710 -15.880 -7.534 101 2HE LYS 51 1HE LYS 51 -0.188 -16.750 -7.718 102 1HZ LYS 51 1HZ LYS 51 -2.797 -17.314 -8.862 103 2HZ LYS 51 2HZ LYS 51 -1.924 -18.664 -8.338 104 3HZ LYS 51 3HZ LYS 51 -1.253 -17.615 -9.484 105 H ALA 52 H ALA 52 -1.392 -14.126 -1.919 106 HA ALA 52 HA ALA 52 -2.476 -11.482 -2.317 107 1HB ALA 52 1HB ALA 52 -2.384 -12.832 -0.120 108 2HB ALA 52 2HB ALA 52 -2.056 -11.100 -0.066 109 3HB ALA 52 3HB ALA 52 -0.721 -12.252 -0.016 110 H LYS 53 H LYS 53 -0.965 -9.615 -1.515 111 HA LYS 53 HA LYS 53 1.741 -9.898 -2.586 112 1HB LYS 53 2HB LYS 53 -0.189 -7.748 -3.481 113 2HB LYS 53 1HB LYS 53 1.510 -7.842 -3.921 114 1HG LYS 53 2HG LYS 53 -0.339 -10.106 -4.545 115 2HG LYS 53 1HG LYS 53 -0.279 -8.680 -5.581 116 1HD LYS 53 2HD LYS 53 1.759 -9.199 -6.400 117 2HD LYS 53 1HD LYS 53 2.334 -9.826 -4.854 118 1HE LYS 53 2HE LYS 53 2.203 -11.594 -6.531 119 2HE LYS 53 1HE LYS 53 1.072 -11.883 -5.209 120 1HZ LYS 53 1HZ LYS 53 0.547 -11.323 -8.004 121 2HZ LYS 53 2HZ LYS 53 -0.464 -10.520 -6.912 122 3HZ LYS 53 3HZ LYS 53 -0.364 -12.208 -6.885 123 H LYS 54 H LYS 54 3.190 -8.906 -1.326 124 HA LYS 54 HA LYS 54 2.240 -7.219 0.830 125 1HB LYS 54 2HB LYS 54 4.651 -8.882 0.338 126 2HB LYS 54 1HB LYS 54 4.875 -7.440 1.320 127 1HG LYS 54 2HG LYS 54 2.734 -9.459 1.910 128 2HG LYS 54 1HG LYS 54 4.377 -9.605 2.539 129 1HD LYS 54 2HD LYS 54 4.084 -7.948 4.037 130 2HD LYS 54 1HD LYS 54 3.139 -6.967 2.916 131 1HE LYS 54 2HE LYS 54 1.220 -7.664 3.805 132 2HE LYS 54 1HE LYS 54 1.704 -9.355 3.683 133 1HZ LYS 54 1HZ LYS 54 2.571 -9.352 5.794 134 2HZ LYS 54 2HZ LYS 54 1.264 -8.297 5.991 135 3HZ LYS 54 3HZ LYS 54 2.829 -7.680 5.823 136 H VAL 55 H VAL 55 2.336 -5.129 0.701 137 HA VAL 55 HA VAL 55 4.416 -3.871 -0.959 138 HB VAL 55 HB VAL 55 2.767 -2.136 -1.638 139 1HG1 VAL 55 1HG1 VAL 55 1.661 -4.700 -2.641 140 2HG1 VAL 55 2HG1 VAL 55 3.369 -4.351 -2.918 141 3HG1 VAL 55 3HG1 VAL 55 2.133 -3.243 -3.516 142 1HG2 VAL 55 1HG2 VAL 55 1.044 -2.210 -0.111 143 2HG2 VAL 55 2HG2 VAL 55 0.921 -3.971 -0.176 144 3HG2 VAL 55 3HG2 VAL 55 0.328 -2.996 -1.522 145 H ARG 56 H ARG 56 4.943 -1.736 -0.423 146 HA ARG 56 HA ARG 56 4.300 -0.996 2.346 147 1HB ARG 56 2HB ARG 56 6.770 -1.147 0.982 148 2HB ARG 56 1HB ARG 56 6.424 0.569 1.154 149 1HG ARG 56 2HG ARG 56 6.121 -1.201 3.528 150 2HG ARG 56 1HG ARG 56 7.740 -0.738 3.000 151 1HD ARG 56 2HD ARG 56 6.252 1.621 2.941 152 2HD ARG 56 1HD ARG 56 5.755 0.802 4.422 153 HE ARG 56 HE ARG 56 8.318 1.981 3.865 154 1HH1 ARG 56 1HH1 ARG 56 6.606 -0.378 5.785 155 2HH1 ARG 56 2HH1 ARG 56 7.779 -0.377 7.058 156 1HH2 ARG 56 1HH2 ARG 56 9.861 1.983 5.539 157 2HH2 ARG 56 2HH2 ARG 56 9.626 0.964 6.920 158 H PHE 57 H PHE 57 2.573 0.333 2.275 159 HA PHE 57 HA PHE 57 2.234 2.095 -0.003 160 1HB PHE 57 2HB PHE 57 0.480 1.345 2.320 161 2HB PHE 57 1HB PHE 57 0.055 2.659 1.232 162 HD1 PHE 57 1HD PHE 57 1.560 0.782 -1.062 163 HD2 PHE 57 2HD PHE 57 -1.767 0.455 1.580 164 HE1 PHE 57 1HE PHE 57 0.506 -0.807 -2.594 165 HE2 PHE 57 2HE PHE 57 -2.819 -1.152 0.047 166 HZ PHE 57 HZ PHE 57 -1.687 -1.782 -2.046 167 H TYR 58 H TYR 58 2.633 4.136 -0.067 168 HA TYR 58 HA TYR 58 3.200 5.600 2.423 169 1HB TYR 58 2HB TYR 58 4.411 6.201 -0.261 170 2HB TYR 58 1HB TYR 58 4.856 6.883 1.285 171 HD1 TYR 58 1HD TYR 58 5.225 4.026 -0.948 172 HD2 TYR 58 2HD TYR 58 6.170 5.578 2.898 173 HE1 TYR 58 1HE TYR 58 6.945 2.291 -0.678 174 HE2 TYR 58 2HE TYR 58 7.894 3.847 3.179 175 HH TYR 58 HH TYR 58 9.171 2.113 0.758 176 H ARG 59 H ARG 59 2.450 7.696 2.553 177 HA ARG 59 HA ARG 59 0.311 8.315 0.654 178 1HB ARG 59 2HB ARG 59 -0.460 9.938 2.343 179 2HB ARG 59 1HB ARG 59 -0.344 8.312 2.999 180 1HG ARG 59 2HG ARG 59 2.118 9.327 3.586 181 2HG ARG 59 1HG ARG 59 1.083 10.748 3.743 182 1HD ARG 59 2HD ARG 59 -0.421 8.935 5.037 183 2HD ARG 59 1HD ARG 59 1.183 8.281 5.361 184 HE ARG 59 HE ARG 59 1.471 10.886 5.980 185 1HH1 ARG 59 1HH1 ARG 59 -0.882 8.485 6.918 186 2HH1 ARG 59 2HH1 ARG 59 -1.191 9.210 8.459 187 1HH2 ARG 59 1HH2 ARG 59 1.063 11.842 8.005 188 2HH2 ARG 59 2HH2 ARG 59 -0.088 11.116 9.076 189 H ASN 60 H ASN 60 0.763 9.621 -0.944 190 HA ASN 60 HA ASN 60 3.029 10.889 -1.580 191 1HB ASN 60 2HB ASN 60 1.201 10.810 -3.127 192 2HB ASN 60 1HB ASN 60 0.216 11.837 -2.099 193 1HD2 ASN 60 1HD2 ASN 60 0.097 12.916 -4.279 194 2HD2 ASN 60 2HD2 ASN 60 1.256 14.158 -4.587 195 H GLY 61 H GLY 61 4.290 12.334 -0.684 196 1HA GLY 61 2HA GLY 61 4.991 14.239 0.402 197 2HA GLY 61 1HA GLY 61 3.334 14.821 0.337 198 H ASP 62 H ASP 62 5.686 13.029 2.197 199 HA ASP 62 HA ASP 62 4.112 13.535 4.597 200 1HB ASP 62 2HB ASP 62 4.535 11.183 5.396 201 2HB ASP 62 1HB ASP 62 3.381 11.319 4.073 202 H ARG 63 H ARG 63 7.108 12.062 3.353 203 HA ARG 63 HA ARG 63 9.274 12.238 4.003 204 1HB ARG 63 2HB ARG 63 8.071 14.824 4.651 205 2HB ARG 63 1HB ARG 63 9.494 14.458 5.620 206 1HG ARG 63 2HG ARG 63 10.900 14.560 3.842 207 2HG ARG 63 1HG ARG 63 9.674 14.004 2.701 208 1HD ARG 63 2HD ARG 63 8.795 16.102 2.409 209 2HD ARG 63 1HD ARG 63 9.311 16.655 4.001 210 HE ARG 63 HE ARG 63 11.495 16.126 2.216 211 1HH1 ARG 63 1HH1 ARG 63 9.144 18.504 3.215 212 2HH1 ARG 63 2HH1 ARG 63 10.096 19.850 2.687 213 1HH2 ARG 63 1HH2 ARG 63 12.750 17.895 1.521 214 2HH2 ARG 63 2HH2 ARG 63 12.143 19.505 1.725 215 H TYR 64 H TYR 64 7.912 13.765 6.901 216 HA TYR 64 HA TYR 64 9.438 12.416 8.750 217 1HB TYR 64 2HB TYR 64 6.668 13.585 8.981 218 2HB TYR 64 1HB TYR 64 7.529 12.922 10.366 219 HD1 TYR 64 1HD TYR 64 7.654 15.549 7.758 220 HD2 TYR 64 2HD TYR 64 9.197 14.176 11.477 221 HE1 TYR 64 1HE TYR 64 8.790 17.706 8.077 222 HE2 TYR 64 2HE TYR 64 10.338 16.330 11.807 223 HH TYR 64 HH TYR 64 11.169 18.294 9.813 224 H PHE 65 H PHE 65 6.511 11.357 7.165 225 HA PHE 65 HA PHE 65 6.077 9.101 8.883 226 1HB PHE 65 2HB PHE 65 4.378 10.390 7.380 227 2HB PHE 65 1HB PHE 65 4.968 9.336 6.099 228 HD1 PHE 65 1HD PHE 65 3.276 7.849 5.637 229 HD2 PHE 65 2HD PHE 65 4.286 8.632 9.695 230 HE1 PHE 65 1HE PHE 65 1.728 6.079 6.356 231 HE2 PHE 65 2HE PHE 65 2.739 6.863 10.425 232 HZ PHE 65 HZ PHE 65 1.457 5.581 8.754 233 H LYS 66 H LYS 66 5.649 6.965 7.286 234 HA LYS 66 HA LYS 66 7.868 6.464 5.528 235 1HB LYS 66 2HB LYS 66 7.784 5.351 8.311 236 2HB LYS 66 1HB LYS 66 8.488 4.397 7.012 237 1HG LYS 66 2HG LYS 66 9.660 6.878 6.703 238 2HG LYS 66 1HG LYS 66 9.572 6.667 8.453 239 1HD LYS 66 2HD LYS 66 10.502 4.280 7.908 240 2HD LYS 66 1HD LYS 66 11.037 5.051 6.414 241 1HE LYS 66 2HE LYS 66 12.498 6.463 7.509 242 2HE LYS 66 1HE LYS 66 11.615 6.362 9.032 243 1HZ LYS 66 1HZ LYS 66 13.019 4.016 7.912 244 2HZ LYS 66 2HZ LYS 66 12.530 4.291 9.508 245 3HZ LYS 66 3HZ LYS 66 13.833 5.155 8.863 246 H GLY 67 H GLY 67 4.942 6.406 5.527 247 1HA GLY 67 2HA GLY 67 3.230 5.129 4.713 248 2HA GLY 67 1HA GLY 67 4.488 4.175 3.945 249 H ILE 68 H ILE 68 2.195 2.982 4.698 250 HA ILE 68 HA ILE 68 3.011 1.349 7.007 251 HB ILE 68 HB ILE 68 1.051 2.643 7.628 252 1HG1 ILE 68 2HG1 ILE 68 0.265 -0.218 7.038 253 2HG1 ILE 68 1HG1 ILE 68 1.246 0.297 8.407 254 1HG2 ILE 68 1HG2 ILE 68 0.331 2.516 5.000 255 2HG2 ILE 68 2HG2 ILE 68 -0.707 3.080 6.313 256 3HG2 ILE 68 3HG2 ILE 68 -0.818 1.409 5.750 257 1HD1 ILE 68 1HD1 ILE 68 -0.756 0.232 9.441 258 2HD1 ILE 68 2HD1 ILE 68 -1.659 0.532 7.957 259 3HD1 ILE 68 3HD1 ILE 68 -0.871 1.868 8.795 260 H VAL 69 H VAL 69 2.947 -0.856 6.722 261 HA VAL 69 HA VAL 69 2.808 -1.772 3.991 262 HB VAL 69 HB VAL 69 3.310 -3.425 6.463 263 1HG1 VAL 69 1HG1 VAL 69 4.759 -4.415 4.299 264 2HG1 VAL 69 2HG1 VAL 69 3.173 -4.015 3.638 265 3HG1 VAL 69 3HG1 VAL 69 3.303 -5.112 5.012 266 1HG2 VAL 69 1HG2 VAL 69 4.969 -1.428 5.136 267 2HG2 VAL 69 2HG2 VAL 69 5.749 -3.006 5.261 268 3HG2 VAL 69 3HG2 VAL 69 5.160 -2.195 6.712 269 H TYR 70 H TYR 70 1.271 -2.949 3.036 270 HA TYR 70 HA TYR 70 -0.835 -4.147 4.651 271 1HB TYR 70 2HB TYR 70 -1.137 -1.906 2.815 272 2HB TYR 70 1HB TYR 70 -2.161 -3.265 2.373 273 HD1 TYR 70 1HD TYR 70 -1.151 -1.619 5.588 274 HD2 TYR 70 2HD TYR 70 -4.303 -3.084 3.136 275 HE1 TYR 70 1HE TYR 70 -2.783 -0.985 7.316 276 HE2 TYR 70 2HE TYR 70 -5.944 -2.451 4.853 277 HH TYR 70 HH TYR 70 -6.190 -1.029 6.733 278 H ALA 71 H ALA 71 -1.946 -5.799 3.665 279 HA ALA 71 HA ALA 71 -0.490 -7.163 1.512 280 1HB ALA 71 1HB ALA 71 -2.569 -8.635 3.002 281 2HB ALA 71 2HB ALA 71 -1.162 -8.141 3.943 282 3HB ALA 71 3HB ALA 71 -0.954 -9.143 2.508 283 H VAL 72 H VAL 72 -1.644 -7.930 -0.315 284 HA VAL 72 HA VAL 72 -4.458 -7.147 -0.473 285 HB VAL 72 HB VAL 72 -2.720 -6.560 -2.828 286 1HG1 VAL 72 1HG1 VAL 72 -4.470 -5.222 -3.513 287 2HG1 VAL 72 2HG1 VAL 72 -5.050 -4.960 -1.868 288 3HG1 VAL 72 3HG1 VAL 72 -5.317 -6.511 -2.660 289 1HG2 VAL 72 1HG2 VAL 72 -2.468 -4.223 -2.000 290 2HG2 VAL 72 2HG2 VAL 72 -1.545 -5.407 -1.076 291 3HG2 VAL 72 3HG2 VAL 72 -3.052 -4.763 -0.426 292 H SER 73 H SER 73 -5.703 -8.526 -1.468 293 HA SER 73 HA SER 73 -4.763 -10.322 -3.514 294 1HB SER 73 2HB SER 73 -6.050 -12.084 -1.711 295 2HB SER 73 1HB SER 73 -4.358 -12.100 -2.205 296 HG SER 73 HG SER 73 -5.327 -11.584 0.185 297 H SER 74 H SER 74 -6.821 -12.108 -3.611 298 HA SER 74 HA SER 74 -9.061 -10.353 -4.256 299 1HB SER 74 2HB SER 74 -9.889 -12.153 -5.623 300 2HB SER 74 1HB SER 74 -8.161 -11.987 -5.937 301 HG SER 74 HG SER 74 -9.421 -13.909 -4.272 302 H ASP 75 H ASP 75 -8.122 -12.389 -1.737 303 HA ASP 75 HA ASP 75 -10.757 -13.317 -1.042 304 1HB ASP 75 2HB ASP 75 -8.011 -13.838 -0.244 305 2HB ASP 75 1HB ASP 75 -9.084 -13.710 1.138 306 H ARG 76 H ARG 76 -8.533 -10.780 -0.034 307 HA ARG 76 HA ARG 76 -10.334 -9.960 2.108 308 1HB ARG 76 2HB ARG 76 -7.594 -9.011 1.275 309 2HB ARG 76 1HB ARG 76 -8.528 -8.256 2.560 310 1HG ARG 76 2HG ARG 76 -8.601 -10.503 3.683 311 2HG ARG 76 1HG ARG 76 -7.432 -11.052 2.481 312 1HD ARG 76 2HD ARG 76 -5.840 -9.392 3.207 313 2HD ARG 76 1HD ARG 76 -7.019 -8.700 4.319 314 HE ARG 76 HE ARG 76 -5.411 -11.045 4.735 315 1HH1 ARG 76 1HH1 ARG 76 -8.348 -9.393 5.641 316 2HH1 ARG 76 2HH1 ARG 76 -8.468 -10.184 7.176 317 1HH2 ARG 76 1HH2 ARG 76 -5.568 -12.088 6.753 318 2HH2 ARG 76 2HH2 ARG 76 -6.890 -11.713 7.809 319 H PHE 77 H PHE 77 -8.997 -8.678 -0.918 320 HA PHE 77 HA PHE 77 -11.115 -6.635 -0.870 321 1HB PHE 77 2HB PHE 77 -8.409 -6.269 -2.156 322 2HB PHE 77 1HB PHE 77 -9.645 -5.045 -1.880 323 HD1 PHE 77 1HD PHE 77 -10.119 -4.278 0.431 324 HD2 PHE 77 2HD PHE 77 -6.847 -6.843 -0.477 325 HE1 PHE 77 1HE PHE 77 -9.086 -3.719 2.592 326 HE2 PHE 77 2HE PHE 77 -5.808 -6.287 1.682 327 HZ PHE 77 HZ PHE 77 -6.928 -4.724 3.220 328 H ARG 78 H ARG 78 -12.551 -6.954 -2.407 329 HA ARG 78 HA ARG 78 -12.210 -8.781 -4.520 330 1HB ARG 78 2HB ARG 78 -14.298 -7.082 -3.430 331 2HB ARG 78 1HB ARG 78 -14.362 -7.162 -5.178 332 1HG ARG 78 2HG ARG 78 -14.119 -9.665 -3.571 333 2HG ARG 78 1HG ARG 78 -15.686 -8.877 -3.767 334 1HD ARG 78 2HD ARG 78 -15.095 -8.893 -6.291 335 2HD ARG 78 1HD ARG 78 -13.926 -10.132 -5.836 336 HE ARG 78 HE ARG 78 -16.588 -10.630 -4.865 337 1HH1 ARG 78 1HH1 ARG 78 -14.390 -11.045 -7.544 338 2HH1 ARG 78 2HH1 ARG 78 -15.228 -12.420 -8.181 339 1HH2 ARG 78 1HH2 ARG 78 -17.690 -12.439 -5.701 340 2HH2 ARG 78 2HH2 ARG 78 -17.102 -13.211 -7.135 341 H SER 79 H SER 79 -11.550 -5.389 -4.220 342 HA SER 79 HA SER 79 -10.307 -5.337 -6.797 343 1HB SER 79 2HB SER 79 -12.690 -3.515 -6.414 344 2HB SER 79 1HB SER 79 -11.680 -3.658 -7.851 345 HG SER 79 HG SER 79 -13.597 -5.445 -6.837 346 H PHE 80 H PHE 80 -9.681 -2.936 -7.323 347 HA PHE 80 HA PHE 80 -7.992 -2.049 -5.273 348 1HB PHE 80 2HB PHE 80 -8.239 -1.540 -7.957 349 2HB PHE 80 1HB PHE 80 -8.738 -0.007 -7.251 350 HD1 PHE 80 1HD PHE 80 -7.045 1.538 -7.252 351 HD2 PHE 80 2HD PHE 80 -6.106 -2.533 -6.457 352 HE1 PHE 80 1HE PHE 80 -4.692 2.151 -6.926 353 HE2 PHE 80 2HE PHE 80 -3.749 -1.926 -6.122 354 HZ PHE 80 HZ PHE 80 -3.036 0.418 -6.359 355 H ASP 81 H ASP 81 -11.248 -1.094 -6.165 356 HA ASP 81 HA ASP 81 -11.397 1.305 -4.716 357 1HB ASP 81 2HB ASP 81 -13.657 -0.640 -5.226 358 2HB ASP 81 1HB ASP 81 -13.802 1.083 -4.889 359 H ALA 82 H ALA 82 -12.034 -2.038 -3.788 360 HA ALA 82 HA ALA 82 -12.983 -1.460 -1.179 361 1HB ALA 82 1HB ALA 82 -12.420 -3.789 -2.772 362 2HB ALA 82 2HB ALA 82 -13.558 -3.582 -1.440 363 3HB ALA 82 3HB ALA 82 -11.880 -4.007 -1.107 364 H LEU 83 H LEU 83 -9.801 -2.251 -2.500 365 HA LEU 83 HA LEU 83 -8.447 -2.457 -0.028 366 1HB LEU 83 2HB LEU 83 -7.543 -3.235 -2.211 367 2HB LEU 83 1HB LEU 83 -7.364 -1.566 -2.703 368 HG LEU 83 HG LEU 83 -5.750 -1.203 -0.879 369 1HD1 LEU 83 1HD1 LEU 83 -5.002 -3.819 -0.214 370 2HD1 LEU 83 2HD1 LEU 83 -6.751 -3.747 -0.006 371 3HD1 LEU 83 3HD1 LEU 83 -5.714 -2.600 0.841 372 1HD2 LEU 83 1HD2 LEU 83 -4.100 -3.092 -1.855 373 2HD2 LEU 83 2HD2 LEU 83 -4.505 -1.605 -2.712 374 3HD2 LEU 83 3HD2 LEU 83 -5.355 -3.103 -3.094 375 H LEU 84 H LEU 84 -8.914 0.162 -2.329 376 HA LEU 84 HA LEU 84 -7.510 2.152 -0.956 377 1HB LEU 84 2HB LEU 84 -9.738 2.176 -2.956 378 2HB LEU 84 1HB LEU 84 -9.224 3.678 -2.206 379 HG LEU 84 HG LEU 84 -7.372 1.831 -3.706 380 1HD1 LEU 84 1HD1 LEU 84 -9.156 4.013 -4.619 381 2HD1 LEU 84 2HD1 LEU 84 -8.617 2.558 -5.458 382 3HD1 LEU 84 3HD1 LEU 84 -7.534 3.941 -5.305 383 1HD2 LEU 84 1HD2 LEU 84 -5.999 3.968 -3.750 384 2HD2 LEU 84 2HD2 LEU 84 -6.120 3.134 -2.198 385 3HD2 LEU 84 3HD2 LEU 84 -7.095 4.572 -2.508 386 H ALA 85 H ALA 85 -10.782 0.890 -0.583 387 HA ALA 85 HA ALA 85 -11.767 2.953 1.101 388 1HB ALA 85 1HB ALA 85 -13.520 1.421 1.670 389 2HB ALA 85 2HB ALA 85 -12.554 0.045 1.138 390 3HB ALA 85 3HB ALA 85 -13.149 1.215 -0.041 391 H ASP 86 H ASP 86 -10.186 -0.139 1.765 392 HA ASP 86 HA ASP 86 -10.216 0.168 4.600 393 1HB ASP 86 2HB ASP 86 -9.856 -1.963 3.017 394 2HB ASP 86 1HB ASP 86 -8.166 -1.558 3.304 395 H LEU 87 H LEU 87 -8.017 0.952 2.007 396 HA LEU 87 HA LEU 87 -5.727 1.524 3.539 397 1HB LEU 87 2HB LEU 87 -6.696 2.492 0.859 398 2HB LEU 87 1HB LEU 87 -5.206 3.095 1.547 399 HG LEU 87 HG LEU 87 -5.817 0.429 0.386 400 1HD1 LEU 87 1HD1 LEU 87 -3.181 1.828 0.439 401 2HD1 LEU 87 2HD1 LEU 87 -4.471 2.396 -0.622 402 3HD1 LEU 87 3HD1 LEU 87 -3.857 0.751 -0.783 403 1HD2 LEU 87 1HD2 LEU 87 -3.915 -0.598 1.545 404 2HD2 LEU 87 2HD2 LEU 87 -5.207 -0.173 2.666 405 3HD2 LEU 87 3HD2 LEU 87 -3.764 0.836 2.561 406 H THR 88 H THR 88 -8.504 3.490 2.640 407 HA THR 88 HA THR 88 -7.551 5.961 3.568 408 HB THR 88 HB THR 88 -10.392 5.647 4.053 409 HG1 THR 88 1HG THR 88 -11.001 4.533 2.398 410 1HG2 THR 88 1HG2 THR 88 -10.640 7.471 2.701 411 2HG2 THR 88 2HG2 THR 88 -9.297 7.015 1.652 412 3HG2 THR 88 3HG2 THR 88 -8.979 7.687 3.252 413 H ARG 89 H ARG 89 -9.120 3.268 5.170 414 HA ARG 89 HA ARG 89 -9.506 4.532 7.676 415 1HB ARG 89 2HB ARG 89 -9.677 1.771 6.612 416 2HB ARG 89 1HB ARG 89 -9.449 1.931 8.348 417 1HG ARG 89 2HG ARG 89 -11.624 2.258 8.566 418 2HG ARG 89 1HG ARG 89 -11.463 3.760 7.653 419 1HD ARG 89 2HD ARG 89 -13.093 2.537 6.498 420 2HD ARG 89 1HD ARG 89 -11.615 2.304 5.564 421 HE ARG 89 HE ARG 89 -11.666 0.074 6.094 422 1HH1 ARG 89 1HH1 ARG 89 -13.891 1.787 8.166 423 2HH1 ARG 89 2HH1 ARG 89 -14.591 0.343 8.817 424 1HH2 ARG 89 1HH2 ARG 89 -12.585 -1.826 6.949 425 2HH2 ARG 89 2HH2 ARG 89 -13.849 -1.708 8.126 426 H SER 90 H SER 90 -6.941 2.359 6.451 427 HA SER 90 HA SER 90 -5.527 2.370 8.938 428 1HB SER 90 2HB SER 90 -5.437 0.827 6.653 429 2HB SER 90 1HB SER 90 -3.918 1.725 6.584 430 HG SER 90 HG SER 90 -4.859 0.143 8.747 431 H LEU 91 H LEU 91 -5.217 4.176 5.919 432 HA LEU 91 HA LEU 91 -2.904 5.581 6.959 433 1HB LEU 91 2HB LEU 91 -4.068 5.024 4.340 434 2HB LEU 91 1HB LEU 91 -3.502 6.665 4.511 435 HG LEU 91 HG LEU 91 -1.924 4.117 4.649 436 1HD1 LEU 91 1HD1 LEU 91 -2.425 5.868 2.613 437 2HD1 LEU 91 2HD1 LEU 91 -1.058 4.757 2.699 438 3HD1 LEU 91 3HD1 LEU 91 -0.869 6.430 3.223 439 1HD2 LEU 91 1HD2 LEU 91 -1.250 6.773 5.848 440 2HD2 LEU 91 2HD2 LEU 91 0.021 5.740 5.192 441 3HD2 LEU 91 3HD2 LEU 91 -1.006 5.152 6.501 442 H SER 92 H SER 92 -6.161 5.877 7.253 443 HA SER 92 HA SER 92 -7.128 8.268 6.631 444 1HB SER 92 2HB SER 92 -8.121 8.340 9.033 445 2HB SER 92 1HB SER 92 -8.526 6.983 7.984 446 HG SER 92 HG SER 92 -6.993 5.740 9.059 447 H ASP 93 H ASP 93 -6.592 10.305 6.757 448 HA ASP 93 HA ASP 93 -5.256 11.412 9.065 449 1HB ASP 93 2HB ASP 93 -3.805 10.741 6.624 450 2HB ASP 93 1HB ASP 93 -3.661 12.445 7.032 451 H ASN 94 H ASN 94 -4.467 13.848 7.866 452 HA ASN 94 HA ASN 94 -6.586 14.919 6.278 453 1HB ASN 94 2HB ASN 94 -7.396 16.539 7.998 454 2HB ASN 94 1HB ASN 94 -7.819 14.866 8.351 455 1HD2 ASN 94 1HD2 ASN 94 -7.248 14.032 10.246 456 2HD2 ASN 94 2HD2 ASN 94 -6.216 14.797 11.403 457 H ILE 95 H ILE 95 -3.684 14.779 6.320 458 HA ILE 95 HA ILE 95 -3.091 17.654 6.238 459 HB ILE 95 HB ILE 95 -1.437 15.397 7.334 460 1HG1 ILE 95 2HG1 ILE 95 -1.061 17.700 8.837 461 2HG1 ILE 95 1HG1 ILE 95 -2.750 17.795 8.349 462 1HG2 ILE 95 1HG2 ILE 95 0.488 17.002 7.377 463 2HG2 ILE 95 2HG2 ILE 95 -0.424 18.014 6.257 464 3HG2 ILE 95 3HG2 ILE 95 0.054 16.385 5.783 465 1HD1 ILE 95 1HD1 ILE 95 -2.401 15.166 9.166 466 2HD1 ILE 95 2HD1 ILE 95 -3.208 16.460 10.052 467 3HD1 ILE 95 3HD1 ILE 95 -1.499 16.130 10.334 468 H ASN 96 H ASN 96 -1.984 14.452 5.133 469 HA ASN 96 HA ASN 96 -0.951 15.633 2.676 470 1HB ASN 96 2HB ASN 96 -0.841 12.721 3.447 471 2HB ASN 96 1HB ASN 96 0.206 13.597 2.340 472 1HD2 ASN 96 1HD2 ASN 96 0.126 12.210 5.256 473 2HD2 ASN 96 2HD2 ASN 96 1.322 13.144 6.081 474 H LEU 97 H LEU 97 -3.401 13.363 3.802 475 HA LEU 97 HA LEU 97 -4.447 13.154 1.062 476 1HB LEU 97 2HB LEU 97 -4.982 11.438 3.488 477 2HB LEU 97 1HB LEU 97 -5.734 11.216 1.919 478 HG LEU 97 HG LEU 97 -2.776 11.217 1.947 479 1HD1 LEU 97 1HD1 LEU 97 -4.416 9.282 3.485 480 2HD1 LEU 97 2HD1 LEU 97 -2.774 9.859 3.772 481 3HD1 LEU 97 3HD1 LEU 97 -3.079 8.651 2.524 482 1HD2 LEU 97 1HD2 LEU 97 -4.905 10.390 0.253 483 2HD2 LEU 97 2HD2 LEU 97 -3.940 8.973 0.669 484 3HD2 LEU 97 3HD2 LEU 97 -3.170 10.379 -0.066 485 HA PRO 98 HA PRO 98 -7.236 16.463 2.620 486 1HB PRO 98 2HB PRO 98 -8.312 15.583 -0.042 487 2HB PRO 98 1HB PRO 98 -8.208 17.205 0.638 488 1HG PRO 98 2HG PRO 98 -6.410 16.371 -1.132 489 2HG PRO 98 1HG PRO 98 -5.922 17.363 0.255 490 1HD PRO 98 2HD PRO 98 -5.471 14.478 -0.253 491 2HD PRO 98 1HD PRO 98 -4.528 15.614 0.731 492 H GLN 99 H GLN 99 -8.809 13.990 0.614 493 HA GLN 99 HA GLN 99 -10.849 13.677 2.688 494 1HB GLN 99 2HB GLN 99 -10.917 12.567 -0.117 495 2HB GLN 99 1HB GLN 99 -12.266 12.771 0.992 496 1HG GLN 99 2HG GLN 99 -12.139 15.159 0.795 497 2HG GLN 99 1HG GLN 99 -10.670 15.040 -0.172 498 1HE2 GLN 99 1HE2 GLN 99 -10.898 13.780 -2.216 499 2HE2 GLN 99 2HE2 GLN 99 -12.359 13.980 -3.117 500 H GLY 100 H GLY 100 -8.243 11.984 1.164 501 1HA GLY 100 2HA GLY 100 -7.550 10.122 2.788 502 2HA GLY 100 1HA GLY 100 -9.111 9.452 2.331 503 H VAL 101 H VAL 101 -7.283 7.793 1.817 504 HA VAL 101 HA VAL 101 -5.812 8.109 -0.589 505 HB VAL 101 HB VAL 101 -6.691 5.513 0.688 506 1HG1 VAL 101 1HG1 VAL 101 -5.516 5.865 -1.730 507 2HG1 VAL 101 2HG1 VAL 101 -5.320 4.429 -0.724 508 3HG1 VAL 101 3HG1 VAL 101 -4.104 5.703 -0.687 509 1HG2 VAL 101 1HG2 VAL 101 -5.218 7.440 1.933 510 2HG2 VAL 101 2HG2 VAL 101 -3.962 6.454 1.183 511 3HG2 VAL 101 3HG2 VAL 101 -5.126 5.713 2.282 512 H ARG 102 H ARG 102 -6.920 8.605 -2.381 513 HA ARG 102 HA ARG 102 -9.352 7.120 -3.023 514 1HB ARG 102 2HB ARG 102 -8.377 9.798 -3.568 515 2HB ARG 102 1HB ARG 102 -8.935 9.000 -5.032 516 1HG ARG 102 2HG ARG 102 -10.637 8.899 -2.595 517 2HG ARG 102 1HG ARG 102 -10.578 10.383 -3.550 518 1HD ARG 102 2HD ARG 102 -12.345 8.512 -4.065 519 2HD ARG 102 1HD ARG 102 -11.584 9.421 -5.364 520 HE ARG 102 HE ARG 102 -9.987 7.430 -5.477 521 1HH1 ARG 102 1HH1 ARG 102 -13.343 7.145 -4.509 522 2HH1 ARG 102 2HH1 ARG 102 -13.469 5.497 -5.015 523 1HH2 ARG 102 1HH2 ARG 102 -10.172 5.270 -6.139 524 2HH2 ARG 102 2HH2 ARG 102 -11.675 4.434 -5.940 525 H TYR 103 H TYR 103 -6.095 7.709 -4.205 526 HA TYR 103 HA TYR 103 -6.463 5.438 -6.001 527 1HB TYR 103 2HB TYR 103 -5.170 7.974 -7.004 528 2HB TYR 103 1HB TYR 103 -5.573 6.530 -7.906 529 HD1 TYR 103 1HD TYR 103 -6.879 9.629 -6.509 530 HD2 TYR 103 2HD TYR 103 -7.857 6.020 -8.533 531 HE1 TYR 103 1HE TYR 103 -9.055 10.581 -7.150 532 HE2 TYR 103 2HE TYR 103 -10.022 6.956 -9.185 533 HH TYR 103 HH TYR 103 -11.541 9.160 -7.883 534 H ILE 104 H ILE 104 -4.499 4.495 -6.763 535 HA ILE 104 HA ILE 104 -2.235 5.013 -4.954 536 HB ILE 104 HB ILE 104 -2.926 2.400 -6.297 537 1HG1 ILE 104 2HG1 ILE 104 -3.601 3.516 -3.589 538 2HG1 ILE 104 1HG1 ILE 104 -4.648 2.684 -4.733 539 1HG2 ILE 104 1HG2 ILE 104 -1.208 1.430 -5.011 540 2HG2 ILE 104 2HG2 ILE 104 -1.023 2.882 -4.026 541 3HG2 ILE 104 3HG2 ILE 104 -0.524 2.893 -5.716 542 1HD1 ILE 104 1HD1 ILE 104 -4.347 1.148 -3.016 543 2HD1 ILE 104 2HD1 ILE 104 -2.632 1.528 -2.847 544 3HD1 ILE 104 3HD1 ILE 104 -3.200 0.622 -4.249 545 H TYR 105 H TYR 105 -0.470 5.767 -5.906 546 HA TYR 105 HA TYR 105 -0.158 5.422 -8.791 547 1HB TYR 105 2HB TYR 105 0.258 7.632 -6.956 548 2HB TYR 105 1HB TYR 105 1.665 7.344 -7.981 549 HD1 TYR 105 1HD TYR 105 -1.594 8.761 -7.803 550 HD2 TYR 105 2HD TYR 105 1.280 7.137 -10.470 551 HE1 TYR 105 1HE TYR 105 -2.733 9.846 -9.676 552 HE2 TYR 105 2HE TYR 105 0.167 8.214 -12.350 553 HH TYR 105 HH TYR 105 -1.335 10.092 -12.789 554 H THR 106 H THR 106 2.057 5.339 -9.628 555 HA THR 106 HA THR 106 3.493 3.213 -8.357 556 HB THR 106 HB THR 106 5.203 4.269 -10.269 557 HG1 THR 106 1HG THR 106 2.585 4.475 -11.308 558 1HG2 THR 106 1HG2 THR 106 3.733 2.592 -11.778 559 2HG2 THR 106 2HG2 THR 106 3.278 2.060 -10.160 560 3HG2 THR 106 3HG2 THR 106 4.976 2.074 -10.639 561 H ILE 107 H ILE 107 5.721 3.286 -7.660 562 HA ILE 107 HA ILE 107 6.278 5.094 -5.695 563 HB ILE 107 HB ILE 107 7.506 2.963 -6.081 564 1HG1 ILE 107 2HG1 ILE 107 9.727 3.863 -5.317 565 2HG1 ILE 107 1HG1 ILE 107 9.113 5.483 -5.637 566 1HG2 ILE 107 1HG2 ILE 107 9.324 2.826 -7.604 567 2HG2 ILE 107 2HG2 ILE 107 9.197 4.538 -8.009 568 3HG2 ILE 107 3HG2 ILE 107 7.931 3.417 -8.511 569 1HD1 ILE 107 1HD1 ILE 107 8.725 3.801 -3.346 570 2HD1 ILE 107 2HD1 ILE 107 7.174 4.257 -4.048 571 3HD1 ILE 107 3HD1 ILE 107 8.327 5.504 -3.570 572 H ASP 108 H ASP 108 6.727 5.521 -9.111 573 HA ASP 108 HA ASP 108 8.284 7.961 -8.705 574 1HB ASP 108 2HB ASP 108 8.591 6.058 -10.572 575 2HB ASP 108 1HB ASP 108 7.470 7.109 -11.434 576 H GLY 109 H GLY 109 5.084 6.885 -9.464 577 1HA GLY 109 2HA GLY 109 3.152 8.201 -9.331 578 2HA GLY 109 1HA GLY 109 4.153 9.642 -9.422 579 H SER 110 H SER 110 4.794 7.209 -11.753 580 HA SER 110 HA SER 110 4.177 8.930 -13.911 581 1HB SER 110 2HB SER 110 4.550 6.770 -15.273 582 2HB SER 110 1HB SER 110 5.904 7.391 -14.328 583 HG SER 110 HG SER 110 5.916 5.522 -13.391 584 H ARG 111 H ARG 111 2.578 6.000 -12.669 585 HA ARG 111 HA ARG 111 0.086 6.928 -13.837 586 1HB ARG 111 2HB ARG 111 -0.297 4.475 -14.580 587 2HB ARG 111 1HB ARG 111 0.680 5.528 -15.595 588 1HG ARG 111 2HG ARG 111 2.545 4.325 -15.273 589 2HG ARG 111 1HG ARG 111 2.186 4.032 -13.570 590 1HD ARG 111 2HD ARG 111 0.688 2.257 -14.116 591 2HD ARG 111 1HD ARG 111 0.754 2.652 -15.832 592 HE ARG 111 HE ARG 111 2.572 1.012 -14.397 593 1HH1 ARG 111 1HH1 ARG 111 2.408 3.334 -16.996 594 2HH1 ARG 111 2HH1 ARG 111 3.802 2.707 -17.810 595 1HH2 ARG 111 1HH2 ARG 111 4.406 0.187 -15.466 596 2HH2 ARG 111 2HH2 ARG 111 4.936 0.921 -16.942 597 H LYS 112 H LYS 112 -1.748 6.038 -12.905 598 HA LYS 112 HA LYS 112 -1.346 5.029 -10.197 599 1HB LYS 112 2HB LYS 112 -2.755 6.882 -10.110 600 2HB LYS 112 1HB LYS 112 -3.592 6.453 -11.586 601 1HG LYS 112 2HG LYS 112 -4.276 4.379 -9.955 602 2HG LYS 112 1HG LYS 112 -4.157 5.717 -8.816 603 1HD LYS 112 2HD LYS 112 -5.882 5.546 -11.284 604 2HD LYS 112 1HD LYS 112 -6.417 5.636 -9.605 605 1HE LYS 112 2HE LYS 112 -5.547 7.892 -9.421 606 2HE LYS 112 1HE LYS 112 -4.907 7.805 -11.060 607 1HZ LYS 112 1HZ LYS 112 -7.222 8.905 -10.540 608 2HZ LYS 112 2HZ LYS 112 -7.765 7.310 -10.688 609 3HZ LYS 112 3HZ LYS 112 -6.955 8.050 -11.976 610 H ILE 113 H ILE 113 -2.174 3.113 -9.470 611 HA ILE 113 HA ILE 113 -2.684 1.097 -11.460 612 HB ILE 113 HB ILE 113 -2.688 0.869 -8.450 613 1HG1 ILE 113 2HG1 ILE 113 -0.544 1.684 -9.657 614 2HG1 ILE 113 1HG1 ILE 113 -0.419 0.365 -8.501 615 1HG2 ILE 113 1HG2 ILE 113 -1.951 -1.557 -9.363 616 2HG2 ILE 113 2HG2 ILE 113 -3.074 -1.061 -10.629 617 3HG2 ILE 113 3HG2 ILE 113 -3.608 -1.115 -8.948 618 1HD1 ILE 113 1HD1 ILE 113 -0.912 -0.547 -11.215 619 2HD1 ILE 113 2HD1 ILE 113 0.308 -1.058 -10.047 620 3HD1 ILE 113 3HD1 ILE 113 0.582 0.373 -11.044 621 H GLY 114 H GLY 114 -4.572 0.162 -11.957 622 1HA GLY 114 2HA GLY 114 -6.965 1.057 -10.474 623 2HA GLY 114 1HA GLY 114 -6.950 0.700 -12.196 624 H SER 115 H SER 115 -5.151 -1.670 -11.594 625 HA SER 115 HA SER 115 -7.236 -3.451 -10.522 626 1HB SER 115 2HB SER 115 -6.052 -5.166 -12.124 627 2HB SER 115 1HB SER 115 -7.249 -4.041 -12.765 628 HG SER 115 HG SER 115 -4.663 -4.289 -13.414 629 H MET 116 H MET 116 -6.600 -5.176 -9.280 630 HA MET 116 HA MET 116 -4.338 -4.840 -7.652 631 1HB MET 116 2HB MET 116 -6.653 -6.319 -7.537 632 2HB MET 116 1HB MET 116 -5.427 -7.561 -7.751 633 1HG MET 116 2HG MET 116 -4.343 -7.002 -5.763 634 2HG MET 116 1HG MET 116 -5.148 -5.436 -5.661 635 1HE MET 116 1HE MET 116 -8.137 -5.675 -5.806 636 2HE MET 116 2HE MET 116 -7.238 -4.965 -4.465 637 3HE MET 116 3HE MET 116 -8.532 -6.118 -4.146 638 H ASP 117 H ASP 117 -4.831 -6.524 -10.640 639 HA ASP 117 HA ASP 117 -2.774 -8.397 -10.536 640 1HB ASP 117 2HB ASP 117 -4.549 -7.236 -12.519 641 2HB ASP 117 1HB ASP 117 -2.969 -7.598 -13.186 642 H GLU 118 H GLU 118 -2.622 -4.973 -10.758 643 HA GLU 118 HA GLU 118 -0.008 -4.964 -12.024 644 1HB GLU 118 2HB GLU 118 -1.753 -2.759 -10.932 645 2HB GLU 118 1HB GLU 118 -0.157 -2.480 -11.612 646 1HG GLU 118 2HG GLU 118 -1.108 -3.737 -13.676 647 2HG GLU 118 1HG GLU 118 -2.672 -3.328 -12.972 648 H LEU 119 H LEU 119 -1.245 -5.263 -8.875 649 HA LEU 119 HA LEU 119 0.995 -4.035 -7.530 650 1HB LEU 119 2HB LEU 119 -0.870 -5.909 -6.151 651 2HB LEU 119 1HB LEU 119 -0.114 -4.447 -5.550 652 HG LEU 119 HG LEU 119 -2.421 -4.568 -7.490 653 1HD1 LEU 119 1HD1 LEU 119 -2.443 -3.493 -4.688 654 2HD1 LEU 119 2HD1 LEU 119 -2.821 -5.177 -5.051 655 3HD1 LEU 119 3HD1 LEU 119 -3.810 -3.885 -5.731 656 1HD2 LEU 119 1HD2 LEU 119 -1.345 -2.115 -6.140 657 2HD2 LEU 119 2HD2 LEU 119 -2.442 -2.232 -7.515 658 3HD2 LEU 119 3HD2 LEU 119 -0.740 -2.652 -7.708 659 H GLU 120 H GLU 120 2.918 -4.996 -7.528 660 HA GLU 120 HA GLU 120 3.069 -7.920 -7.553 661 1HB GLU 120 2HB GLU 120 5.371 -6.003 -7.872 662 2HB GLU 120 1HB GLU 120 5.284 -7.685 -8.353 663 1HG GLU 120 2HG GLU 120 3.912 -7.218 -10.186 664 2HG GLU 120 1HG GLU 120 3.506 -5.615 -9.577 665 H GLU 121 H GLU 121 4.580 -8.999 -6.106 666 HA GLU 121 HA GLU 121 4.257 -8.314 -3.436 667 1HB GLU 121 2HB GLU 121 6.259 -10.092 -4.802 668 2HB GLU 121 1HB GLU 121 6.257 -9.870 -3.056 669 1HG GLU 121 2HG GLU 121 3.777 -10.547 -3.193 670 2HG GLU 121 1HG GLU 121 4.189 -11.158 -4.795 671 H GLY 122 H GLY 122 5.848 -7.741 -1.828 672 1HA GLY 122 2HA GLY 122 7.152 -6.042 -0.988 673 2HA GLY 122 1HA GLY 122 8.351 -6.789 -2.019 674 H GLU 123 H GLU 123 5.459 -4.947 -2.919 675 HA GLU 123 HA GLU 123 7.178 -3.207 -4.534 676 1HB GLU 123 2HB GLU 123 4.307 -3.990 -4.637 677 2HB GLU 123 1HB GLU 123 4.762 -2.428 -5.300 678 1HG GLU 123 2HG GLU 123 6.076 -5.008 -6.102 679 2HG GLU 123 1HG GLU 123 4.685 -4.318 -6.938 680 H SER 124 H SER 124 6.688 -0.908 -4.663 681 HA SER 124 HA SER 124 5.780 0.183 -2.080 682 1HB SER 124 2HB SER 124 7.995 1.112 -3.914 683 2HB SER 124 1HB SER 124 7.339 2.120 -2.625 684 HG SER 124 HG SER 124 9.242 0.819 -2.087 685 H TYR 125 H TYR 125 4.057 1.492 -2.182 686 HA TYR 125 HA TYR 125 3.449 2.767 -4.760 687 1HB TYR 125 2HB TYR 125 1.624 1.241 -2.964 688 2HB TYR 125 1HB TYR 125 0.992 2.490 -4.014 689 HD1 TYR 125 1HD TYR 125 1.561 2.342 -6.485 690 HD2 TYR 125 2HD TYR 125 1.969 -0.935 -3.819 691 HE1 TYR 125 1HE TYR 125 1.555 0.823 -8.383 692 HE2 TYR 125 2HE TYR 125 1.953 -2.491 -5.720 693 HH TYR 125 HH TYR 125 2.621 -2.180 -8.354 694 H VAL 126 H VAL 126 2.073 4.574 -4.693 695 HA VAL 126 HA VAL 126 2.327 6.117 -2.181 696 HB VAL 126 HB VAL 126 2.791 6.974 -5.014 697 1HG1 VAL 126 1HG1 VAL 126 1.520 8.619 -2.881 698 2HG1 VAL 126 2HG1 VAL 126 1.285 8.658 -4.628 699 3HG1 VAL 126 3HG1 VAL 126 2.729 9.380 -3.915 700 1HG2 VAL 126 1HG2 VAL 126 4.861 7.292 -4.277 701 2HG2 VAL 126 2HG2 VAL 126 4.373 6.589 -2.736 702 3HG2 VAL 126 3HG2 VAL 126 4.288 8.335 -2.973 703 H CYS 127 H CYS 127 0.587 7.261 -1.459 704 HA CYS 127 HA CYS 127 -1.961 6.608 -2.730 705 1HB CYS 127 2HB CYS 127 -1.440 7.937 -0.066 706 2HB CYS 127 1HB CYS 127 -2.988 7.334 -0.648 707 HG CYS 127 HG CYS 127 -0.851 5.170 -0.427 708 H SER 128 H SER 128 -3.164 8.026 -3.813 709 HA SER 128 HA SER 128 -2.569 10.891 -3.536 710 1HB SER 128 2HB SER 128 -3.038 9.447 -6.157 711 2HB SER 128 1HB SER 128 -2.801 11.188 -5.957 712 HG SER 128 HG SER 128 -0.830 10.354 -6.484 713 H SER 129 H SER 129 -4.286 12.286 -4.389 714 HA SER 129 HA SER 129 -6.914 11.137 -4.730 715 1HB SER 129 2HB SER 129 -6.871 13.183 -2.587 716 2HB SER 129 1HB SER 129 -7.883 11.749 -2.758 717 HG SER 129 HG SER 129 -6.580 10.790 -1.436 718 H ASP 130 H ASP 130 -5.159 14.139 -4.015 719 HA ASP 130 HA ASP 130 -6.138 15.339 -6.460 720 1HB ASP 130 2HB ASP 130 -7.180 16.076 -3.790 721 2HB ASP 130 1HB ASP 130 -6.725 17.422 -4.830 722 H ASN 131 H ASN 131 -3.572 14.564 -5.177 723 HA ASN 131 HA ASN 131 -2.283 17.184 -4.884 724 1HB ASN 131 2HB ASN 131 -0.976 14.527 -4.365 725 2HB ASN 131 1HB ASN 131 -0.529 16.106 -3.732 726 1HD2 ASN 131 1HD2 ASN 131 -2.300 13.269 -3.223 727 2HD2 ASN 131 2HD2 ASN 131 -3.115 13.746 -1.776 728 H PHE 132 H PHE 132 -0.302 17.629 -5.981 729 HA PHE 132 HA PHE 132 -0.242 16.487 -8.661 730 1HB PHE 132 2HB PHE 132 1.359 18.365 -9.121 731 2HB PHE 132 1HB PHE 132 -0.238 18.882 -8.588 732 HD1 PHE 132 1HD PHE 132 3.270 18.442 -7.541 733 HD2 PHE 132 2HD PHE 132 -0.526 20.118 -6.593 734 HE1 PHE 132 1HE PHE 132 4.306 19.761 -5.740 735 HE2 PHE 132 2HE PHE 132 0.504 21.441 -4.792 736 HZ PHE 132 HZ PHE 132 2.923 21.264 -4.364 737 H PHE 133 H PHE 133 0.774 14.968 -6.339 738 HA PHE 133 HA PHE 133 2.467 13.519 -5.898 739 1HB PHE 133 2HB PHE 133 2.460 13.225 -8.377 740 2HB PHE 133 1HB PHE 133 3.685 14.482 -8.485 741 HD1 PHE 133 1HD PHE 133 5.962 14.009 -8.076 742 HD2 PHE 133 2HD PHE 133 2.984 11.100 -7.190 743 HE1 PHE 133 1HE PHE 133 7.718 12.320 -7.731 744 HE2 PHE 133 2HE PHE 133 4.735 9.406 -6.844 745 HZ PHE 133 HZ PHE 133 7.105 10.015 -7.114 746 H LYS 134 H LYS 134 4.428 13.519 -4.819 747 HA LYS 134 HA LYS 134 5.983 16.004 -4.832 748 1HB LYS 134 2HB LYS 134 4.789 14.661 -2.410 749 2HB LYS 134 1HB LYS 134 6.137 15.784 -2.298 750 1HG LYS 134 2HG LYS 134 4.730 17.508 -3.387 751 2HG LYS 134 1HG LYS 134 3.376 16.378 -3.338 752 1HD LYS 134 2HD LYS 134 3.254 16.437 -1.009 753 2HD LYS 134 1HD LYS 134 4.890 17.081 -0.849 754 1HE LYS 134 2HE LYS 134 3.260 18.868 -2.403 755 2HE LYS 134 1HE LYS 134 2.477 18.510 -0.865 756 1HZ LYS 134 1HZ LYS 134 4.299 20.407 -1.156 757 2HZ LYS 134 2HZ LYS 134 5.319 19.118 -0.753 758 3HZ LYS 134 3HZ LYS 134 4.072 19.571 0.296 759 H LYS 135 H LYS 135 7.990 15.458 -5.338 760 HA LYS 135 HA LYS 135 8.968 12.780 -4.945 761 1HB LYS 135 2HB LYS 135 11.093 13.767 -5.936 762 2HB LYS 135 1HB LYS 135 9.664 13.792 -6.959 763 1HG LYS 135 2HG LYS 135 10.059 16.195 -5.319 764 2HG LYS 135 1HG LYS 135 11.292 15.907 -6.548 765 1HD LYS 135 2HD LYS 135 9.780 16.083 -8.291 766 2HD LYS 135 1HD LYS 135 8.399 15.687 -7.268 767 1HE LYS 135 2HE LYS 135 9.978 18.213 -6.891 768 2HE LYS 135 1HE LYS 135 8.649 18.113 -8.046 769 1HZ LYS 135 1HZ LYS 135 7.986 18.974 -5.847 770 2HZ LYS 135 2HZ LYS 135 8.399 17.487 -5.154 771 3HZ LYS 135 3HZ LYS 135 7.144 17.573 -6.285 772 H VAL 136 H VAL 136 9.249 12.340 -2.813 773 HA VAL 136 HA VAL 136 11.266 13.957 -1.398 774 HB VAL 136 HB VAL 136 9.882 12.710 0.637 775 1HG1 VAL 136 1HG1 VAL 136 8.773 15.121 0.719 776 2HG1 VAL 136 2HG1 VAL 136 10.015 15.436 -0.493 777 3HG1 VAL 136 3HG1 VAL 136 10.470 14.841 1.103 778 1HG2 VAL 136 1HG2 VAL 136 7.886 13.641 -1.422 779 2HG2 VAL 136 2HG2 VAL 136 7.509 13.303 0.269 780 3HG2 VAL 136 3HG2 VAL 136 8.071 12.006 -0.787 781 H GLU 137 H GLU 137 11.617 12.267 0.809 782 HA GLU 137 HA GLU 137 13.257 10.245 -0.379 783 1HB GLU 137 2HB GLU 137 12.599 10.415 2.556 784 2HB GLU 137 1HB GLU 137 14.066 9.809 1.800 785 1HG GLU 137 2HG GLU 137 14.396 12.216 0.980 786 2HG GLU 137 1HG GLU 137 13.186 12.641 2.190 787 H TYR 138 H TYR 138 11.100 9.558 -1.413 788 HA TYR 138 HA TYR 138 9.150 8.069 -0.200 789 1HB TYR 138 2HB TYR 138 10.444 8.127 -2.862 790 2HB TYR 138 1HB TYR 138 9.429 6.729 -2.510 791 HD1 TYR 138 1HD TYR 138 8.050 7.536 -4.456 792 HD2 TYR 138 2HD TYR 138 8.450 9.798 -0.875 793 HE1 TYR 138 1HE TYR 138 6.062 8.846 -5.067 794 HE2 TYR 138 2HE TYR 138 6.460 11.112 -1.477 795 HH TYR 138 HH TYR 138 5.268 11.717 -3.737 796 H THR 139 H THR 139 12.265 6.867 -1.456 797 HA THR 139 HA THR 139 12.248 4.752 0.527 798 HB THR 139 HB THR 139 12.318 2.927 -0.948 799 HG1 THR 139 1HG THR 139 12.632 4.802 -3.049 800 1HG2 THR 139 1HG2 THR 139 10.323 4.841 -2.135 801 2HG2 THR 139 2HG2 THR 139 10.042 3.709 -0.812 802 3HG2 THR 139 3HG2 THR 139 10.373 3.104 -2.435 803 H LYS 140 H LYS 140 13.899 7.168 -0.572 804 HA LYS 140 HA LYS 140 16.384 5.985 -1.371 805 1HB LYS 140 2HB LYS 140 17.292 8.207 -1.294 806 2HB LYS 140 1HB LYS 140 15.691 8.298 -2.011 807 1HG LYS 140 2HG LYS 140 14.781 9.081 0.114 808 2HG LYS 140 1HG LYS 140 16.387 8.984 0.838 809 1HD LYS 140 2HD LYS 140 15.918 11.270 0.201 810 2HD LYS 140 1HD LYS 140 17.201 10.620 -0.820 811 1HE LYS 140 2HE LYS 140 15.977 10.830 -2.683 812 2HE LYS 140 1HE LYS 140 14.526 10.194 -1.908 813 1HZ LYS 140 1HZ LYS 140 14.755 12.706 -2.695 814 2HZ LYS 140 2HZ LYS 140 15.354 12.873 -1.122 815 3HZ LYS 140 3HZ LYS 140 13.802 12.249 -1.373 816 H ASN 141 H ASN 141 17.797 5.046 -0.156 817 HA ASN 141 HA ASN 141 19.077 4.458 1.607 818 1HB ASN 141 2HB ASN 141 18.009 6.873 3.071 819 2HB ASN 141 1HB ASN 141 19.509 6.008 3.384 820 1HD2 ASN 141 1HD2 ASN 141 19.884 8.541 3.157 821 2HD2 ASN 141 2HD2 ASN 141 20.509 9.003 1.615 822 H VAL 142 H VAL 142 15.959 4.129 1.408 823 HA VAL 142 HA VAL 142 15.354 3.430 4.169 824 HB VAL 142 HB VAL 142 13.615 3.207 1.706 825 1HG1 VAL 142 1HG1 VAL 142 12.841 3.083 4.619 826 2HG1 VAL 142 2HG1 VAL 142 13.007 1.681 3.561 827 3HG1 VAL 142 3HG1 VAL 142 11.771 2.896 3.229 828 1HG2 VAL 142 1HG2 VAL 142 12.560 5.185 3.303 829 2HG2 VAL 142 2HG2 VAL 142 13.513 5.438 1.841 830 3HG2 VAL 142 3HG2 VAL 142 14.298 5.463 3.420 831 H ASN 143 H ASN 143 14.998 1.359 4.897 832 HA ASN 143 HA ASN 143 16.315 -0.741 3.454 833 1HB ASN 143 2HB ASN 143 15.194 -0.360 6.157 834 2HB ASN 143 1HB ASN 143 15.115 -2.010 5.545 835 1HD2 ASN 143 1HD2 ASN 143 16.708 -3.119 6.406 836 2HD2 ASN 143 2HD2 ASN 143 18.353 -2.606 6.532 837 HA PRO 144 HA PRO 144 12.415 -1.964 1.550 838 1HB PRO 144 2HB PRO 144 13.440 -3.315 -0.505 839 2HB PRO 144 1HB PRO 144 13.546 -1.552 -0.433 840 1HG PRO 144 2HG PRO 144 15.634 -3.603 0.159 841 2HG PRO 144 1HG PRO 144 15.796 -2.042 -0.664 842 1HD PRO 144 2HD PRO 144 16.408 -2.527 2.011 843 2HD PRO 144 1HD PRO 144 16.115 -0.930 1.299 844 H ASN 145 H ASN 145 14.044 -3.558 3.685 845 HA ASN 145 HA ASN 145 13.449 -6.289 2.878 846 1HB ASN 145 2HB ASN 145 14.777 -5.148 5.340 847 2HB ASN 145 1HB ASN 145 14.501 -6.868 5.083 848 1HD2 ASN 145 1HD2 ASN 145 16.977 -5.256 5.344 849 2HD2 ASN 145 2HD2 ASN 145 17.913 -5.639 3.943 850 H TRP 146 H TRP 146 11.335 -4.200 3.554 851 HA TRP 146 HA TRP 146 10.142 -5.075 5.996 852 1HB TRP 146 2HB TRP 146 8.060 -3.890 4.813 853 2HB TRP 146 1HB TRP 146 9.354 -2.980 5.582 854 HD1 TRP 146 HD TRP 146 10.913 -1.521 4.035 855 HE1 TRP 146 1HE TRP 146 10.748 -0.783 1.576 856 HE3 TRP 146 3HE TRP 146 7.264 -4.744 2.457 857 HZ2 TRP 146 2HZ TRP 146 9.269 -1.470 -0.724 858 HZ3 TRP 146 3HZ TRP 146 6.529 -4.629 0.116 859 HH2 TRP 146 HH TRP 146 7.513 -3.029 -1.441 860 H SER 147 H SER 147 10.114 -6.257 2.772 861 HA SER 147 HA SER 147 7.628 -7.697 3.047 862 1HB SER 147 2HB SER 147 9.457 -7.058 0.905 863 2HB SER 147 1HB SER 147 9.080 -8.780 0.892 864 HG SER 147 HG SER 147 6.844 -8.168 0.954 865 H VAL 148 H VAL 148 10.604 -8.149 4.375 866 HA VAL 148 HA VAL 148 10.690 -11.040 4.072 867 HB VAL 148 HB VAL 148 12.483 -9.313 5.776 868 1HG1 VAL 148 1HG1 VAL 148 13.976 -11.157 5.792 869 2HG1 VAL 148 2HG1 VAL 148 13.035 -12.016 4.571 870 3HG1 VAL 148 3HG1 VAL 148 12.383 -11.797 6.195 871 1HG2 VAL 148 1HG2 VAL 148 12.480 -8.625 3.380 872 2HG2 VAL 148 2HG2 VAL 148 12.999 -10.257 2.959 873 3HG2 VAL 148 3HG2 VAL 148 14.036 -9.230 3.950 874 H ASN 149 H ASN 149 9.670 -8.641 6.359 875 HA ASN 149 HA ASN 149 9.376 -10.615 8.488 876 1HB ASN 149 2HB ASN 149 9.393 -7.656 8.332 877 2HB ASN 149 1HB ASN 149 8.336 -8.359 9.552 878 1HD2 ASN 149 1HD2 ASN 149 9.530 -10.326 10.669 879 2HD2 ASN 149 2HD2 ASN 149 11.091 -9.925 11.290 880 H VAL 150 H VAL 150 7.801 -11.551 6.701 881 HA VAL 150 HA VAL 150 5.115 -10.427 7.092 882 HB VAL 150 HB VAL 150 4.427 -11.861 5.203 883 1HG1 VAL 150 1HG1 VAL 150 4.876 -9.734 4.463 884 2HG1 VAL 150 2HG1 VAL 150 6.002 -10.671 3.481 885 3HG1 VAL 150 3HG1 VAL 150 6.579 -9.818 4.913 886 1HG2 VAL 150 1HG2 VAL 150 6.998 -13.054 5.676 887 2HG2 VAL 150 2HG2 VAL 150 6.884 -12.500 4.006 888 3HG2 VAL 150 3HG2 VAL 150 5.678 -13.613 4.649 Start of MODEL 15 1 1H GLY 38 1HT GLY 38 -5.978 -21.824 20.759 2 2H GLY 38 2HT GLY 38 -5.917 -22.787 22.147 3 3H GLY 38 3HT GLY 38 -5.225 -23.338 20.706 4 1HA GLY 38 1HA GLY 38 -4.215 -20.795 21.650 5 2HA GLY 38 2HA GLY 38 -3.848 -22.169 22.681 6 H ALA 39 H ALA 39 -4.165 -22.083 19.154 7 HA ALA 39 HA ALA 39 -2.725 -22.647 17.484 8 1HB ALA 39 1HB ALA 39 -1.526 -20.660 18.389 9 2HB ALA 39 2HB ALA 39 -0.471 -21.842 17.612 10 3HB ALA 39 3HB ALA 39 -0.551 -21.753 19.371 11 H MET 40 H MET 40 -2.977 -24.838 17.363 12 HA MET 40 HA MET 40 -0.795 -26.436 18.425 13 1HB MET 40 2HB MET 40 -2.901 -26.385 20.010 14 2HB MET 40 1HB MET 40 -3.546 -27.529 18.841 15 1HG MET 40 2HG MET 40 -1.236 -28.722 19.230 16 2HG MET 40 1HG MET 40 -1.291 -27.831 20.751 17 1HE MET 40 1HE MET 40 -1.552 -30.146 22.429 18 2HE MET 40 2HE MET 40 -0.916 -30.654 20.865 19 3HE MET 40 3HE MET 40 -2.245 -31.545 21.607 20 H ASP 41 H ASP 41 -3.977 -26.868 16.862 21 HA ASP 41 HA ASP 41 -2.898 -28.865 15.084 22 1HB ASP 41 2HB ASP 41 -5.618 -27.659 15.498 23 2HB ASP 41 1HB ASP 41 -5.288 -28.657 14.085 24 HA PRO 42 HA PRO 42 -1.802 -25.921 11.925 25 1HB PRO 42 2HB PRO 42 -1.196 -27.651 9.954 26 2HB PRO 42 1HB PRO 42 -0.159 -27.447 11.372 27 1HG PRO 42 2HG PRO 42 -2.182 -29.579 10.795 28 2HG PRO 42 1HG PRO 42 -0.552 -29.739 11.475 29 1HD PRO 42 2HD PRO 42 -2.815 -29.745 12.999 30 2HD PRO 42 1HD PRO 42 -1.244 -29.167 13.591 31 H GLU 43 H GLU 43 -3.384 -24.747 11.027 32 HA GLU 43 HA GLU 43 -5.719 -25.963 9.869 33 1HB GLU 43 2HB GLU 43 -5.543 -23.707 11.135 34 2HB GLU 43 1HB GLU 43 -5.001 -23.059 9.593 35 1HG GLU 43 2HG GLU 43 -7.079 -23.795 8.547 36 2HG GLU 43 1HG GLU 43 -7.621 -24.453 10.090 37 H PHE 44 H PHE 44 -3.485 -23.550 8.480 38 HA PHE 44 HA PHE 44 -4.098 -24.496 5.816 39 1HB PHE 44 2HB PHE 44 -3.717 -22.041 6.564 40 2HB PHE 44 1HB PHE 44 -2.005 -22.436 6.460 41 HD1 PHE 44 1HD PHE 44 -5.042 -23.053 4.372 42 HD2 PHE 44 2HD PHE 44 -1.005 -21.718 4.536 43 HE1 PHE 44 1HE PHE 44 -5.094 -22.613 1.952 44 HE2 PHE 44 2HE PHE 44 -1.049 -21.275 2.115 45 HZ PHE 44 HZ PHE 44 -3.096 -21.722 0.821 46 H ALA 45 H ALA 45 -0.995 -23.837 7.448 47 HA ALA 45 HA ALA 45 1.082 -24.743 7.131 48 1HB ALA 45 1HB ALA 45 -0.029 -26.365 8.626 49 2HB ALA 45 2HB ALA 45 1.213 -27.101 7.615 50 3HB ALA 45 3HB ALA 45 -0.491 -27.312 7.213 51 H LEU 46 H LEU 46 1.397 -23.935 4.988 52 HA LEU 46 HA LEU 46 1.902 -26.021 3.083 53 1HB LEU 46 2HB LEU 46 -0.597 -24.997 2.928 54 2HB LEU 46 1HB LEU 46 0.261 -23.873 1.891 55 HG LEU 46 HG LEU 46 0.004 -26.855 1.538 56 1HD1 LEU 46 1HD1 LEU 46 -1.704 -24.921 0.775 57 2HD1 LEU 46 2HD1 LEU 46 -1.453 -26.417 -0.124 58 3HD1 LEU 46 3HD1 LEU 46 -0.618 -24.944 -0.615 59 1HD2 LEU 46 1HD2 LEU 46 1.276 -26.061 -0.684 60 2HD2 LEU 46 2HD2 LEU 46 2.110 -26.691 0.736 61 3HD2 LEU 46 3HD2 LEU 46 1.995 -24.950 0.482 62 H SER 47 H SER 47 3.905 -25.533 2.490 63 HA SER 47 HA SER 47 4.878 -22.822 2.535 64 1HB SER 47 2HB SER 47 6.237 -24.845 3.215 65 2HB SER 47 1HB SER 47 6.323 -25.269 1.505 66 HG SER 47 HG SER 47 7.851 -23.857 1.298 67 H ASN 48 H ASN 48 6.510 -22.432 0.513 68 HA ASN 48 HA ASN 48 6.665 -21.767 -1.655 69 1HB ASN 48 2HB ASN 48 5.268 -24.356 -1.792 70 2HB ASN 48 1HB ASN 48 5.029 -23.321 -3.197 71 1HD2 ASN 48 1HD2 ASN 48 6.612 -23.135 -4.656 72 2HD2 ASN 48 2HD2 ASN 48 8.174 -23.861 -4.515 73 H GLU 49 H GLU 49 5.828 -19.904 -2.288 74 HA GLU 49 HA GLU 49 4.355 -18.276 -2.880 75 1HB GLU 49 2HB GLU 49 2.945 -20.779 -3.568 76 2HB GLU 49 1HB GLU 49 1.918 -19.361 -3.390 77 1HG GLU 49 2HG GLU 49 2.616 -18.473 -5.308 78 2HG GLU 49 1HG GLU 49 4.305 -18.855 -4.979 79 H LYS 50 H LYS 50 3.957 -17.001 -1.182 80 HA LYS 50 HA LYS 50 2.334 -17.962 1.030 81 1HB LYS 50 2HB LYS 50 4.180 -15.680 0.579 82 2HB LYS 50 1HB LYS 50 2.887 -15.443 1.746 83 1HG LYS 50 2HG LYS 50 4.585 -17.885 1.923 84 2HG LYS 50 1HG LYS 50 5.208 -16.341 2.510 85 1HD LYS 50 2HD LYS 50 2.852 -16.254 3.708 86 2HD LYS 50 1HD LYS 50 2.964 -18.007 3.536 87 1HE LYS 50 2HE LYS 50 5.054 -16.250 4.819 88 2HE LYS 50 1HE LYS 50 3.846 -17.189 5.695 89 1HZ LYS 50 1HZ LYS 50 5.679 -18.496 3.789 90 2HZ LYS 50 2HZ LYS 50 4.831 -19.178 5.084 91 3HZ LYS 50 3HZ LYS 50 6.166 -18.183 5.379 92 H LYS 51 H LYS 51 1.543 -16.834 -1.875 93 HA LYS 51 HA LYS 51 -0.260 -15.790 -2.784 94 1HB LYS 51 2HB LYS 51 -1.170 -17.173 -0.460 95 2HB LYS 51 1HB LYS 51 -2.061 -15.662 -0.583 96 1HG LYS 51 2HG LYS 51 -2.819 -16.216 -2.786 97 2HG LYS 51 1HG LYS 51 -1.787 -17.646 -2.829 98 1HD LYS 51 2HD LYS 51 -3.996 -18.388 -2.346 99 2HD LYS 51 1HD LYS 51 -3.068 -18.509 -0.849 100 1HE LYS 51 2HE LYS 51 -3.995 -16.134 -0.380 101 2HE LYS 51 1HE LYS 51 -5.193 -16.540 -1.609 102 1HZ LYS 51 1HZ LYS 51 -4.660 -18.228 0.771 103 2HZ LYS 51 2HZ LYS 51 -5.942 -18.368 -0.323 104 3HZ LYS 51 3HZ LYS 51 -5.865 -17.041 0.722 105 H ALA 52 H ALA 52 -1.751 -13.879 -2.594 106 HA ALA 52 HA ALA 52 -2.124 -11.668 -2.195 107 1HB ALA 52 1HB ALA 52 -0.494 -11.501 0.248 108 2HB ALA 52 2HB ALA 52 -1.788 -12.698 0.279 109 3HB ALA 52 3HB ALA 52 -2.161 -11.005 -0.045 110 H LYS 53 H LYS 53 -0.680 -9.597 -1.342 111 HA LYS 53 HA LYS 53 2.002 -9.800 -2.488 112 1HB LYS 53 2HB LYS 53 -0.126 -7.872 -3.427 113 2HB LYS 53 1HB LYS 53 1.583 -7.691 -3.796 114 1HG LYS 53 2HG LYS 53 1.515 -9.229 -5.412 115 2HG LYS 53 1HG LYS 53 0.526 -10.330 -4.453 116 1HD LYS 53 2HD LYS 53 -1.431 -8.821 -4.955 117 2HD LYS 53 1HD LYS 53 -0.390 -7.989 -6.112 118 1HE LYS 53 2HE LYS 53 -1.059 -10.930 -6.162 119 2HE LYS 53 1HE LYS 53 -1.807 -9.698 -7.178 120 1HZ LYS 53 1HZ LYS 53 -0.140 -10.667 -8.480 121 2HZ LYS 53 2HZ LYS 53 0.995 -10.648 -7.227 122 3HZ LYS 53 3HZ LYS 53 0.527 -9.200 -7.965 123 H LYS 54 H LYS 54 3.444 -8.704 -1.307 124 HA LYS 54 HA LYS 54 2.483 -7.023 0.847 125 1HB LYS 54 2HB LYS 54 4.967 -8.559 0.296 126 2HB LYS 54 1HB LYS 54 5.124 -7.110 1.278 127 1HG LYS 54 2HG LYS 54 2.961 -8.987 2.010 128 2HG LYS 54 1HG LYS 54 4.619 -9.515 2.304 129 1HD LYS 54 2HD LYS 54 4.870 -8.107 4.026 130 2HD LYS 54 1HD LYS 54 4.137 -6.767 3.145 131 1HE LYS 54 2HE LYS 54 2.183 -7.043 4.180 132 2HE LYS 54 1HE LYS 54 2.180 -8.778 3.863 133 1HZ LYS 54 1HZ LYS 54 3.069 -7.321 6.223 134 2HZ LYS 54 2HZ LYS 54 3.991 -8.669 5.783 135 3HZ LYS 54 3HZ LYS 54 2.339 -8.843 6.099 136 H VAL 55 H VAL 55 2.474 -4.936 0.693 137 HA VAL 55 HA VAL 55 4.451 -3.598 -1.029 138 HB VAL 55 HB VAL 55 2.736 -1.927 -1.667 139 1HG1 VAL 55 1HG1 VAL 55 2.027 -3.073 -3.500 140 2HG1 VAL 55 2HG1 VAL 55 1.657 -4.537 -2.586 141 3HG1 VAL 55 3HG1 VAL 55 3.333 -4.128 -2.956 142 1HG2 VAL 55 1HG2 VAL 55 0.325 -2.784 -1.446 143 2HG2 VAL 55 2HG2 VAL 55 1.094 -2.038 -0.041 144 3HG2 VAL 55 3HG2 VAL 55 0.965 -3.795 -0.151 145 H ARG 56 H ARG 56 4.978 -1.486 -0.468 146 HA ARG 56 HA ARG 56 4.361 -0.763 2.309 147 1HB ARG 56 2HB ARG 56 6.818 -0.877 0.902 148 2HB ARG 56 1HB ARG 56 6.464 0.829 1.138 149 1HG ARG 56 2HG ARG 56 6.138 -0.953 3.478 150 2HG ARG 56 1HG ARG 56 7.782 -0.627 2.926 151 1HD ARG 56 2HD ARG 56 6.673 1.862 2.880 152 2HD ARG 56 1HD ARG 56 5.850 1.132 4.255 153 HE ARG 56 HE ARG 56 8.630 1.863 4.076 154 1HH1 ARG 56 1HH1 ARG 56 6.282 -0.132 5.714 155 2HH1 ARG 56 2HH1 ARG 56 7.242 -0.308 7.143 156 1HH2 ARG 56 1HH2 ARG 56 9.895 1.633 5.958 157 2HH2 ARG 56 2HH2 ARG 56 9.293 0.694 7.283 158 H PHE 57 H PHE 57 2.636 0.562 2.274 159 HA PHE 57 HA PHE 57 2.263 2.342 0.017 160 1HB PHE 57 2HB PHE 57 0.545 1.585 2.366 161 2HB PHE 57 1HB PHE 57 0.102 2.895 1.280 162 HD1 PHE 57 1HD PHE 57 1.605 0.969 -1.004 163 HD2 PHE 57 2HD PHE 57 -1.735 0.731 1.632 164 HE1 PHE 57 1HE PHE 57 0.528 -0.626 -2.516 165 HE2 PHE 57 2HE PHE 57 -2.806 -0.884 0.116 166 HZ PHE 57 HZ PHE 57 -1.679 -1.559 -1.960 167 H TYR 58 H TYR 58 2.659 4.375 -0.048 168 HA TYR 58 HA TYR 58 3.320 5.840 2.416 169 1HB TYR 58 2HB TYR 58 4.387 6.444 -0.328 170 2HB TYR 58 1HB TYR 58 4.901 7.146 1.188 171 HD1 TYR 58 1HD TYR 58 6.191 5.764 2.817 172 HD2 TYR 58 2HD TYR 58 5.312 4.381 -1.109 173 HE1 TYR 58 1HE TYR 58 7.952 4.062 3.029 174 HE2 TYR 58 2HE TYR 58 7.068 2.673 -0.907 175 HH TYR 58 HH TYR 58 8.586 1.940 2.075 176 H ARG 59 H ARG 59 2.576 7.940 2.585 177 HA ARG 59 HA ARG 59 0.321 8.552 0.819 178 1HB ARG 59 2HB ARG 59 -0.138 10.343 2.610 179 2HB ARG 59 1HB ARG 59 -0.409 8.662 3.042 180 1HG ARG 59 2HG ARG 59 0.872 8.982 4.816 181 2HG ARG 59 1HG ARG 59 2.247 9.175 3.732 182 1HD ARG 59 2HD ARG 59 2.126 11.068 5.210 183 2HD ARG 59 1HD ARG 59 1.743 11.584 3.568 184 HE ARG 59 HE ARG 59 -0.686 11.176 4.507 185 1HH1 ARG 59 1HH1 ARG 59 2.024 12.769 6.027 186 2HH1 ARG 59 2HH1 ARG 59 1.030 13.811 6.987 187 1HH2 ARG 59 1HH2 ARG 59 -1.991 12.548 5.768 188 2HH2 ARG 59 2HH2 ARG 59 -1.247 13.688 6.839 189 H ASN 60 H ASN 60 0.654 9.866 -0.804 190 HA ASN 60 HA ASN 60 2.867 11.151 -1.584 191 1HB ASN 60 2HB ASN 60 0.895 11.029 -2.980 192 2HB ASN 60 1HB ASN 60 0.044 12.156 -1.934 193 1HD2 ASN 60 1HD2 ASN 60 -0.042 12.928 -4.363 194 2HD2 ASN 60 2HD2 ASN 60 1.108 14.160 -4.746 195 H GLY 61 H GLY 61 4.110 12.771 -0.999 196 1HA GLY 61 2HA GLY 61 4.854 14.696 0.014 197 2HA GLY 61 1HA GLY 61 3.173 15.181 0.175 198 H ASP 62 H ASP 62 5.775 13.329 1.667 199 HA ASP 62 HA ASP 62 4.707 14.001 4.275 200 1HB ASP 62 2HB ASP 62 5.133 11.510 4.963 201 2HB ASP 62 1HB ASP 62 3.601 11.966 4.226 202 H ARG 63 H ARG 63 7.068 11.541 3.255 203 HA ARG 63 HA ARG 63 9.320 11.398 3.496 204 1HB ARG 63 2HB ARG 63 9.340 14.331 4.183 205 2HB ARG 63 1HB ARG 63 10.655 13.368 3.526 206 1HG ARG 63 2HG ARG 63 10.058 14.004 1.499 207 2HG ARG 63 1HG ARG 63 8.533 13.140 1.705 208 1HD ARG 63 2HD ARG 63 7.365 15.033 2.025 209 2HD ARG 63 1HD ARG 63 8.631 15.762 3.014 210 HE ARG 63 HE ARG 63 9.686 15.885 0.544 211 1HH1 ARG 63 1HH1 ARG 63 6.568 16.824 1.807 212 2HH1 ARG 63 2HH1 ARG 63 6.354 18.107 0.665 213 1HH2 ARG 63 1HH2 ARG 63 9.405 17.574 -0.957 214 2HH2 ARG 63 2HH2 ARG 63 7.963 18.533 -0.904 215 H TYR 64 H TYR 64 7.225 11.823 5.906 216 HA TYR 64 HA TYR 64 9.205 11.203 7.926 217 1HB TYR 64 2HB TYR 64 7.642 13.721 7.831 218 2HB TYR 64 1HB TYR 64 7.750 12.914 9.387 219 HD1 TYR 64 1HD TYR 64 9.596 14.697 6.790 220 HD2 TYR 64 2HD TYR 64 9.893 12.724 10.548 221 HE1 TYR 64 1HE TYR 64 11.817 15.693 7.128 222 HE2 TYR 64 2HE TYR 64 12.117 13.716 10.899 223 HH TYR 64 HH TYR 64 13.334 16.238 8.946 224 H PHE 65 H PHE 65 7.858 9.230 7.274 225 HA PHE 65 HA PHE 65 6.015 8.692 9.386 226 1HB PHE 65 2HB PHE 65 4.440 9.835 7.965 227 2HB PHE 65 1HB PHE 65 4.956 8.906 6.562 228 HD1 PHE 65 1HD PHE 65 3.511 7.277 5.872 229 HD2 PHE 65 2HD PHE 65 3.715 8.211 10.018 230 HE1 PHE 65 1HE PHE 65 1.760 5.611 6.328 231 HE2 PHE 65 2HE PHE 65 1.963 6.546 10.484 232 HZ PHE 65 HZ PHE 65 0.984 5.243 8.637 233 H LYS 66 H LYS 66 7.375 7.708 6.288 234 HA LYS 66 HA LYS 66 8.406 5.764 5.681 235 1HB LYS 66 2HB LYS 66 8.407 5.556 8.479 236 2HB LYS 66 1HB LYS 66 7.751 4.031 7.900 237 1HG LYS 66 2HG LYS 66 9.859 3.384 7.647 238 2HG LYS 66 1HG LYS 66 9.907 4.453 6.244 239 1HD LYS 66 2HD LYS 66 11.164 6.004 7.307 240 2HD LYS 66 1HD LYS 66 10.365 5.740 8.858 241 1HE LYS 66 2HE LYS 66 11.695 3.854 9.335 242 2HE LYS 66 1HE LYS 66 12.264 3.736 7.670 243 1HZ LYS 66 1HZ LYS 66 13.994 4.655 9.003 244 2HZ LYS 66 2HZ LYS 66 12.966 5.832 9.650 245 3HZ LYS 66 3HZ LYS 66 13.398 5.894 8.016 246 H GLY 67 H GLY 67 5.334 6.390 5.841 247 1HA GLY 67 2HA GLY 67 3.410 5.422 5.062 248 2HA GLY 67 1HA GLY 67 4.477 4.383 4.129 249 H ILE 68 H ILE 68 2.303 3.173 4.720 250 HA ILE 68 HA ILE 68 2.917 1.485 7.054 251 HB ILE 68 HB ILE 68 0.937 2.739 7.590 252 1HG1 ILE 68 2HG1 ILE 68 -0.079 0.041 6.710 253 2HG1 ILE 68 1HG1 ILE 68 1.050 0.225 8.049 254 1HG2 ILE 68 1HG2 ILE 68 -0.651 3.362 6.151 255 2HG2 ILE 68 2HG2 ILE 68 -0.821 1.731 5.499 256 3HG2 ILE 68 3HG2 ILE 68 0.446 2.793 4.891 257 1HD1 ILE 68 1HD1 ILE 68 -1.315 1.948 8.189 258 2HD1 ILE 68 2HD1 ILE 68 -0.535 0.976 9.438 259 3HD1 ILE 68 3HD1 ILE 68 -1.640 0.218 8.291 260 H VAL 69 H VAL 69 2.856 -0.705 6.751 261 HA VAL 69 HA VAL 69 2.886 -1.619 4.007 262 HB VAL 69 HB VAL 69 3.225 -3.308 6.483 263 1HG1 VAL 69 1HG1 VAL 69 2.996 -4.051 3.857 264 2HG1 VAL 69 2HG1 VAL 69 3.786 -4.993 5.120 265 3HG1 VAL 69 3HG1 VAL 69 4.744 -3.950 4.071 266 1HG2 VAL 69 1HG2 VAL 69 5.506 -2.132 4.937 267 2HG2 VAL 69 2HG2 VAL 69 5.499 -2.825 6.559 268 3HG2 VAL 69 3HG2 VAL 69 4.762 -1.249 6.270 269 H TYR 70 H TYR 70 1.379 -2.798 2.984 270 HA TYR 70 HA TYR 70 -0.824 -3.919 4.527 271 1HB TYR 70 2HB TYR 70 -0.978 -1.749 2.593 272 2HB TYR 70 1HB TYR 70 -2.007 -3.105 2.147 273 HD1 TYR 70 1HD TYR 70 -1.130 -1.372 5.356 274 HD2 TYR 70 2HD TYR 70 -4.183 -2.834 2.779 275 HE1 TYR 70 1HE TYR 70 -2.835 -0.636 6.968 276 HE2 TYR 70 2HE TYR 70 -5.896 -2.099 4.381 277 HH TYR 70 HH TYR 70 -6.115 -1.584 6.733 278 H ALA 71 H ALA 71 -1.819 -5.655 3.647 279 HA ALA 71 HA ALA 71 -0.320 -7.075 1.561 280 1HB ALA 71 1HB ALA 71 -0.997 -7.961 4.026 281 2HB ALA 71 2HB ALA 71 -0.758 -9.021 2.637 282 3HB ALA 71 3HB ALA 71 -2.387 -8.523 3.095 283 H VAL 72 H VAL 72 -1.433 -7.930 -0.242 284 HA VAL 72 HA VAL 72 -4.266 -7.220 -0.458 285 HB VAL 72 HB VAL 72 -2.514 -6.676 -2.816 286 1HG1 VAL 72 1HG1 VAL 72 -4.366 -4.789 -2.873 287 2HG1 VAL 72 2HG1 VAL 72 -5.221 -5.936 -1.844 288 3HG1 VAL 72 3HG1 VAL 72 -4.690 -6.423 -3.454 289 1HG2 VAL 72 1HG2 VAL 72 -1.328 -5.361 -1.302 290 2HG2 VAL 72 2HG2 VAL 72 -2.769 -4.964 -0.367 291 3HG2 VAL 72 3HG2 VAL 72 -2.521 -4.239 -1.956 292 H SER 73 H SER 73 -5.457 -8.719 -1.322 293 HA SER 73 HA SER 73 -4.496 -10.531 -3.345 294 1HB SER 73 2HB SER 73 -4.712 -12.565 -2.146 295 2HB SER 73 1HB SER 73 -3.779 -11.509 -1.086 296 HG SER 73 HG SER 73 -5.645 -11.112 0.101 297 H SER 74 H SER 74 -6.214 -11.820 -4.267 298 HA SER 74 HA SER 74 -8.608 -10.427 -4.593 299 1HB SER 74 2HB SER 74 -7.666 -13.171 -5.310 300 2HB SER 74 1HB SER 74 -9.382 -12.799 -5.476 301 HG SER 74 HG SER 74 -8.956 -11.505 -7.099 302 H ASP 75 H ASP 75 -7.666 -12.633 -2.120 303 HA ASP 75 HA ASP 75 -10.348 -13.343 -1.358 304 1HB ASP 75 2HB ASP 75 -7.638 -14.158 -0.702 305 2HB ASP 75 1HB ASP 75 -8.642 -14.006 0.728 306 H ARG 76 H ARG 76 -8.009 -10.905 -0.522 307 HA ARG 76 HA ARG 76 -9.484 -10.154 1.881 308 1HB ARG 76 2HB ARG 76 -6.844 -10.156 1.427 309 2HB ARG 76 1HB ARG 76 -7.204 -8.514 0.912 310 1HG ARG 76 2HG ARG 76 -7.870 -9.692 3.603 311 2HG ARG 76 1HG ARG 76 -6.524 -8.605 3.253 312 1HD ARG 76 2HD ARG 76 -8.368 -7.031 2.333 313 2HD ARG 76 1HD ARG 76 -9.462 -8.035 3.283 314 HE ARG 76 HE ARG 76 -7.545 -6.126 4.276 315 1HH1 ARG 76 1HH1 ARG 76 -9.485 -8.925 5.043 316 2HH1 ARG 76 2HH1 ARG 76 -9.487 -8.610 6.746 317 1HH2 ARG 76 1HH2 ARG 76 -7.546 -5.714 6.514 318 2HH2 ARG 76 2HH2 ARG 76 -8.386 -6.789 7.582 319 H PHE 77 H PHE 77 -8.526 -8.713 -1.226 320 HA PHE 77 HA PHE 77 -10.762 -6.826 -0.931 321 1HB PHE 77 2HB PHE 77 -8.057 -6.220 -2.138 322 2HB PHE 77 1HB PHE 77 -9.418 -5.105 -2.045 323 HD1 PHE 77 1HD PHE 77 -10.291 -4.514 0.286 324 HD2 PHE 77 2HD PHE 77 -6.510 -6.337 -0.412 325 HE1 PHE 77 1HE PHE 77 -9.524 -3.764 2.500 326 HE2 PHE 77 2HE PHE 77 -5.736 -5.589 1.799 327 HZ PHE 77 HZ PHE 77 -7.243 -4.300 3.259 328 H ARG 78 H ARG 78 -12.218 -7.078 -2.453 329 HA ARG 78 HA ARG 78 -11.871 -8.771 -4.673 330 1HB ARG 78 2HB ARG 78 -13.986 -7.215 -3.434 331 2HB ARG 78 1HB ARG 78 -14.099 -7.196 -5.181 332 1HG ARG 78 2HG ARG 78 -13.577 -9.853 -4.153 333 2HG ARG 78 1HG ARG 78 -15.054 -9.153 -3.490 334 1HD ARG 78 2HD ARG 78 -14.841 -8.657 -6.328 335 2HD ARG 78 1HD ARG 78 -14.734 -10.381 -5.973 336 HE ARG 78 HE ARG 78 -16.860 -9.596 -4.509 337 1HH1 ARG 78 1HH1 ARG 78 -16.005 -9.163 -7.865 338 2HH1 ARG 78 2HH1 ARG 78 -17.648 -9.127 -8.408 339 1HH2 ARG 78 1HH2 ARG 78 -19.023 -9.549 -5.223 340 2HH2 ARG 78 2HH2 ARG 78 -19.361 -9.345 -6.909 341 H SER 79 H SER 79 -11.313 -5.382 -4.207 342 HA SER 79 HA SER 79 -10.160 -5.153 -6.817 343 1HB SER 79 2HB SER 79 -12.826 -4.765 -6.883 344 2HB SER 79 1HB SER 79 -12.298 -3.129 -6.493 345 HG SER 79 HG SER 79 -12.446 -3.815 -8.815 346 H PHE 80 H PHE 80 -9.595 -2.746 -7.257 347 HA PHE 80 HA PHE 80 -7.890 -1.869 -5.220 348 1HB PHE 80 2HB PHE 80 -8.235 -1.277 -7.879 349 2HB PHE 80 1HB PHE 80 -8.753 0.215 -7.106 350 HD1 PHE 80 1HD PHE 80 -7.098 1.804 -7.144 351 HD2 PHE 80 2HD PHE 80 -6.031 -2.253 -6.454 352 HE1 PHE 80 1HE PHE 80 -4.750 2.471 -6.889 353 HE2 PHE 80 2HE PHE 80 -3.680 -1.593 -6.190 354 HZ PHE 80 HZ PHE 80 -3.034 0.767 -6.408 355 H ASP 81 H ASP 81 -11.197 -0.991 -6.001 356 HA ASP 81 HA ASP 81 -11.390 1.346 -4.456 357 1HB ASP 81 2HB ASP 81 -13.373 -0.655 -5.478 358 2HB ASP 81 1HB ASP 81 -13.898 0.585 -4.343 359 H ALA 82 H ALA 82 -11.886 -2.051 -3.656 360 HA ALA 82 HA ALA 82 -12.782 -1.615 -0.999 361 1HB ALA 82 1HB ALA 82 -12.413 -3.809 -2.717 362 2HB ALA 82 2HB ALA 82 -13.206 -3.779 -1.142 363 3HB ALA 82 3HB ALA 82 -11.484 -4.138 -1.255 364 H LEU 83 H LEU 83 -9.623 -2.253 -2.446 365 HA LEU 83 HA LEU 83 -8.182 -2.509 -0.026 366 1HB LEU 83 2HB LEU 83 -7.317 -3.198 -2.243 367 2HB LEU 83 1HB LEU 83 -7.235 -1.516 -2.721 368 HG LEU 83 HG LEU 83 -5.617 -1.161 -0.813 369 1HD1 LEU 83 1HD1 LEU 83 -4.452 -3.138 0.031 370 2HD1 LEU 83 2HD1 LEU 83 -5.585 -4.174 -0.837 371 3HD1 LEU 83 3HD1 LEU 83 -6.157 -3.148 0.478 372 1HD2 LEU 83 1HD2 LEU 83 -3.851 -2.701 -2.164 373 2HD2 LEU 83 2HD2 LEU 83 -4.416 -1.123 -2.710 374 3HD2 LEU 83 3HD2 LEU 83 -5.163 -2.593 -3.338 375 H LEU 84 H LEU 84 -8.780 0.162 -2.232 376 HA LEU 84 HA LEU 84 -7.403 2.156 -0.834 377 1HB LEU 84 2HB LEU 84 -9.668 2.158 -2.793 378 2HB LEU 84 1HB LEU 84 -9.187 3.657 -2.018 379 HG LEU 84 HG LEU 84 -7.313 1.903 -3.599 380 1HD1 LEU 84 1HD1 LEU 84 -7.550 4.056 -5.129 381 2HD1 LEU 84 2HD1 LEU 84 -9.162 4.071 -4.411 382 3HD1 LEU 84 3HD1 LEU 84 -8.608 2.655 -5.305 383 1HD2 LEU 84 1HD2 LEU 84 -6.087 4.198 -3.609 384 2HD2 LEU 84 2HD2 LEU 84 -5.973 3.147 -2.195 385 3HD2 LEU 84 3HD2 LEU 84 -7.079 4.521 -2.188 386 H ALA 85 H ALA 85 -10.601 0.759 -0.399 387 HA ALA 85 HA ALA 85 -11.677 2.756 1.290 388 1HB ALA 85 1HB ALA 85 -12.953 0.905 0.202 389 2HB ALA 85 2HB ALA 85 -13.308 1.120 1.917 390 3HB ALA 85 3HB ALA 85 -12.258 -0.196 1.391 391 H ASP 86 H ASP 86 -9.874 -0.209 1.981 392 HA ASP 86 HA ASP 86 -9.889 0.148 4.810 393 1HB ASP 86 2HB ASP 86 -9.229 -1.918 3.081 394 2HB ASP 86 1HB ASP 86 -7.677 -1.450 3.768 395 H LEU 87 H LEU 87 -7.777 1.032 2.180 396 HA LEU 87 HA LEU 87 -5.509 1.774 3.668 397 1HB LEU 87 2HB LEU 87 -6.579 2.643 0.991 398 2HB LEU 87 1HB LEU 87 -5.106 3.329 1.643 399 HG LEU 87 HG LEU 87 -5.613 0.599 0.565 400 1HD1 LEU 87 1HD1 LEU 87 -4.419 2.636 -0.536 401 2HD1 LEU 87 2HD1 LEU 87 -3.759 1.012 -0.722 402 3HD1 LEU 87 3HD1 LEU 87 -3.053 2.120 0.453 403 1HD2 LEU 87 1HD2 LEU 87 -3.510 1.211 2.643 404 2HD2 LEU 87 2HD2 LEU 87 -3.596 -0.261 1.678 405 3HD2 LEU 87 3HD2 LEU 87 -4.875 0.110 2.832 406 H THR 88 H THR 88 -8.445 3.511 2.857 407 HA THR 88 HA THR 88 -7.644 6.074 3.662 408 HB THR 88 HB THR 88 -10.430 5.433 4.297 409 HG1 THR 88 1HG THR 88 -10.821 4.187 2.680 410 1HG2 THR 88 1HG2 THR 88 -10.717 7.486 3.550 411 2HG2 THR 88 2HG2 THR 88 -10.125 7.021 1.955 412 3HG2 THR 88 3HG2 THR 88 -8.992 7.573 3.190 413 H ARG 89 H ARG 89 -9.024 3.362 5.431 414 HA ARG 89 HA ARG 89 -9.283 4.693 7.916 415 1HB ARG 89 2HB ARG 89 -9.409 1.871 6.979 416 2HB ARG 89 1HB ARG 89 -9.196 2.157 8.701 417 1HG ARG 89 2HG ARG 89 -11.297 2.924 8.972 418 2HG ARG 89 1HG ARG 89 -11.326 3.718 7.397 419 1HD ARG 89 2HD ARG 89 -11.234 1.092 6.684 420 2HD ARG 89 1HD ARG 89 -12.178 1.018 8.171 421 HE ARG 89 HE ARG 89 -13.071 3.053 6.355 422 1HH1 ARG 89 1HH1 ARG 89 -13.299 -0.330 7.178 423 2HH1 ARG 89 2HH1 ARG 89 -14.854 -0.533 6.443 424 1HH2 ARG 89 1HH2 ARG 89 -15.116 2.789 5.387 425 2HH2 ARG 89 2HH2 ARG 89 -15.886 1.238 5.426 426 H SER 90 H SER 90 -6.741 2.550 6.597 427 HA SER 90 HA SER 90 -5.216 2.613 9.012 428 1HB SER 90 2HB SER 90 -5.094 1.255 6.489 429 2HB SER 90 1HB SER 90 -3.508 1.931 6.864 430 HG SER 90 HG SER 90 -4.868 -0.127 8.060 431 H LEU 91 H LEU 91 -5.060 4.424 5.972 432 HA LEU 91 HA LEU 91 -2.751 5.882 6.954 433 1HB LEU 91 2HB LEU 91 -3.920 5.245 4.359 434 2HB LEU 91 1HB LEU 91 -3.402 6.905 4.491 435 HG LEU 91 HG LEU 91 -1.748 4.409 4.654 436 1HD1 LEU 91 1HD1 LEU 91 -0.958 5.041 2.676 437 2HD1 LEU 91 2HD1 LEU 91 -0.739 6.710 3.200 438 3HD1 LEU 91 3HD1 LEU 91 -2.313 6.167 2.621 439 1HD2 LEU 91 1HD2 LEU 91 -1.204 7.049 5.912 440 2HD2 LEU 91 2HD2 LEU 91 0.129 6.204 5.124 441 3HD2 LEU 91 3HD2 LEU 91 -0.752 5.426 6.439 442 H SER 92 H SER 92 -6.008 6.118 7.282 443 HA SER 92 HA SER 92 -7.030 8.476 6.623 444 1HB SER 92 2HB SER 92 -7.936 8.575 9.090 445 2HB SER 92 1HB SER 92 -8.417 7.260 8.019 446 HG SER 92 HG SER 92 -6.439 7.216 10.046 447 H ASP 93 H ASP 93 -6.559 10.537 6.719 448 HA ASP 93 HA ASP 93 -5.171 11.700 8.971 449 1HB ASP 93 2HB ASP 93 -3.806 11.057 6.473 450 2HB ASP 93 1HB ASP 93 -3.697 12.768 6.863 451 H ASN 94 H ASN 94 -4.507 14.154 7.673 452 HA ASN 94 HA ASN 94 -6.773 15.120 6.218 453 1HB ASN 94 2HB ASN 94 -7.552 16.723 7.928 454 2HB ASN 94 1HB ASN 94 -7.795 15.052 8.427 455 1HD2 ASN 94 1HD2 ASN 94 -7.574 14.997 10.545 456 2HD2 ASN 94 2HD2 ASN 94 -6.272 15.691 11.446 457 H ILE 95 H ILE 95 -3.849 15.079 6.067 458 HA ILE 95 HA ILE 95 -3.322 17.968 6.017 459 HB ILE 95 HB ILE 95 -1.465 15.638 6.474 460 1HG1 ILE 95 2HG1 ILE 95 -0.880 17.557 8.326 461 2HG1 ILE 95 1HG1 ILE 95 -2.606 17.819 8.095 462 1HG2 ILE 95 1HG2 ILE 95 0.380 17.294 6.462 463 2HG2 ILE 95 2HG2 ILE 95 -0.748 18.483 5.811 464 3HG2 ILE 95 3HG2 ILE 95 -0.360 17.036 4.883 465 1HD1 ILE 95 1HD1 ILE 95 -2.961 15.401 8.553 466 2HD1 ILE 95 2HD1 ILE 95 -2.306 16.312 9.913 467 3HD1 ILE 95 3HD1 ILE 95 -1.248 15.278 8.952 468 H ASN 96 H ASN 96 -2.068 15.004 4.478 469 HA ASN 96 HA ASN 96 -1.859 16.440 1.942 470 1HB ASN 96 2HB ASN 96 -0.677 13.902 3.016 471 2HB ASN 96 1HB ASN 96 -0.736 14.174 1.278 472 1HD2 ASN 96 1HD2 ASN 96 0.544 15.315 4.315 473 2HD2 ASN 96 2HD2 ASN 96 1.825 16.262 3.644 474 H LEU 97 H LEU 97 -3.767 14.037 3.523 475 HA LEU 97 HA LEU 97 -5.065 13.329 0.980 476 1HB LEU 97 2HB LEU 97 -5.021 11.921 3.647 477 2HB LEU 97 1HB LEU 97 -6.065 11.444 2.323 478 HG LEU 97 HG LEU 97 -3.097 11.591 1.924 479 1HD1 LEU 97 1HD1 LEU 97 -2.741 9.969 3.397 480 2HD1 LEU 97 2HD1 LEU 97 -3.744 8.915 2.399 481 3HD1 LEU 97 3HD1 LEU 97 -4.466 9.816 3.732 482 1HD2 LEU 97 1HD2 LEU 97 -3.494 10.507 -0.006 483 2HD2 LEU 97 2HD2 LEU 97 -5.127 11.142 0.196 484 3HD2 LEU 97 3HD2 LEU 97 -4.753 9.493 0.699 485 HA PRO 98 HA PRO 98 -7.957 16.566 2.593 486 1HB PRO 98 2HB PRO 98 -9.132 15.488 0.048 487 2HB PRO 98 1HB PRO 98 -9.107 17.143 0.652 488 1HG PRO 98 2HG PRO 98 -7.373 16.362 -1.203 489 2HG PRO 98 1HG PRO 98 -6.873 17.454 0.101 490 1HD PRO 98 2HD PRO 98 -6.232 14.589 -0.313 491 2HD PRO 98 1HD PRO 98 -5.318 15.839 0.551 492 H GLN 99 H GLN 99 -9.445 13.891 0.793 493 HA GLN 99 HA GLN 99 -11.307 13.494 3.018 494 1HB GLN 99 2HB GLN 99 -11.452 12.302 0.245 495 2HB GLN 99 1HB GLN 99 -12.732 12.360 1.448 496 1HG GLN 99 2HG GLN 99 -12.950 14.721 1.211 497 2HG GLN 99 1HG GLN 99 -11.510 14.805 0.198 498 1HE2 GLN 99 1HE2 GLN 99 -11.648 13.387 -1.804 499 2HE2 GLN 99 2HE2 GLN 99 -13.141 13.433 -2.671 500 H GLY 100 H GLY 100 -8.746 11.927 1.256 501 1HA GLY 100 2HA GLY 100 -7.769 10.211 2.956 502 2HA GLY 100 1HA GLY 100 -9.267 9.381 2.556 503 H VAL 101 H VAL 101 -7.457 7.831 1.958 504 HA VAL 101 HA VAL 101 -5.993 8.246 -0.444 505 HB VAL 101 HB VAL 101 -6.754 5.612 0.830 506 1HG1 VAL 101 1HG1 VAL 101 -5.373 4.575 -0.605 507 2HG1 VAL 101 2HG1 VAL 101 -4.210 5.897 -0.605 508 3HG1 VAL 101 3HG1 VAL 101 -5.650 5.994 -1.612 509 1HG2 VAL 101 1HG2 VAL 101 -5.221 5.913 2.424 510 2HG2 VAL 101 2HG2 VAL 101 -5.269 7.623 1.991 511 3HG2 VAL 101 3HG2 VAL 101 -4.044 6.567 1.284 512 H ARG 102 H ARG 102 -7.057 8.653 -2.272 513 HA ARG 102 HA ARG 102 -9.438 7.071 -2.913 514 1HB ARG 102 2HB ARG 102 -8.630 9.811 -3.424 515 2HB ARG 102 1HB ARG 102 -9.146 8.997 -4.894 516 1HG ARG 102 2HG ARG 102 -10.730 9.240 -2.351 517 2HG ARG 102 1HG ARG 102 -11.007 10.129 -3.851 518 1HD ARG 102 2HD ARG 102 -11.543 7.273 -3.202 519 2HD ARG 102 1HD ARG 102 -12.542 8.438 -4.063 520 HE ARG 102 HE ARG 102 -10.102 7.344 -5.321 521 1HH1 ARG 102 1HH1 ARG 102 -13.580 7.780 -5.318 522 2HH1 ARG 102 2HH1 ARG 102 -13.768 7.207 -6.939 523 1HH2 ARG 102 1HH2 ARG 102 -10.369 6.595 -7.444 524 2HH2 ARG 102 2HH2 ARG 102 -11.952 6.534 -8.144 525 H TYR 103 H TYR 103 -6.211 7.829 -4.060 526 HA TYR 103 HA TYR 103 -6.491 5.607 -5.942 527 1HB TYR 103 2HB TYR 103 -5.036 8.072 -6.843 528 2HB TYR 103 1HB TYR 103 -5.652 6.730 -7.786 529 HD1 TYR 103 1HD TYR 103 -7.729 6.807 -8.801 530 HD2 TYR 103 2HD TYR 103 -6.743 9.700 -5.845 531 HE1 TYR 103 1HE TYR 103 -9.736 8.081 -9.397 532 HE2 TYR 103 2HE TYR 103 -8.761 10.985 -6.425 533 HH TYR 103 HH TYR 103 -10.262 11.243 -8.444 534 H ILE 104 H ILE 104 -4.434 4.808 -6.759 535 HA ILE 104 HA ILE 104 -2.230 5.273 -4.861 536 HB ILE 104 HB ILE 104 -2.970 2.646 -6.144 537 1HG1 ILE 104 2HG1 ILE 104 -3.478 3.780 -3.401 538 2HG1 ILE 104 1HG1 ILE 104 -4.630 3.054 -4.517 539 1HG2 ILE 104 1HG2 ILE 104 -0.976 3.130 -3.950 540 2HG2 ILE 104 2HG2 ILE 104 -0.537 3.090 -5.658 541 3HG2 ILE 104 3HG2 ILE 104 -1.230 1.660 -4.893 542 1HD1 ILE 104 1HD1 ILE 104 -3.391 0.877 -4.164 543 2HD1 ILE 104 2HD1 ILE 104 -4.312 1.490 -2.790 544 3HD1 ILE 104 3HD1 ILE 104 -2.559 1.681 -2.834 545 H TYR 105 H TYR 105 -0.465 6.010 -5.817 546 HA TYR 105 HA TYR 105 -0.108 5.582 -8.686 547 1HB TYR 105 2HB TYR 105 0.269 7.852 -6.920 548 2HB TYR 105 1HB TYR 105 1.697 7.534 -7.906 549 HD1 TYR 105 1HD TYR 105 -1.662 8.813 -7.872 550 HD2 TYR 105 2HD TYR 105 1.455 7.377 -10.368 551 HE1 TYR 105 1HE TYR 105 -2.755 9.832 -9.806 552 HE2 TYR 105 2HE TYR 105 0.387 8.387 -12.309 553 HH TYR 105 HH TYR 105 -1.768 9.177 -13.041 554 H THR 106 H THR 106 2.116 5.474 -9.493 555 HA THR 106 HA THR 106 3.536 3.388 -8.149 556 HB THR 106 HB THR 106 5.312 4.221 -10.006 557 HG1 THR 106 1HG THR 106 3.990 6.007 -10.581 558 1HG2 THR 106 1HG2 THR 106 3.091 2.917 -11.341 559 2HG2 THR 106 2HG2 THR 106 3.537 2.140 -9.822 560 3HG2 THR 106 3HG2 THR 106 4.747 2.367 -11.084 561 H ILE 107 H ILE 107 5.766 3.470 -7.442 562 HA ILE 107 HA ILE 107 6.311 5.272 -5.474 563 HB ILE 107 HB ILE 107 7.571 3.167 -5.863 564 1HG1 ILE 107 2HG1 ILE 107 9.760 4.057 -5.084 565 2HG1 ILE 107 1HG1 ILE 107 9.212 5.680 -5.494 566 1HG2 ILE 107 1HG2 ILE 107 7.969 3.554 -8.287 567 2HG2 ILE 107 2HG2 ILE 107 9.415 3.085 -7.391 568 3HG2 ILE 107 3HG2 ILE 107 9.168 4.771 -7.851 569 1HD1 ILE 107 1HD1 ILE 107 7.342 4.273 -3.778 570 2HD1 ILE 107 2HD1 ILE 107 8.067 5.872 -3.601 571 3HD1 ILE 107 3HD1 ILE 107 8.945 4.440 -3.060 572 H ASP 108 H ASP 108 6.818 5.709 -8.892 573 HA ASP 108 HA ASP 108 8.316 8.179 -8.447 574 1HB ASP 108 2HB ASP 108 8.090 6.247 -10.618 575 2HB ASP 108 1HB ASP 108 7.930 7.906 -11.188 576 H GLY 109 H GLY 109 5.159 7.044 -9.315 577 1HA GLY 109 2HA GLY 109 3.200 8.324 -9.231 578 2HA GLY 109 1HA GLY 109 4.177 9.783 -9.273 579 H SER 110 H SER 110 4.966 7.412 -11.612 580 HA SER 110 HA SER 110 4.375 9.141 -13.769 581 1HB SER 110 2HB SER 110 4.939 7.145 -15.186 582 2HB SER 110 1HB SER 110 6.171 7.552 -13.991 583 HG SER 110 HG SER 110 5.824 5.715 -13.017 584 H ARG 111 H ARG 111 2.776 6.207 -12.556 585 HA ARG 111 HA ARG 111 0.310 7.085 -13.812 586 1HB ARG 111 2HB ARG 111 -0.074 4.710 -14.626 587 2HB ARG 111 1HB ARG 111 1.098 5.663 -15.527 588 1HG ARG 111 2HG ARG 111 2.278 3.740 -15.338 589 2HG ARG 111 1HG ARG 111 2.776 4.506 -13.829 590 1HD ARG 111 2HD ARG 111 1.481 3.117 -12.538 591 2HD ARG 111 1HD ARG 111 0.326 2.815 -13.834 592 HE ARG 111 HE ARG 111 2.712 1.332 -13.263 593 1HH1 ARG 111 1HH1 ARG 111 0.458 2.236 -15.769 594 2HH1 ARG 111 2HH1 ARG 111 0.807 0.857 -16.754 595 1HH2 ARG 111 1HH2 ARG 111 3.173 -0.484 -14.558 596 2HH2 ARG 111 2HH2 ARG 111 2.348 -0.688 -16.068 597 H LYS 112 H LYS 112 -1.533 6.271 -12.862 598 HA LYS 112 HA LYS 112 -1.151 5.242 -10.164 599 1HB LYS 112 2HB LYS 112 -2.798 6.642 -9.613 600 2HB LYS 112 1HB LYS 112 -2.888 7.166 -11.283 601 1HG LYS 112 2HG LYS 112 -4.485 5.251 -11.675 602 2HG LYS 112 1HG LYS 112 -4.518 5.038 -9.923 603 1HD LYS 112 2HD LYS 112 -6.400 6.411 -10.722 604 2HD LYS 112 1HD LYS 112 -5.337 7.308 -9.638 605 1HE LYS 112 2HE LYS 112 -4.575 8.682 -11.289 606 2HE LYS 112 1HE LYS 112 -4.767 7.458 -12.544 607 1HZ LYS 112 1HZ LYS 112 -7.303 7.873 -11.904 608 2HZ LYS 112 2HZ LYS 112 -6.502 8.766 -13.096 609 3HZ LYS 112 3HZ LYS 112 -6.682 9.405 -11.540 610 H ILE 113 H ILE 113 -2.019 3.349 -9.420 611 HA ILE 113 HA ILE 113 -2.576 1.345 -11.414 612 HB ILE 113 HB ILE 113 -2.523 1.127 -8.401 613 1HG1 ILE 113 2HG1 ILE 113 -0.382 1.846 -9.614 614 2HG1 ILE 113 1HG1 ILE 113 -0.281 0.451 -8.549 615 1HG2 ILE 113 1HG2 ILE 113 -3.086 -0.798 -10.540 616 2HG2 ILE 113 2HG2 ILE 113 -3.524 -0.830 -8.831 617 3HG2 ILE 113 3HG2 ILE 113 -1.913 -1.339 -9.338 618 1HD1 ILE 113 1HD1 ILE 113 -0.746 0.114 -11.480 619 2HD1 ILE 113 2HD1 ILE 113 -0.100 -1.045 -10.315 620 3HD1 ILE 113 3HD1 ILE 113 0.876 0.337 -10.825 621 H GLY 114 H GLY 114 -4.479 0.404 -11.864 622 1HA GLY 114 2HA GLY 114 -6.842 1.347 -10.362 623 2HA GLY 114 1HA GLY 114 -6.852 1.027 -12.090 624 H SER 115 H SER 115 -5.077 -1.396 -11.494 625 HA SER 115 HA SER 115 -7.218 -3.149 -10.487 626 1HB SER 115 2HB SER 115 -6.473 -4.861 -12.088 627 2HB SER 115 1HB SER 115 -6.963 -3.386 -12.922 628 HG SER 115 HG SER 115 -4.920 -2.980 -13.450 629 H MET 116 H MET 116 -6.646 -4.858 -9.199 630 HA MET 116 HA MET 116 -4.386 -4.569 -7.559 631 1HB MET 116 2HB MET 116 -6.743 -5.979 -7.446 632 2HB MET 116 1HB MET 116 -5.551 -7.259 -7.628 633 1HG MET 116 2HG MET 116 -5.954 -6.890 -5.302 634 2HG MET 116 1HG MET 116 -4.325 -6.344 -5.695 635 1HE MET 116 1HE MET 116 -7.866 -4.155 -4.107 636 2HE MET 116 2HE MET 116 -6.751 -5.001 -3.034 637 3HE MET 116 3HE MET 116 -7.547 -5.873 -4.343 638 H ASP 117 H ASP 117 -4.888 -6.291 -10.527 639 HA ASP 117 HA ASP 117 -2.823 -8.178 -10.318 640 1HB ASP 117 2HB ASP 117 -4.663 -7.189 -12.336 641 2HB ASP 117 1HB ASP 117 -3.094 -7.577 -13.013 642 H GLU 118 H GLU 118 -2.686 -4.790 -10.679 643 HA GLU 118 HA GLU 118 -0.148 -4.807 -12.086 644 1HB GLU 118 2HB GLU 118 -1.750 -2.531 -10.913 645 2HB GLU 118 1HB GLU 118 -0.282 -2.346 -11.862 646 1HG GLU 118 2HG GLU 118 -2.304 -3.965 -13.189 647 2HG GLU 118 1HG GLU 118 -2.848 -2.326 -12.829 648 H LEU 119 H LEU 119 -1.196 -5.063 -8.873 649 HA LEU 119 HA LEU 119 1.067 -3.741 -7.673 650 1HB LEU 119 2HB LEU 119 -0.643 -5.682 -6.187 651 2HB LEU 119 1HB LEU 119 0.109 -4.206 -5.621 652 HG LEU 119 HG LEU 119 -2.316 -4.378 -7.410 653 1HD1 LEU 119 1HD1 LEU 119 -2.941 -5.012 -5.219 654 2HD1 LEU 119 2HD1 LEU 119 -3.406 -3.321 -5.398 655 3HD1 LEU 119 3HD1 LEU 119 -1.955 -3.744 -4.492 656 1HD2 LEU 119 1HD2 LEU 119 -2.357 -2.083 -7.532 657 2HD2 LEU 119 2HD2 LEU 119 -0.625 -2.397 -7.619 658 3HD2 LEU 119 3HD2 LEU 119 -1.352 -1.876 -6.099 659 H GLU 120 H GLU 120 3.026 -4.600 -7.586 660 HA GLU 120 HA GLU 120 3.330 -7.508 -7.741 661 1HB GLU 120 2HB GLU 120 5.534 -5.464 -7.921 662 2HB GLU 120 1HB GLU 120 5.547 -7.126 -8.476 663 1HG GLU 120 2HG GLU 120 4.032 -6.613 -10.259 664 2HG GLU 120 1HG GLU 120 3.813 -4.972 -9.649 665 H GLU 121 H GLU 121 4.799 -8.595 -6.290 666 HA GLU 121 HA GLU 121 4.423 -7.998 -3.605 667 1HB GLU 121 2HB GLU 121 6.510 -9.680 -4.972 668 2HB GLU 121 1HB GLU 121 6.419 -9.532 -3.221 669 1HG GLU 121 2HG GLU 121 3.841 -10.156 -3.889 670 2HG GLU 121 1HG GLU 121 4.774 -11.081 -5.067 671 H GLY 122 H GLY 122 5.969 -7.428 -1.957 672 1HA GLY 122 2HA GLY 122 7.215 -5.709 -1.063 673 2HA GLY 122 1HA GLY 122 8.455 -6.431 -2.065 674 H GLU 123 H GLU 123 5.563 -4.552 -2.920 675 HA GLU 123 HA GLU 123 7.272 -2.834 -4.569 676 1HB GLU 123 2HB GLU 123 4.425 -3.635 -4.625 677 2HB GLU 123 1HB GLU 123 4.783 -2.003 -5.171 678 1HG GLU 123 2HG GLU 123 6.358 -4.300 -6.237 679 2HG GLU 123 1HG GLU 123 4.744 -3.969 -6.864 680 H SER 124 H SER 124 6.709 -0.516 -4.711 681 HA SER 124 HA SER 124 5.963 0.585 -2.080 682 1HB SER 124 2HB SER 124 8.171 1.368 -3.971 683 2HB SER 124 1HB SER 124 7.503 2.539 -2.835 684 HG SER 124 HG SER 124 9.261 0.555 -2.386 685 H TYR 125 H TYR 125 4.089 1.644 -2.204 686 HA TYR 125 HA TYR 125 3.445 3.018 -4.725 687 1HB TYR 125 2HB TYR 125 1.697 1.438 -2.902 688 2HB TYR 125 1HB TYR 125 1.013 2.676 -3.931 689 HD1 TYR 125 1HD TYR 125 1.964 -0.731 -3.764 690 HD2 TYR 125 2HD TYR 125 1.642 2.560 -6.424 691 HE1 TYR 125 1HE TYR 125 1.939 -2.281 -5.669 692 HE2 TYR 125 2HE TYR 125 1.621 1.047 -8.326 693 HH TYR 125 HH TYR 125 0.948 -1.463 -8.687 694 H VAL 126 H VAL 126 2.028 4.786 -4.617 695 HA VAL 126 HA VAL 126 2.277 6.313 -2.096 696 HB VAL 126 HB VAL 126 2.768 7.170 -4.909 697 1HG1 VAL 126 1HG1 VAL 126 1.116 8.751 -4.621 698 2HG1 VAL 126 2HG1 VAL 126 2.508 9.595 -3.943 699 3HG1 VAL 126 3HG1 VAL 126 1.339 8.822 -2.873 700 1HG2 VAL 126 1HG2 VAL 126 4.300 6.865 -2.642 701 2HG2 VAL 126 2HG2 VAL 126 4.044 8.610 -2.728 702 3HG2 VAL 126 3HG2 VAL 126 4.761 7.753 -4.094 703 H CYS 127 H CYS 127 0.520 7.423 -1.359 704 HA CYS 127 HA CYS 127 -2.025 6.707 -2.598 705 1HB CYS 127 2HB CYS 127 -1.395 7.893 0.109 706 2HB CYS 127 1HB CYS 127 -3.007 7.463 -0.452 707 HG CYS 127 HG CYS 127 -2.490 5.312 0.619 708 H SER 128 H SER 128 -3.343 8.122 -3.558 709 HA SER 128 HA SER 128 -2.813 10.993 -3.231 710 1HB SER 128 2HB SER 128 -3.356 9.640 -5.885 711 2HB SER 128 1HB SER 128 -3.073 11.362 -5.626 712 HG SER 128 HG SER 128 -1.006 10.996 -5.568 713 H SER 129 H SER 129 -4.641 12.333 -4.112 714 HA SER 129 HA SER 129 -7.230 11.031 -4.212 715 1HB SER 129 2HB SER 129 -7.848 12.979 -2.400 716 2HB SER 129 1HB SER 129 -7.549 11.292 -1.982 717 HG SER 129 HG SER 129 -6.250 12.568 -0.696 718 H ASP 130 H ASP 130 -5.453 14.094 -4.062 719 HA ASP 130 HA ASP 130 -6.972 15.051 -6.361 720 1HB ASP 130 2HB ASP 130 -7.551 15.932 -3.741 721 2HB ASP 130 1HB ASP 130 -6.652 17.238 -4.507 722 H ASN 131 H ASN 131 -4.406 15.641 -4.019 723 HA ASN 131 HA ASN 131 -2.941 17.554 -5.401 724 1HB ASN 131 2HB ASN 131 -0.952 16.431 -4.129 725 2HB ASN 131 1HB ASN 131 -2.229 17.230 -3.219 726 1HD2 ASN 131 1HD2 ASN 131 -1.733 14.020 -4.673 727 2HD2 ASN 131 2HD2 ASN 131 -2.203 13.132 -3.271 728 H PHE 132 H PHE 132 -0.724 17.177 -6.362 729 HA PHE 132 HA PHE 132 -0.981 15.223 -8.483 730 1HB PHE 132 2HB PHE 132 0.802 17.580 -8.017 731 2HB PHE 132 1HB PHE 132 1.195 16.394 -9.258 732 HD1 PHE 132 1HD PHE 132 -0.818 15.811 -10.873 733 HD2 PHE 132 2HD PHE 132 -0.456 19.402 -8.618 734 HE1 PHE 132 1HE PHE 132 -2.338 16.945 -12.441 735 HE2 PHE 132 2HE PHE 132 -1.976 20.542 -10.181 736 HZ PHE 132 HZ PHE 132 -2.920 19.313 -12.095 737 H PHE 133 H PHE 133 2.165 16.074 -7.506 738 HA PHE 133 HA PHE 133 2.690 13.769 -5.895 739 1HB PHE 133 2HB PHE 133 2.627 13.199 -8.550 740 2HB PHE 133 1HB PHE 133 4.317 13.653 -8.361 741 HD1 PHE 133 1HD PHE 133 5.861 12.204 -7.343 742 HD2 PHE 133 2HD PHE 133 1.699 11.340 -7.159 743 HE1 PHE 133 1HE PHE 133 6.370 9.959 -6.474 744 HE2 PHE 133 2HE PHE 133 2.199 9.094 -6.289 745 HZ PHE 133 HZ PHE 133 4.538 8.401 -5.946 746 H LYS 134 H LYS 134 4.517 14.051 -4.705 747 HA LYS 134 HA LYS 134 6.057 16.476 -5.266 748 1HB LYS 134 2HB LYS 134 6.115 14.885 -2.712 749 2HB LYS 134 1HB LYS 134 6.638 16.545 -2.962 750 1HG LYS 134 2HG LYS 134 3.789 15.591 -3.160 751 2HG LYS 134 1HG LYS 134 4.503 16.377 -1.751 752 1HD LYS 134 2HD LYS 134 4.114 18.380 -2.634 753 2HD LYS 134 1HD LYS 134 5.043 17.956 -4.072 754 1HE LYS 134 2HE LYS 134 3.092 16.993 -5.106 755 2HE LYS 134 1HE LYS 134 2.149 17.232 -3.636 756 1HZ LYS 134 1HZ LYS 134 2.105 18.929 -5.656 757 2HZ LYS 134 2HZ LYS 134 3.395 19.598 -4.792 758 3HZ LYS 134 3HZ LYS 134 1.884 19.423 -4.053 759 H LYS 135 H LYS 135 6.308 13.218 -5.700 760 HA LYS 135 HA LYS 135 8.031 11.717 -5.938 761 1HB LYS 135 2HB LYS 135 8.907 14.228 -7.321 762 2HB LYS 135 1HB LYS 135 9.946 12.810 -7.321 763 1HG LYS 135 2HG LYS 135 8.840 12.320 -9.207 764 2HG LYS 135 1HG LYS 135 7.617 11.698 -8.096 765 1HD LYS 135 2HD LYS 135 6.530 13.945 -8.151 766 2HD LYS 135 1HD LYS 135 7.680 14.414 -9.406 767 1HE LYS 135 2HE LYS 135 5.973 11.967 -9.701 768 2HE LYS 135 1HE LYS 135 5.354 13.564 -10.118 769 1HZ LYS 135 1HZ LYS 135 6.618 12.017 -11.846 770 2HZ LYS 135 2HZ LYS 135 7.952 12.848 -11.220 771 3HZ LYS 135 3HZ LYS 135 6.676 13.707 -11.924 772 H VAL 136 H VAL 136 8.682 11.311 -3.805 773 HA VAL 136 HA VAL 136 11.136 12.727 -2.992 774 HB VAL 136 HB VAL 136 10.204 11.637 -0.645 775 1HG1 VAL 136 1HG1 VAL 136 10.331 14.317 -1.861 776 2HG1 VAL 136 2HG1 VAL 136 11.058 13.699 -0.378 777 3HG1 VAL 136 3HG1 VAL 136 9.354 14.159 -0.401 778 1HG2 VAL 136 1HG2 VAL 136 7.838 12.785 -2.127 779 2HG2 VAL 136 2HG2 VAL 136 7.881 12.380 -0.410 780 3HG2 VAL 136 3HG2 VAL 136 8.035 11.106 -1.622 781 H GLU 137 H GLU 137 12.460 11.409 -1.403 782 HA GLU 137 HA GLU 137 12.999 8.874 -2.635 783 1HB GLU 137 2HB GLU 137 14.299 9.947 -0.133 784 2HB GLU 137 1HB GLU 137 14.959 8.792 -1.282 785 1HG GLU 137 2HG GLU 137 14.301 11.291 -2.566 786 2HG GLU 137 1HG GLU 137 15.404 11.527 -1.211 787 H TYR 138 H TYR 138 10.787 8.206 -2.064 788 HA TYR 138 HA TYR 138 9.899 7.576 0.482 789 1HB TYR 138 2HB TYR 138 9.416 6.497 -2.258 790 2HB TYR 138 1HB TYR 138 8.674 5.692 -0.872 791 HD1 TYR 138 1HD TYR 138 8.015 7.920 -3.376 792 HD2 TYR 138 2HD TYR 138 7.638 7.596 0.848 793 HE1 TYR 138 1HE TYR 138 6.207 9.585 -3.416 794 HE2 TYR 138 2HE TYR 138 5.827 9.257 0.820 795 HH TYR 138 HH TYR 138 5.201 11.247 -1.770 796 H THR 139 H THR 139 12.162 5.886 -1.584 797 HA THR 139 HA THR 139 12.243 3.598 0.223 798 HB THR 139 HB THR 139 13.389 2.425 -1.486 799 HG1 THR 139 1HG THR 139 13.744 4.927 -2.770 800 1HG2 THR 139 1HG2 THR 139 11.974 3.638 -3.586 801 2HG2 THR 139 2HG2 THR 139 10.975 3.800 -2.141 802 3HG2 THR 139 3HG2 THR 139 11.529 2.206 -2.657 803 H LYS 140 H LYS 140 13.621 6.493 0.378 804 HA LYS 140 HA LYS 140 16.397 5.833 0.608 805 1HB LYS 140 2HB LYS 140 14.797 8.211 0.718 806 2HB LYS 140 1HB LYS 140 15.861 8.169 2.115 807 1HG LYS 140 2HG LYS 140 17.026 7.571 -0.550 808 2HG LYS 140 1HG LYS 140 16.607 9.243 -0.171 809 1HD LYS 140 2HD LYS 140 18.145 7.677 1.839 810 2HD LYS 140 1HD LYS 140 18.989 8.254 0.400 811 1HE LYS 140 2HE LYS 140 18.451 10.519 0.897 812 2HE LYS 140 1HE LYS 140 17.334 10.038 2.174 813 1HZ LYS 140 1HZ LYS 140 20.245 10.193 2.212 814 2HZ LYS 140 2HZ LYS 140 19.543 8.924 3.081 815 3HZ LYS 140 3HZ LYS 140 19.127 10.524 3.438 816 H ASN 141 H ASN 141 17.339 4.787 2.149 817 HA ASN 141 HA ASN 141 17.816 3.841 4.139 818 1HB ASN 141 2HB ASN 141 16.682 6.481 4.850 819 2HB ASN 141 1HB ASN 141 16.817 5.309 6.156 820 1HD2 ASN 141 1HD2 ASN 141 18.704 6.680 3.488 821 2HD2 ASN 141 2HD2 ASN 141 20.205 6.720 4.343 822 H VAL 142 H VAL 142 15.108 3.423 2.792 823 HA VAL 142 HA VAL 142 13.445 2.634 5.045 824 HB VAL 142 HB VAL 142 12.877 2.311 2.097 825 1HG1 VAL 142 1HG1 VAL 142 10.555 2.110 2.796 826 2HG1 VAL 142 2HG1 VAL 142 11.030 2.306 4.483 827 3HG1 VAL 142 3HG1 VAL 142 11.545 0.879 3.582 828 1HG2 VAL 142 1HG2 VAL 142 12.556 4.507 1.973 829 2HG2 VAL 142 2HG2 VAL 142 13.000 4.691 3.670 830 3HG2 VAL 142 3HG2 VAL 142 11.322 4.384 3.227 831 H ASN 143 H ASN 143 15.280 1.171 2.408 832 HA ASN 143 HA ASN 143 16.031 -0.949 2.075 833 1HB ASN 143 2HB ASN 143 15.766 -0.712 4.960 834 2HB ASN 143 1HB ASN 143 15.517 -2.368 4.418 835 1HD2 ASN 143 1HD2 ASN 143 17.187 -3.367 3.166 836 2HD2 ASN 143 2HD2 ASN 143 18.829 -2.867 3.361 837 HA PRO 144 HA PRO 144 12.048 -2.780 1.062 838 1HB PRO 144 2HB PRO 144 13.404 -4.459 -0.851 839 2HB PRO 144 1HB PRO 144 12.371 -3.063 -1.154 840 1HG PRO 144 2HG PRO 144 15.066 -3.115 -1.652 841 2HG PRO 144 1HG PRO 144 14.141 -1.637 -1.339 842 1HD PRO 144 2HD PRO 144 15.883 -3.215 0.518 843 2HD PRO 144 1HD PRO 144 15.706 -1.454 0.355 844 H ASN 145 H ASN 145 13.820 -3.903 3.230 845 HA ASN 145 HA ASN 145 13.621 -6.767 2.811 846 1HB ASN 145 2HB ASN 145 14.709 -6.932 5.027 847 2HB ASN 145 1HB ASN 145 15.620 -5.926 3.905 848 1HD2 ASN 145 1HD2 ASN 145 16.091 -5.749 6.569 849 2HD2 ASN 145 2HD2 ASN 145 15.516 -4.236 7.176 850 H TRP 146 H TRP 146 11.452 -4.480 3.636 851 HA TRP 146 HA TRP 146 10.220 -5.664 5.924 852 1HB TRP 146 2HB TRP 146 8.228 -4.169 5.038 853 2HB TRP 146 1HB TRP 146 9.633 -3.450 5.813 854 HD1 TRP 146 HD TRP 146 11.102 -1.831 4.396 855 HE1 TRP 146 1HE TRP 146 10.907 -0.855 2.022 856 HE3 TRP 146 3HE TRP 146 7.382 -4.837 2.586 857 HZ2 TRP 146 2HZ TRP 146 9.377 -1.300 -0.308 858 HZ3 TRP 146 3HZ TRP 146 6.608 -4.493 0.281 859 HH2 TRP 146 HH TRP 146 7.587 -2.765 -1.139 860 H SER 147 H SER 147 9.967 -6.129 2.491 861 HA SER 147 HA SER 147 7.449 -7.527 2.640 862 1HB SER 147 2HB SER 147 8.560 -8.148 0.177 863 2HB SER 147 1HB SER 147 7.468 -6.805 0.515 864 HG SER 147 HG SER 147 9.792 -6.536 -0.450 865 H VAL 148 H VAL 148 10.758 -8.359 3.032 866 HA VAL 148 HA VAL 148 10.355 -11.156 2.378 867 HB VAL 148 HB VAL 148 12.719 -11.425 3.047 868 1HG1 VAL 148 1HG1 VAL 148 13.536 -10.626 1.064 869 2HG1 VAL 148 2HG1 VAL 148 12.703 -9.080 1.219 870 3HG1 VAL 148 3HG1 VAL 148 11.805 -10.521 0.745 871 1HG2 VAL 148 1HG2 VAL 148 12.822 -8.440 3.349 872 2HG2 VAL 148 2HG2 VAL 148 14.069 -9.622 3.740 873 3HG2 VAL 148 3HG2 VAL 148 12.608 -9.520 4.725 874 H ASN 149 H ASN 149 9.899 -9.174 5.075 875 HA ASN 149 HA ASN 149 10.436 -11.288 7.010 876 1HB ASN 149 2HB ASN 149 9.901 -8.362 7.155 877 2HB ASN 149 1HB ASN 149 9.428 -9.341 8.540 878 1HD2 ASN 149 1HD2 ASN 149 10.911 -8.832 10.014 879 2HD2 ASN 149 2HD2 ASN 149 12.618 -9.002 9.806 880 H VAL 150 H VAL 150 8.522 -12.151 5.353 881 HA VAL 150 HA VAL 150 5.950 -11.646 6.672 882 HB VAL 150 HB VAL 150 4.945 -12.838 4.746 883 1HG1 VAL 150 1HG1 VAL 150 5.650 -11.073 3.010 884 2HG1 VAL 150 2HG1 VAL 150 6.658 -10.419 4.301 885 3HG1 VAL 150 3HG1 VAL 150 4.910 -10.521 4.512 886 1HG2 VAL 150 1HG2 VAL 150 6.295 -13.362 2.794 887 2HG2 VAL 150 2HG2 VAL 150 6.875 -14.256 4.200 888 3HG2 VAL 150 3HG2 VAL 150 7.751 -12.832 3.637 Start of MODEL 16 1 1H GLY 38 1HT GLY 38 -7.552 -32.917 16.175 2 2H GLY 38 2HT GLY 38 -6.282 -31.836 16.458 3 3H GLY 38 3HT GLY 38 -6.986 -32.669 17.750 4 1HA GLY 38 1HA GLY 38 -5.061 -33.865 17.425 5 2HA GLY 38 2HA GLY 38 -6.260 -34.783 16.527 6 H ALA 39 H ALA 39 -6.535 -33.254 14.250 7 HA ALA 39 HA ALA 39 -4.277 -34.072 12.750 8 1HB ALA 39 1HB ALA 39 -6.834 -33.515 12.115 9 2HB ALA 39 2HB ALA 39 -5.529 -33.604 10.933 10 3HB ALA 39 3HB ALA 39 -6.046 -32.038 11.558 11 H MET 40 H MET 40 -2.371 -33.109 12.615 12 HA MET 40 HA MET 40 -2.086 -30.324 13.410 13 1HB MET 40 2HB MET 40 0.323 -30.766 13.339 14 2HB MET 40 1HB MET 40 -0.514 -31.961 14.319 15 1HG MET 40 2HG MET 40 -0.427 -33.547 12.467 16 2HG MET 40 1HG MET 40 0.409 -32.348 11.481 17 1HE MET 40 1HE MET 40 2.218 -35.603 12.899 18 2HE MET 40 2HE MET 40 2.953 -34.676 11.590 19 3HE MET 40 3HE MET 40 1.212 -34.962 11.600 20 H ASP 41 H ASP 41 -1.387 -28.681 12.096 21 HA ASP 41 HA ASP 41 -1.799 -29.058 9.267 22 1HB ASP 41 2HB ASP 41 -0.929 -26.563 10.739 23 2HB ASP 41 1HB ASP 41 -1.567 -26.648 9.100 24 HA PRO 42 HA PRO 42 2.406 -29.658 8.080 25 1HB PRO 42 2HB PRO 42 1.922 -28.030 5.676 26 2HB PRO 42 1HB PRO 42 2.323 -29.742 5.810 27 1HG PRO 42 2HG PRO 42 -0.126 -28.909 5.072 28 2HG PRO 42 1HG PRO 42 0.123 -30.382 6.027 29 1HD PRO 42 2HD PRO 42 -0.773 -27.668 6.925 30 2HD PRO 42 1HD PRO 42 -1.344 -29.271 7.435 31 H GLU 43 H GLU 43 1.620 -26.477 6.701 32 HA GLU 43 HA GLU 43 2.510 -24.408 6.982 33 1HB GLU 43 2HB GLU 43 3.713 -25.531 9.521 34 2HB GLU 43 1HB GLU 43 3.611 -23.830 9.091 35 1HG GLU 43 2HG GLU 43 1.179 -25.565 9.366 36 2HG GLU 43 1HG GLU 43 1.895 -24.708 10.730 37 H PHE 44 H PHE 44 4.949 -26.705 8.191 38 HA PHE 44 HA PHE 44 7.035 -25.338 6.725 39 1HB PHE 44 2HB PHE 44 6.893 -27.154 8.961 40 2HB PHE 44 1HB PHE 44 8.047 -27.751 7.773 41 HD1 PHE 44 1HD PHE 44 10.085 -26.568 7.314 42 HD2 PHE 44 2HD PHE 44 7.247 -25.025 10.085 43 HE1 PHE 44 1HE PHE 44 11.770 -24.980 8.150 44 HE2 PHE 44 2HE PHE 44 8.925 -23.433 10.924 45 HZ PHE 44 HZ PHE 44 11.189 -23.410 9.956 46 H ALA 45 H ALA 45 8.703 -27.075 5.727 47 HA ALA 45 HA ALA 45 9.168 -28.594 4.085 48 1HB ALA 45 1HB ALA 45 7.020 -29.750 5.329 49 2HB ALA 45 2HB ALA 45 7.967 -30.482 4.033 50 3HB ALA 45 3HB ALA 45 6.469 -29.629 3.657 51 H LEU 46 H LEU 46 9.527 -26.813 2.699 52 HA LEU 46 HA LEU 46 9.290 -25.634 0.771 53 1HB LEU 46 2HB LEU 46 7.776 -28.083 0.367 54 2HB LEU 46 1HB LEU 46 7.133 -26.754 -0.579 55 HG LEU 46 HG LEU 46 10.021 -27.628 -0.636 56 1HD1 LEU 46 1HD1 LEU 46 9.137 -29.403 -1.720 57 2HD1 LEU 46 2HD1 LEU 46 9.090 -28.261 -3.064 58 3HD1 LEU 46 3HD1 LEU 46 7.638 -28.561 -2.109 59 1HD2 LEU 46 1HD2 LEU 46 9.945 -25.389 -1.302 60 2HD2 LEU 46 2HD2 LEU 46 8.414 -25.598 -2.151 61 3HD2 LEU 46 3HD2 LEU 46 9.893 -26.292 -2.816 62 H SER 47 H SER 47 7.594 -24.382 -0.585 63 HA SER 47 HA SER 47 5.142 -23.718 0.756 64 1HB SER 47 2HB SER 47 7.083 -22.450 1.946 65 2HB SER 47 1HB SER 47 7.079 -21.433 0.505 66 HG SER 47 HG SER 47 4.728 -21.242 0.955 67 H ASN 48 H ASN 48 4.814 -24.596 -1.519 68 HA ASN 48 HA ASN 48 5.333 -22.756 -3.680 69 1HB ASN 48 2HB ASN 48 3.725 -25.317 -3.582 70 2HB ASN 48 1HB ASN 48 4.068 -24.403 -5.048 71 1HD2 ASN 48 1HD2 ASN 48 5.040 -26.926 -3.159 72 2HD2 ASN 48 2HD2 ASN 48 6.664 -27.092 -3.724 73 H GLU 49 H GLU 49 3.276 -22.492 -5.221 74 HA GLU 49 HA GLU 49 1.415 -21.225 -5.575 75 1HB GLU 49 2HB GLU 49 0.410 -23.343 -4.721 76 2HB GLU 49 1HB GLU 49 0.394 -22.642 -3.110 77 1HG GLU 49 2HG GLU 49 -0.923 -20.721 -4.389 78 2HG GLU 49 1HG GLU 49 -1.324 -22.074 -5.448 79 H LYS 50 H LYS 50 2.004 -19.137 -5.242 80 HA LYS 50 HA LYS 50 2.138 -18.071 -2.540 81 1HB LYS 50 2HB LYS 50 2.878 -15.992 -3.637 82 2HB LYS 50 1HB LYS 50 3.852 -17.375 -4.118 83 1HG LYS 50 2HG LYS 50 1.776 -17.221 -5.990 84 2HG LYS 50 1HG LYS 50 2.332 -15.565 -5.741 85 1HD LYS 50 2HD LYS 50 3.688 -16.379 -7.467 86 2HD LYS 50 1HD LYS 50 4.693 -16.513 -6.024 87 1HE LYS 50 2HE LYS 50 4.343 -18.845 -5.879 88 2HE LYS 50 1HE LYS 50 3.021 -18.793 -7.043 89 1HZ LYS 50 1HZ LYS 50 5.302 -19.616 -7.820 90 2HZ LYS 50 2HZ LYS 50 5.749 -17.985 -7.823 91 3HZ LYS 50 3HZ LYS 50 4.478 -18.514 -8.805 92 H LYS 51 H LYS 51 1.049 -15.944 -2.110 93 HA LYS 51 HA LYS 51 -1.353 -15.361 -3.583 94 1HB LYS 51 2HB LYS 51 -1.787 -17.359 -1.945 95 2HB LYS 51 1HB LYS 51 -1.805 -16.101 -0.717 96 1HG LYS 51 2HG LYS 51 -3.911 -15.645 -1.207 97 2HG LYS 51 1HG LYS 51 -3.446 -15.238 -2.859 98 1HD LYS 51 2HD LYS 51 -3.702 -17.547 -3.538 99 2HD LYS 51 1HD LYS 51 -4.048 -18.026 -1.875 100 1HE LYS 51 2HE LYS 51 -6.118 -17.881 -3.083 101 2HE LYS 51 1HE LYS 51 -6.044 -16.557 -1.920 102 1HZ LYS 51 1HZ LYS 51 -5.542 -16.389 -4.841 103 2HZ LYS 51 2HZ LYS 51 -5.282 -15.115 -3.760 104 3HZ LYS 51 3HZ LYS 51 -6.845 -15.720 -3.992 105 H ALA 52 H ALA 52 -2.368 -13.413 -2.914 106 HA ALA 52 HA ALA 52 -2.431 -11.284 -2.115 107 1HB ALA 52 1HB ALA 52 -0.686 -12.167 0.166 108 2HB ALA 52 2HB ALA 52 -2.402 -12.564 0.081 109 3HB ALA 52 3HB ALA 52 -1.889 -10.878 0.138 110 H LYS 53 H LYS 53 -0.911 -9.423 -1.359 111 HA LYS 53 HA LYS 53 1.792 -9.728 -2.432 112 1HB LYS 53 2HB LYS 53 -0.157 -7.605 -3.353 113 2HB LYS 53 1HB LYS 53 1.552 -7.654 -3.764 114 1HG LYS 53 2HG LYS 53 -0.094 -10.041 -4.396 115 2HG LYS 53 1HG LYS 53 -0.310 -8.595 -5.382 116 1HD LYS 53 2HD LYS 53 1.553 -9.045 -6.507 117 2HD LYS 53 1HD LYS 53 2.486 -9.059 -5.010 118 1HE LYS 53 2HE LYS 53 2.696 -11.271 -5.101 119 2HE LYS 53 1HE LYS 53 0.949 -11.476 -5.235 120 1HZ LYS 53 1HZ LYS 53 2.585 -10.722 -7.576 121 2HZ LYS 53 2HZ LYS 53 1.046 -11.424 -7.544 122 3HZ LYS 53 3HZ LYS 53 2.403 -12.342 -7.122 123 H LYS 54 H LYS 54 3.255 -8.704 -1.201 124 HA LYS 54 HA LYS 54 2.302 -7.026 0.961 125 1HB LYS 54 2HB LYS 54 4.484 -8.876 0.603 126 2HB LYS 54 1HB LYS 54 5.100 -7.317 1.131 127 1HG LYS 54 2HG LYS 54 4.617 -7.956 3.196 128 2HG LYS 54 1HG LYS 54 2.918 -7.741 2.770 129 1HD LYS 54 2HD LYS 54 3.960 -10.298 1.866 130 2HD LYS 54 1HD LYS 54 4.129 -10.090 3.609 131 1HE LYS 54 2HE LYS 54 1.906 -10.175 3.964 132 2HE LYS 54 1HE LYS 54 1.535 -9.266 2.500 133 1HZ LYS 54 1HZ LYS 54 1.040 -11.868 2.804 134 2HZ LYS 54 2HZ LYS 54 2.566 -11.943 2.078 135 3HZ LYS 54 3HZ LYS 54 1.300 -11.134 1.301 136 H VAL 55 H VAL 55 2.374 -4.943 0.846 137 HA VAL 55 HA VAL 55 4.411 -3.641 -0.833 138 HB VAL 55 HB VAL 55 2.744 -1.906 -1.447 139 1HG1 VAL 55 1HG1 VAL 55 1.650 -4.503 -2.411 140 2HG1 VAL 55 2HG1 VAL 55 3.305 -4.040 -2.812 141 3HG1 VAL 55 3HG1 VAL 55 1.958 -3.006 -3.293 142 1HG2 VAL 55 1HG2 VAL 55 0.936 -3.747 0.052 143 2HG2 VAL 55 2HG2 VAL 55 0.306 -2.747 -1.257 144 3HG2 VAL 55 3HG2 VAL 55 1.075 -1.990 0.142 145 H ARG 56 H ARG 56 4.975 -1.539 -0.249 146 HA ARG 56 HA ARG 56 4.366 -0.834 2.537 147 1HB ARG 56 2HB ARG 56 6.798 -1.196 1.821 148 2HB ARG 56 1HB ARG 56 6.625 0.258 0.848 149 1HG ARG 56 2HG ARG 56 7.450 1.242 2.695 150 2HG ARG 56 1HG ARG 56 5.762 1.199 3.204 151 1HD ARG 56 2HD ARG 56 6.130 -0.413 4.752 152 2HD ARG 56 1HD ARG 56 7.365 -1.214 3.781 153 HE ARG 56 HE ARG 56 8.580 1.075 4.532 154 1HH1 ARG 56 1HH1 ARG 56 6.881 -1.397 6.314 155 2HH1 ARG 56 2HH1 ARG 56 7.811 -1.172 7.758 156 1HH2 ARG 56 1HH2 ARG 56 9.804 1.373 6.430 157 2HH2 ARG 56 2HH2 ARG 56 9.471 0.401 7.824 158 H PHE 57 H PHE 57 2.660 0.520 2.509 159 HA PHE 57 HA PHE 57 2.272 2.264 0.236 160 1HB PHE 57 2HB PHE 57 0.603 1.599 2.646 161 2HB PHE 57 1HB PHE 57 0.154 2.888 1.539 162 HD1 PHE 57 1HD PHE 57 -1.582 0.583 2.117 163 HD2 PHE 57 2HD PHE 57 1.433 1.061 -0.857 164 HE1 PHE 57 1HE PHE 57 -2.728 -1.050 0.683 165 HE2 PHE 57 2HE PHE 57 0.282 -0.557 -2.287 166 HZ PHE 57 HZ PHE 57 -1.800 -1.621 -1.522 167 H TYR 58 H TYR 58 2.682 4.285 0.100 168 HA TYR 58 HA TYR 58 3.410 5.829 2.496 169 1HB TYR 58 2HB TYR 58 4.404 6.338 -0.295 170 2HB TYR 58 1HB TYR 58 4.947 7.105 1.178 171 HD1 TYR 58 1HD TYR 58 4.734 3.699 -0.355 172 HD2 TYR 58 2HD TYR 58 6.899 6.360 2.160 173 HE1 TYR 58 1HE TYR 58 6.528 2.030 -0.143 174 HE2 TYR 58 2HE TYR 58 8.698 4.698 2.379 175 HH TYR 58 HH TYR 58 8.923 1.959 0.389 176 H ARG 59 H ARG 59 2.668 7.934 2.615 177 HA ARG 59 HA ARG 59 0.367 8.487 0.894 178 1HB ARG 59 2HB ARG 59 -0.126 10.271 2.618 179 2HB ARG 59 1HB ARG 59 -0.203 8.614 3.200 180 1HG ARG 59 2HG ARG 59 1.933 8.824 4.264 181 2HG ARG 59 1HG ARG 59 2.180 10.418 3.549 182 1HD ARG 59 2HD ARG 59 -0.248 9.960 5.211 183 2HD ARG 59 1HD ARG 59 1.307 10.135 6.024 184 HE ARG 59 HE ARG 59 0.766 12.200 4.097 185 1HH1 ARG 59 1HH1 ARG 59 0.331 11.188 7.409 186 2HH1 ARG 59 2HH1 ARG 59 0.112 12.799 8.003 187 1HH2 ARG 59 1HH2 ARG 59 0.477 14.320 4.875 188 2HH2 ARG 59 2HH2 ARG 59 0.193 14.579 6.565 189 H ASN 60 H ASN 60 0.659 9.739 -0.780 190 HA ASN 60 HA ASN 60 2.822 10.987 -1.701 191 1HB ASN 60 2HB ASN 60 0.751 10.860 -2.962 192 2HB ASN 60 1HB ASN 60 0.001 12.045 -1.901 193 1HD2 ASN 60 1HD2 ASN 60 -0.210 12.713 -4.363 194 2HD2 ASN 60 2HD2 ASN 60 0.936 13.909 -4.852 195 H GLY 61 H GLY 61 4.154 12.541 -1.131 196 1HA GLY 61 2HA GLY 61 5.028 14.391 -0.100 197 2HA GLY 61 1HA GLY 61 3.396 15.045 -0.097 198 H ASP 62 H ASP 62 5.870 13.513 1.738 199 HA ASP 62 HA ASP 62 4.380 14.060 4.181 200 1HB ASP 62 2HB ASP 62 4.301 11.517 3.252 201 2HB ASP 62 1HB ASP 62 5.787 11.454 4.196 202 H ARG 63 H ARG 63 7.373 12.449 3.105 203 HA ARG 63 HA ARG 63 9.559 12.809 3.607 204 1HB ARG 63 2HB ARG 63 8.316 15.475 3.762 205 2HB ARG 63 1HB ARG 63 9.855 15.325 4.601 206 1HG ARG 63 2HG ARG 63 9.353 14.656 1.712 207 2HG ARG 63 1HG ARG 63 10.137 16.118 2.314 208 1HD ARG 63 2HD ARG 63 11.804 14.568 3.444 209 2HD ARG 63 1HD ARG 63 11.115 13.282 2.453 210 HE ARG 63 HE ARG 63 12.331 14.080 0.703 211 1HH1 ARG 63 1HH1 ARG 63 11.914 16.674 3.002 212 2HH1 ARG 63 2HH1 ARG 63 12.895 17.787 2.112 213 1HH2 ARG 63 1HH2 ARG 63 13.624 15.543 -0.467 214 2HH2 ARG 63 2HH2 ARG 63 13.866 17.147 0.142 215 H TYR 64 H TYR 64 7.372 12.238 5.808 216 HA TYR 64 HA TYR 64 9.295 12.082 7.957 217 1HB TYR 64 2HB TYR 64 7.148 14.079 7.885 218 2HB TYR 64 1HB TYR 64 7.163 13.102 9.346 219 HD1 TYR 64 1HD TYR 64 9.199 15.373 7.257 220 HD2 TYR 64 2HD TYR 64 8.799 13.456 11.033 221 HE1 TYR 64 1HE TYR 64 11.013 16.768 8.149 222 HE2 TYR 64 2HE TYR 64 10.611 14.850 11.940 223 HH TYR 64 HH TYR 64 12.609 16.113 10.999 224 H PHE 65 H PHE 65 7.899 10.183 6.335 225 HA PHE 65 HA PHE 65 6.860 8.495 8.407 226 1HB PHE 65 2HB PHE 65 4.876 9.890 7.830 227 2HB PHE 65 1HB PHE 65 4.982 9.297 6.176 228 HD1 PHE 65 1HD PHE 65 3.163 7.944 5.795 229 HD2 PHE 65 2HD PHE 65 5.305 7.547 9.450 230 HE1 PHE 65 1HE PHE 65 1.769 6.009 6.396 231 HE2 PHE 65 2HE PHE 65 3.914 5.610 10.060 232 HZ PHE 65 HZ PHE 65 2.143 4.839 8.532 233 H LYS 66 H LYS 66 7.336 6.438 7.954 234 HA LYS 66 HA LYS 66 8.609 5.799 5.464 235 1HB LYS 66 2HB LYS 66 7.923 4.122 7.879 236 2HB LYS 66 1HB LYS 66 8.796 3.507 6.483 237 1HG LYS 66 2HG LYS 66 10.064 5.900 7.357 238 2HG LYS 66 1HG LYS 66 9.820 4.845 8.751 239 1HD LYS 66 2HD LYS 66 10.740 3.008 7.108 240 2HD LYS 66 1HD LYS 66 11.446 4.404 6.290 241 1HE LYS 66 2HE LYS 66 13.122 3.801 7.762 242 2HE LYS 66 1HE LYS 66 12.270 5.055 8.662 243 1HZ LYS 66 1HZ LYS 66 11.330 2.331 9.052 244 2HZ LYS 66 2HZ LYS 66 11.518 3.582 10.173 245 3HZ LYS 66 3HZ LYS 66 12.862 2.682 9.681 246 H GLY 67 H GLY 67 5.462 5.274 6.892 247 1HA GLY 67 2HA GLY 67 3.607 4.991 5.317 248 2HA GLY 67 1HA GLY 67 4.647 3.916 4.398 249 H ILE 68 H ILE 68 2.410 2.769 4.797 250 HA ILE 68 HA ILE 68 2.775 1.027 7.146 251 HB ILE 68 HB ILE 68 0.807 2.374 7.523 252 1HG1 ILE 68 2HG1 ILE 68 -0.400 -0.211 6.635 253 2HG1 ILE 68 1HG1 ILE 68 0.873 -0.250 7.851 254 1HG2 ILE 68 1HG2 ILE 68 -0.803 1.353 5.311 255 2HG2 ILE 68 2HG2 ILE 68 0.512 2.415 4.809 256 3HG2 ILE 68 3HG2 ILE 68 -0.685 2.985 5.974 257 1HD1 ILE 68 1HD1 ILE 68 -1.811 0.095 8.315 258 2HD1 ILE 68 2HD1 ILE 68 -1.164 1.732 8.436 259 3HD1 ILE 68 3HD1 ILE 68 -0.505 0.446 9.448 260 H VAL 69 H VAL 69 2.651 -1.148 6.829 261 HA VAL 69 HA VAL 69 2.776 -2.059 4.078 262 HB VAL 69 HB VAL 69 3.045 -3.713 6.590 263 1HG1 VAL 69 1HG1 VAL 69 2.586 -4.917 4.454 264 2HG1 VAL 69 2HG1 VAL 69 4.132 -5.331 5.196 265 3HG1 VAL 69 3HG1 VAL 69 4.083 -4.243 3.809 266 1HG2 VAL 69 1HG2 VAL 69 5.480 -3.003 5.123 267 2HG2 VAL 69 2HG2 VAL 69 5.175 -3.060 6.859 268 3HG2 VAL 69 3HG2 VAL 69 4.691 -1.646 5.924 269 H TYR 70 H TYR 70 1.271 -3.209 3.024 270 HA TYR 70 HA TYR 70 -0.985 -4.317 4.499 271 1HB TYR 70 2HB TYR 70 -1.078 -2.061 2.658 272 2HB TYR 70 1HB TYR 70 -2.134 -3.373 2.151 273 HD1 TYR 70 1HD TYR 70 -4.305 -3.199 2.841 274 HD2 TYR 70 2HD TYR 70 -1.243 -1.675 5.372 275 HE1 TYR 70 1HE TYR 70 -6.009 -2.486 4.466 276 HE2 TYR 70 2HE TYR 70 -2.938 -0.959 7.003 277 HH TYR 70 HH TYR 70 -6.128 -2.011 6.919 278 H ALA 71 H ALA 71 -1.919 -6.074 3.593 279 HA ALA 71 HA ALA 71 -0.444 -7.325 1.385 280 1HB ALA 71 1HB ALA 71 -2.214 -8.584 3.478 281 2HB ALA 71 2HB ALA 71 -0.452 -8.627 3.435 282 3HB ALA 71 3HB ALA 71 -1.384 -9.447 2.183 283 H VAL 72 H VAL 72 -1.389 -7.174 -0.518 284 HA VAL 72 HA VAL 72 -4.267 -6.789 -0.677 285 HB VAL 72 HB VAL 72 -2.503 -6.619 -3.080 286 1HG1 VAL 72 1HG1 VAL 72 -4.181 -5.327 -3.951 287 2HG1 VAL 72 2HG1 VAL 72 -4.674 -4.709 -2.376 288 3HG1 VAL 72 3HG1 VAL 72 -5.116 -6.346 -2.859 289 1HG2 VAL 72 1HG2 VAL 72 -2.396 -4.081 -2.365 290 2HG2 VAL 72 2HG2 VAL 72 -1.176 -5.233 -1.826 291 3HG2 VAL 72 3HG2 VAL 72 -2.491 -4.772 -0.745 292 H SER 73 H SER 73 -5.513 -8.369 -1.136 293 HA SER 73 HA SER 73 -4.832 -10.370 -3.108 294 1HB SER 73 2HB SER 73 -4.916 -12.275 -1.740 295 2HB SER 73 1HB SER 73 -3.960 -11.138 -0.792 296 HG SER 73 HG SER 73 -5.800 -12.321 0.257 297 H SER 74 H SER 74 -6.673 -11.776 -3.626 298 HA SER 74 HA SER 74 -9.074 -10.284 -3.817 299 1HB SER 74 2HB SER 74 -8.027 -12.312 -5.253 300 2HB SER 74 1HB SER 74 -9.197 -13.208 -4.284 301 HG SER 74 HG SER 74 -9.753 -10.938 -5.897 302 H ASP 75 H ASP 75 -7.863 -12.177 -1.293 303 HA ASP 75 HA ASP 75 -10.394 -13.143 -0.335 304 1HB ASP 75 2HB ASP 75 -7.575 -13.501 0.283 305 2HB ASP 75 1HB ASP 75 -8.550 -13.327 1.731 306 H ARG 76 H ARG 76 -8.147 -10.527 0.436 307 HA ARG 76 HA ARG 76 -9.909 -9.580 2.561 308 1HB ARG 76 2HB ARG 76 -7.219 -8.558 1.636 309 2HB ARG 76 1HB ARG 76 -8.114 -7.949 3.021 310 1HG ARG 76 2HG ARG 76 -7.813 -9.948 4.226 311 2HG ARG 76 1HG ARG 76 -7.274 -10.821 2.791 312 1HD ARG 76 2HD ARG 76 -5.477 -8.769 2.913 313 2HD ARG 76 1HD ARG 76 -5.778 -9.092 4.621 314 HE ARG 76 HE ARG 76 -4.238 -10.671 2.868 315 1HH1 ARG 76 1HH1 ARG 76 -6.580 -10.980 5.435 316 2HH1 ARG 76 2HH1 ARG 76 -5.999 -12.529 5.948 317 1HH2 ARG 76 1HH2 ARG 76 -3.474 -12.708 3.539 318 2HH2 ARG 76 2HH2 ARG 76 -4.235 -13.510 4.871 319 H PHE 77 H PHE 77 -8.680 -8.590 -0.595 320 HA PHE 77 HA PHE 77 -10.760 -6.509 -0.665 321 1HB PHE 77 2HB PHE 77 -8.063 -6.202 -1.978 322 2HB PHE 77 1HB PHE 77 -9.298 -4.970 -1.738 323 HD1 PHE 77 1HD PHE 77 -9.911 -4.463 0.747 324 HD2 PHE 77 2HD PHE 77 -6.298 -6.330 -0.503 325 HE1 PHE 77 1HE PHE 77 -8.843 -3.804 2.863 326 HE2 PHE 77 2HE PHE 77 -5.223 -5.673 1.611 327 HZ PHE 77 HZ PHE 77 -6.496 -4.408 3.297 328 H ARG 78 H ARG 78 -12.185 -6.925 -2.193 329 HA ARG 78 HA ARG 78 -11.827 -8.886 -4.180 330 1HB ARG 78 2HB ARG 78 -13.910 -7.090 -3.239 331 2HB ARG 78 1HB ARG 78 -13.951 -7.295 -4.977 332 1HG ARG 78 2HG ARG 78 -14.372 -9.573 -4.828 333 2HG ARG 78 1HG ARG 78 -13.776 -9.665 -3.170 334 1HD ARG 78 2HD ARG 78 -15.856 -9.423 -2.435 335 2HD ARG 78 1HD ARG 78 -15.909 -7.823 -3.174 336 HE ARG 78 HE ARG 78 -17.351 -8.684 -4.704 337 1HH1 ARG 78 1HH1 ARG 78 -15.376 -11.300 -3.504 338 2HH1 ARG 78 2HH1 ARG 78 -16.193 -12.509 -4.437 339 1HH2 ARG 78 1HH2 ARG 78 -18.423 -10.273 -5.932 340 2HH2 ARG 78 2HH2 ARG 78 -17.922 -11.927 -5.816 341 H SER 79 H SER 79 -11.274 -5.451 -4.089 342 HA SER 79 HA SER 79 -9.902 -5.542 -6.606 343 1HB SER 79 2HB SER 79 -12.624 -4.317 -6.417 344 2HB SER 79 1HB SER 79 -11.419 -3.560 -7.459 345 HG SER 79 HG SER 79 -11.349 -5.347 -8.703 346 H PHE 80 H PHE 80 -9.423 -3.107 -7.286 347 HA PHE 80 HA PHE 80 -7.795 -2.038 -5.279 348 1HB PHE 80 2HB PHE 80 -8.059 -1.661 -7.980 349 2HB PHE 80 1HB PHE 80 -8.636 -0.125 -7.343 350 HD1 PHE 80 1HD PHE 80 -6.993 1.464 -7.563 351 HD2 PHE 80 2HD PHE 80 -5.920 -2.447 -6.283 352 HE1 PHE 80 1HE PHE 80 -4.670 2.209 -7.256 353 HE2 PHE 80 2HE PHE 80 -3.596 -1.711 -5.968 354 HZ PHE 80 HZ PHE 80 -2.966 0.618 -6.455 355 H ASP 81 H ASP 81 -11.097 -1.299 -6.206 356 HA ASP 81 HA ASP 81 -11.371 1.153 -4.866 357 1HB ASP 81 2HB ASP 81 -13.293 -0.970 -5.755 358 2HB ASP 81 1HB ASP 81 -13.866 0.352 -4.743 359 H ALA 82 H ALA 82 -11.892 -2.173 -3.798 360 HA ALA 82 HA ALA 82 -12.808 -1.504 -1.196 361 1HB ALA 82 1HB ALA 82 -11.704 -4.029 -1.017 362 2HB ALA 82 2HB ALA 82 -12.212 -3.895 -2.702 363 3HB ALA 82 3HB ALA 82 -13.379 -3.637 -1.404 364 H LEU 83 H LEU 83 -9.648 -2.181 -2.588 365 HA LEU 83 HA LEU 83 -8.210 -2.366 -0.161 366 1HB LEU 83 2HB LEU 83 -7.351 -3.074 -2.387 367 2HB LEU 83 1HB LEU 83 -7.252 -1.392 -2.857 368 HG LEU 83 HG LEU 83 -5.592 -1.005 -1.065 369 1HD1 LEU 83 1HD1 LEU 83 -5.472 -3.987 -0.744 370 2HD1 LEU 83 2HD1 LEU 83 -6.417 -2.956 0.330 371 3HD1 LEU 83 3HD1 LEU 83 -4.671 -2.746 0.217 372 1HD2 LEU 83 1HD2 LEU 83 -4.415 -1.287 -2.970 373 2HD2 LEU 83 2HD2 LEU 83 -5.194 -2.822 -3.354 374 3HD2 LEU 83 3HD2 LEU 83 -3.891 -2.767 -2.167 375 H LEU 84 H LEU 84 -8.891 0.257 -2.396 376 HA LEU 84 HA LEU 84 -7.521 2.299 -1.063 377 1HB LEU 84 2HB LEU 84 -9.829 2.230 -2.967 378 2HB LEU 84 1HB LEU 84 -9.389 3.747 -2.202 379 HG LEU 84 HG LEU 84 -7.423 2.082 -3.764 380 1HD1 LEU 84 1HD1 LEU 84 -7.855 4.028 -5.461 381 2HD1 LEU 84 2HD1 LEU 84 -9.437 4.076 -4.681 382 3HD1 LEU 84 3HD1 LEU 84 -8.882 2.593 -5.457 383 1HD2 LEU 84 1HD2 LEU 84 -6.370 3.623 -2.266 384 2HD2 LEU 84 2HD2 LEU 84 -7.444 4.927 -2.773 385 3HD2 LEU 84 3HD2 LEU 84 -6.251 4.281 -3.899 386 H ALA 85 H ALA 85 -10.700 0.864 -0.538 387 HA ALA 85 HA ALA 85 -11.705 2.864 1.210 388 1HB ALA 85 1HB ALA 85 -12.335 -0.083 1.249 389 2HB ALA 85 2HB ALA 85 -13.060 1.072 0.129 390 3HB ALA 85 3HB ALA 85 -13.339 1.230 1.864 391 H ASP 86 H ASP 86 -9.944 -0.157 1.775 392 HA ASP 86 HA ASP 86 -9.829 0.162 4.610 393 1HB ASP 86 2HB ASP 86 -9.124 -1.844 2.706 394 2HB ASP 86 1HB ASP 86 -7.700 -1.503 3.683 395 H LEU 87 H LEU 87 -7.813 0.998 1.889 396 HA LEU 87 HA LEU 87 -5.463 1.677 3.278 397 1HB LEU 87 2HB LEU 87 -6.605 2.671 0.667 398 2HB LEU 87 1HB LEU 87 -5.034 3.164 1.256 399 HG LEU 87 HG LEU 87 -5.823 0.733 -0.135 400 1HD1 LEU 87 1HD1 LEU 87 -3.086 1.796 0.500 401 2HD1 LEU 87 2HD1 LEU 87 -4.099 2.422 -0.801 402 3HD1 LEU 87 3HD1 LEU 87 -3.559 0.743 -0.833 403 1HD2 LEU 87 1HD2 LEU 87 -3.913 0.347 2.155 404 2HD2 LEU 87 2HD2 LEU 87 -4.561 -0.869 1.054 405 3HD2 LEU 87 3HD2 LEU 87 -5.614 -0.110 2.244 406 H THR 88 H THR 88 -8.259 3.627 2.327 407 HA THR 88 HA THR 88 -7.322 6.078 3.298 408 HB THR 88 HB THR 88 -10.054 4.918 2.804 409 HG1 THR 88 1HG THR 88 -9.343 5.583 0.932 410 1HG2 THR 88 1HG2 THR 88 -11.073 7.074 3.146 411 2HG2 THR 88 2HG2 THR 88 -9.538 7.732 3.717 412 3HG2 THR 88 3HG2 THR 88 -10.362 6.478 4.645 413 H ARG 89 H ARG 89 -8.981 3.385 4.809 414 HA ARG 89 HA ARG 89 -9.448 4.630 7.314 415 1HB ARG 89 2HB ARG 89 -10.346 2.370 6.161 416 2HB ARG 89 1HB ARG 89 -9.116 1.690 7.217 417 1HG ARG 89 2HG ARG 89 -11.292 1.689 8.291 418 2HG ARG 89 1HG ARG 89 -10.171 2.752 9.142 419 1HD ARG 89 2HD ARG 89 -11.248 4.667 8.449 420 2HD ARG 89 1HD ARG 89 -11.938 3.889 7.026 421 HE ARG 89 HE ARG 89 -13.733 3.235 8.291 422 1HH1 ARG 89 1HH1 ARG 89 -11.175 4.295 10.413 423 2HH1 ARG 89 2HH1 ARG 89 -12.165 4.254 11.833 424 1HH2 ARG 89 1HH2 ARG 89 -15.038 3.178 10.156 425 2HH2 ARG 89 2HH2 ARG 89 -14.358 3.618 11.687 426 H SER 90 H SER 90 -6.872 2.433 6.150 427 HA SER 90 HA SER 90 -5.544 2.429 8.694 428 1HB SER 90 2HB SER 90 -5.405 0.896 6.359 429 2HB SER 90 1HB SER 90 -3.827 1.675 6.487 430 HG SER 90 HG SER 90 -3.895 0.914 8.753 431 H LEU 91 H LEU 91 -5.085 4.164 5.654 432 HA LEU 91 HA LEU 91 -2.758 5.514 6.737 433 1HB LEU 91 2HB LEU 91 -3.850 4.929 4.088 434 2HB LEU 91 1HB LEU 91 -3.190 6.535 4.240 435 HG LEU 91 HG LEU 91 -1.772 3.908 4.579 436 1HD1 LEU 91 1HD1 LEU 91 -1.575 4.396 2.375 437 2HD1 LEU 91 2HD1 LEU 91 -0.209 5.330 2.983 438 3HD1 LEU 91 3HD1 LEU 91 -1.738 6.133 2.628 439 1HD2 LEU 91 1HD2 LEU 91 -0.825 5.033 6.352 440 2HD2 LEU 91 2HD2 LEU 91 -1.001 6.612 5.584 441 3HD2 LEU 91 3HD2 LEU 91 0.241 5.492 5.023 442 H SER 92 H SER 92 -6.010 5.962 6.894 443 HA SER 92 HA SER 92 -6.830 8.379 6.159 444 1HB SER 92 2HB SER 92 -7.788 8.535 8.651 445 2HB SER 92 1HB SER 92 -8.416 7.385 7.472 446 HG SER 92 HG SER 92 -6.770 6.954 9.691 447 H ASP 93 H ASP 93 -6.463 10.471 6.473 448 HA ASP 93 HA ASP 93 -4.914 11.444 8.718 449 1HB ASP 93 2HB ASP 93 -3.939 11.829 5.873 450 2HB ASP 93 1HB ASP 93 -3.244 12.586 7.303 451 H ASN 94 H ASN 94 -4.363 14.003 7.366 452 HA ASN 94 HA ASN 94 -6.815 15.026 6.332 453 1HB ASN 94 2HB ASN 94 -7.252 16.604 8.222 454 2HB ASN 94 1HB ASN 94 -7.555 14.914 8.617 455 1HD2 ASN 94 1HD2 ASN 94 -7.383 15.938 10.806 456 2HD2 ASN 94 2HD2 ASN 94 -5.818 15.975 11.535 457 H ILE 95 H ILE 95 -3.956 14.991 5.734 458 HA ILE 95 HA ILE 95 -3.504 17.889 5.587 459 HB ILE 95 HB ILE 95 -1.552 15.681 6.188 460 1HG1 ILE 95 2HG1 ILE 95 -2.543 16.776 8.107 461 2HG1 ILE 95 1HG1 ILE 95 -0.857 17.262 7.976 462 1HG2 ILE 95 1HG2 ILE 95 0.258 17.369 5.873 463 2HG2 ILE 95 2HG2 ILE 95 -0.929 18.405 5.077 464 3HG2 ILE 95 3HG2 ILE 95 -0.523 16.834 4.385 465 1HD1 ILE 95 1HD1 ILE 95 -3.318 18.857 7.380 466 2HD1 ILE 95 2HD1 ILE 95 -1.734 19.324 6.759 467 3HD1 ILE 95 3HD1 ILE 95 -2.003 19.219 8.499 468 H ASN 96 H ASN 96 -2.182 14.882 4.192 469 HA ASN 96 HA ASN 96 -2.142 16.153 1.562 470 1HB ASN 96 2HB ASN 96 -0.631 14.005 2.874 471 2HB ASN 96 1HB ASN 96 -1.069 13.651 1.206 472 1HD2 ASN 96 1HD2 ASN 96 0.726 15.742 3.319 473 2HD2 ASN 96 2HD2 ASN 96 1.698 16.480 2.096 474 H LEU 97 H LEU 97 -3.956 13.879 3.384 475 HA LEU 97 HA LEU 97 -5.318 12.955 0.941 476 1HB LEU 97 2HB LEU 97 -5.108 11.661 3.659 477 2HB LEU 97 1HB LEU 97 -6.135 11.069 2.366 478 HG LEU 97 HG LEU 97 -3.188 11.392 1.922 479 1HD1 LEU 97 1HD1 LEU 97 -3.008 8.958 2.542 480 2HD1 LEU 97 2HD1 LEU 97 -4.585 9.122 3.317 481 3HD1 LEU 97 3HD1 LEU 97 -3.217 10.076 3.890 482 1HD2 LEU 97 1HD2 LEU 97 -5.164 10.788 0.215 483 2HD2 LEU 97 2HD2 LEU 97 -4.779 9.171 0.803 484 3HD2 LEU 97 3HD2 LEU 97 -3.524 10.160 0.057 485 HA PRO 98 HA PRO 98 -8.156 16.115 2.876 486 1HB PRO 98 2HB PRO 98 -9.248 15.537 0.144 487 2HB PRO 98 1HB PRO 98 -9.156 17.066 1.013 488 1HG PRO 98 2HG PRO 98 -7.401 16.512 -0.891 489 2HG PRO 98 1HG PRO 98 -6.879 17.313 0.604 490 1HD PRO 98 2HD PRO 98 -6.479 14.497 -0.276 491 2HD PRO 98 1HD PRO 98 -5.439 15.529 0.725 492 H GLN 99 H GLN 99 -9.650 13.856 0.572 493 HA GLN 99 HA GLN 99 -11.587 13.143 2.656 494 1HB GLN 99 2HB GLN 99 -11.945 12.335 -0.195 495 2HB GLN 99 1HB GLN 99 -13.155 12.744 1.009 496 1HG GLN 99 2HG GLN 99 -12.909 15.019 0.676 497 2HG GLN 99 1HG GLN 99 -11.306 14.846 -0.035 498 1HE2 GLN 99 1HE2 GLN 99 -11.567 13.094 -1.987 499 2HE2 GLN 99 2HE2 GLN 99 -12.718 13.607 -3.167 500 H GLY 100 H GLY 100 -8.819 11.933 2.268 501 1HA GLY 100 2HA GLY 100 -8.201 9.791 3.003 502 2HA GLY 100 1HA GLY 100 -9.741 9.178 2.417 503 H VAL 101 H VAL 101 -7.597 7.769 1.846 504 HA VAL 101 HA VAL 101 -6.250 8.419 -0.559 505 HB VAL 101 HB VAL 101 -6.769 5.657 0.555 506 1HG1 VAL 101 1HG1 VAL 101 -4.453 6.587 -1.124 507 2HG1 VAL 101 2HG1 VAL 101 -5.917 5.888 -1.814 508 3HG1 VAL 101 3HG1 VAL 101 -4.915 4.933 -0.721 509 1HG2 VAL 101 1HG2 VAL 101 -5.033 5.881 2.021 510 2HG2 VAL 101 2HG2 VAL 101 -5.624 7.542 2.017 511 3HG2 VAL 101 3HG2 VAL 101 -4.220 7.104 1.045 512 H ARG 102 H ARG 102 -7.200 8.689 -2.444 513 HA ARG 102 HA ARG 102 -9.562 7.090 -3.113 514 1HB ARG 102 2HB ARG 102 -8.747 9.821 -3.652 515 2HB ARG 102 1HB ARG 102 -9.221 8.982 -5.119 516 1HG ARG 102 2HG ARG 102 -10.884 9.206 -2.626 517 2HG ARG 102 1HG ARG 102 -11.090 10.164 -4.094 518 1HD ARG 102 2HD ARG 102 -11.747 7.318 -3.567 519 2HD ARG 102 1HD ARG 102 -12.633 8.532 -4.483 520 HE ARG 102 HE ARG 102 -10.152 7.380 -5.591 521 1HH1 ARG 102 1HH1 ARG 102 -13.621 7.844 -5.778 522 2HH1 ARG 102 2HH1 ARG 102 -13.729 7.251 -7.398 523 1HH2 ARG 102 1HH2 ARG 102 -10.315 6.597 -7.714 524 2HH2 ARG 102 2HH2 ARG 102 -11.859 6.543 -8.496 525 H TYR 103 H TYR 103 -6.294 7.788 -4.141 526 HA TYR 103 HA TYR 103 -6.535 5.575 -6.039 527 1HB TYR 103 2HB TYR 103 -5.026 8.037 -6.863 528 2HB TYR 103 1HB TYR 103 -5.594 6.699 -7.839 529 HD1 TYR 103 1HD TYR 103 -7.655 6.757 -8.918 530 HD2 TYR 103 2HD TYR 103 -6.747 9.683 -5.969 531 HE1 TYR 103 1HE TYR 103 -9.632 8.037 -9.597 532 HE2 TYR 103 2HE TYR 103 -8.735 10.974 -6.633 533 HH TYR 103 HH TYR 103 -10.507 10.280 -9.486 534 H ILE 104 H ILE 104 -4.472 4.744 -6.779 535 HA ILE 104 HA ILE 104 -2.312 5.183 -4.826 536 HB ILE 104 HB ILE 104 -3.079 2.567 -6.130 537 1HG1 ILE 104 2HG1 ILE 104 -3.478 3.673 -3.354 538 2HG1 ILE 104 1HG1 ILE 104 -4.690 3.021 -4.451 539 1HG2 ILE 104 1HG2 ILE 104 -1.326 1.548 -4.895 540 2HG2 ILE 104 2HG2 ILE 104 -1.010 3.031 -3.994 541 3HG2 ILE 104 3HG2 ILE 104 -0.628 2.944 -5.713 542 1HD1 ILE 104 1HD1 ILE 104 -4.381 1.403 -2.774 543 2HD1 ILE 104 2HD1 ILE 104 -2.624 1.528 -2.869 544 3HD1 ILE 104 3HD1 ILE 104 -3.529 0.791 -4.192 545 H TYR 105 H TYR 105 -0.532 5.933 -5.738 546 HA TYR 105 HA TYR 105 -0.129 5.554 -8.606 547 1HB TYR 105 2HB TYR 105 0.220 7.787 -6.789 548 2HB TYR 105 1HB TYR 105 1.660 7.494 -7.765 549 HD1 TYR 105 1HD TYR 105 1.432 7.364 -10.240 550 HD2 TYR 105 2HD TYR 105 -1.685 8.790 -7.738 551 HE1 TYR 105 1HE TYR 105 0.379 8.410 -12.173 552 HE2 TYR 105 2HE TYR 105 -2.756 9.852 -9.661 553 HH TYR 105 HH TYR 105 -1.769 9.229 -12.899 554 H THR 106 H THR 106 2.117 5.508 -9.374 555 HA THR 106 HA THR 106 3.532 3.394 -8.060 556 HB THR 106 HB THR 106 5.305 4.092 -9.881 557 HG1 THR 106 1HG THR 106 4.683 5.574 -11.222 558 1HG2 THR 106 1HG2 THR 106 3.463 2.188 -9.870 559 2HG2 THR 106 2HG2 THR 106 4.438 2.556 -11.293 560 3HG2 THR 106 3HG2 THR 106 2.798 3.190 -11.160 561 H ILE 107 H ILE 107 5.724 3.469 -7.295 562 HA ILE 107 HA ILE 107 6.252 5.300 -5.344 563 HB ILE 107 HB ILE 107 7.463 3.151 -5.668 564 1HG1 ILE 107 2HG1 ILE 107 9.744 4.127 -4.978 565 2HG1 ILE 107 1HG1 ILE 107 8.980 5.703 -5.158 566 1HG2 ILE 107 1HG2 ILE 107 9.117 4.706 -7.653 567 2HG2 ILE 107 2HG2 ILE 107 7.963 3.436 -8.062 568 3HG2 ILE 107 3HG2 ILE 107 9.399 3.051 -7.114 569 1HD1 ILE 107 1HD1 ILE 107 8.883 3.900 -2.958 570 2HD1 ILE 107 2HD1 ILE 107 7.251 4.131 -3.586 571 3HD1 ILE 107 3HD1 ILE 107 8.213 5.525 -3.094 572 H ASP 108 H ASP 108 6.812 5.669 -8.757 573 HA ASP 108 HA ASP 108 8.393 8.090 -8.334 574 1HB ASP 108 2HB ASP 108 8.577 6.111 -10.227 575 2HB ASP 108 1HB ASP 108 7.709 7.371 -11.098 576 H GLY 109 H GLY 109 5.187 7.084 -9.127 577 1HA GLY 109 2HA GLY 109 3.284 8.430 -9.118 578 2HA GLY 109 1HA GLY 109 4.317 9.851 -9.145 579 H SER 110 H SER 110 5.108 7.509 -11.492 580 HA SER 110 HA SER 110 4.544 9.261 -13.636 581 1HB SER 110 2HB SER 110 4.941 7.019 -14.973 582 2HB SER 110 1HB SER 110 6.277 7.821 -14.147 583 HG SER 110 HG SER 110 5.251 5.373 -13.723 584 H ARG 111 H ARG 111 2.944 6.296 -12.503 585 HA ARG 111 HA ARG 111 0.482 7.196 -13.746 586 1HB ARG 111 2HB ARG 111 0.205 4.680 -14.481 587 2HB ARG 111 1HB ARG 111 1.025 5.839 -15.516 588 1HG ARG 111 2HG ARG 111 2.457 4.051 -15.597 589 2HG ARG 111 1HG ARG 111 3.169 5.004 -14.294 590 1HD ARG 111 2HD ARG 111 3.099 3.083 -13.139 591 2HD ARG 111 1HD ARG 111 1.390 3.465 -12.928 592 HE ARG 111 HE ARG 111 0.925 1.619 -14.167 593 1HH1 ARG 111 1HH1 ARG 111 4.094 2.756 -15.088 594 2HH1 ARG 111 2HH1 ARG 111 4.366 1.467 -16.212 595 1HH2 ARG 111 1HH2 ARG 111 1.283 -0.076 -15.645 596 2HH2 ARG 111 2HH2 ARG 111 2.772 -0.141 -16.528 597 H LYS 112 H LYS 112 -1.364 6.334 -12.836 598 HA LYS 112 HA LYS 112 -0.986 5.258 -10.158 599 1HB LYS 112 2HB LYS 112 -2.654 6.622 -9.587 600 2HB LYS 112 1HB LYS 112 -2.735 7.185 -11.246 601 1HG LYS 112 2HG LYS 112 -4.301 5.240 -11.685 602 2HG LYS 112 1HG LYS 112 -4.362 5.026 -9.934 603 1HD LYS 112 2HD LYS 112 -6.243 6.382 -10.756 604 2HD LYS 112 1HD LYS 112 -5.199 7.296 -9.666 605 1HE LYS 112 2HE LYS 112 -4.396 8.643 -11.333 606 2HE LYS 112 1HE LYS 112 -4.640 7.424 -12.582 607 1HZ LYS 112 1HZ LYS 112 -6.848 8.883 -11.237 608 2HZ LYS 112 2HZ LYS 112 -6.973 7.854 -12.573 609 3HZ LYS 112 3HZ LYS 112 -6.180 9.340 -12.723 610 H ILE 113 H ILE 113 -1.839 3.353 -9.443 611 HA ILE 113 HA ILE 113 -2.367 1.363 -11.458 612 HB ILE 113 HB ILE 113 -2.343 1.119 -8.448 613 1HG1 ILE 113 2HG1 ILE 113 -0.194 1.856 -9.645 614 2HG1 ILE 113 1HG1 ILE 113 -0.093 0.462 -8.576 615 1HG2 ILE 113 1HG2 ILE 113 -1.741 -1.340 -9.319 616 2HG2 ILE 113 2HG2 ILE 113 -2.804 -0.816 -10.626 617 3HG2 ILE 113 3HG2 ILE 113 -3.387 -0.814 -8.961 618 1HD1 ILE 113 1HD1 ILE 113 0.756 0.624 -11.208 619 2HD1 ILE 113 2HD1 ILE 113 -0.717 -0.345 -11.267 620 3HD1 ILE 113 3HD1 ILE 113 0.618 -0.834 -10.222 621 H GLY 114 H GLY 114 -4.251 0.294 -11.835 622 1HA GLY 114 2HA GLY 114 -6.639 1.287 -10.404 623 2HA GLY 114 1HA GLY 114 -6.629 0.930 -12.125 624 H SER 115 H SER 115 -4.904 -1.483 -11.586 625 HA SER 115 HA SER 115 -7.003 -3.213 -10.462 626 1HB SER 115 2HB SER 115 -5.974 -4.955 -12.108 627 2HB SER 115 1HB SER 115 -7.090 -3.741 -12.733 628 HG SER 115 HG SER 115 -5.106 -4.015 -13.958 629 H MET 116 H MET 116 -6.349 -5.054 -9.349 630 HA MET 116 HA MET 116 -4.082 -4.776 -7.718 631 1HB MET 116 2HB MET 116 -6.385 -6.274 -7.655 632 2HB MET 116 1HB MET 116 -5.153 -7.497 -7.933 633 1HG MET 116 2HG MET 116 -4.017 -6.943 -5.941 634 2HG MET 116 1HG MET 116 -4.954 -5.464 -5.737 635 1HE MET 116 1HE MET 116 -8.270 -6.486 -4.353 636 2HE MET 116 2HE MET 116 -7.440 -5.403 -5.469 637 3HE MET 116 3HE MET 116 -6.909 -5.515 -3.792 638 H ASP 117 H ASP 117 -4.577 -6.348 -10.772 639 HA ASP 117 HA ASP 117 -2.508 -8.202 -10.752 640 1HB ASP 117 2HB ASP 117 -4.284 -6.962 -12.685 641 2HB ASP 117 1HB ASP 117 -2.700 -7.288 -13.364 642 H GLU 118 H GLU 118 -2.391 -4.764 -10.874 643 HA GLU 118 HA GLU 118 0.252 -4.706 -12.081 644 1HB GLU 118 2HB GLU 118 -1.412 -2.468 -10.919 645 2HB GLU 118 1HB GLU 118 0.082 -2.272 -11.827 646 1HG GLU 118 2HG GLU 118 -1.282 -3.664 -13.626 647 2HG GLU 118 1HG GLU 118 -2.643 -2.943 -12.768 648 H LEU 119 H LEU 119 -1.062 -5.056 -8.970 649 HA LEU 119 HA LEU 119 1.125 -3.811 -7.556 650 1HB LEU 119 2HB LEU 119 -0.769 -5.712 -6.250 651 2HB LEU 119 1HB LEU 119 -0.029 -4.261 -5.606 652 HG LEU 119 HG LEU 119 -2.242 -4.297 -7.655 653 1HD1 LEU 119 1HD1 LEU 119 -2.721 -5.084 -5.241 654 2HD1 LEU 119 2HD1 LEU 119 -3.769 -3.865 -5.969 655 3HD1 LEU 119 3HD1 LEU 119 -2.519 -3.383 -4.821 656 1HD2 LEU 119 1HD2 LEU 119 -0.614 -2.351 -7.642 657 2HD2 LEU 119 2HD2 LEU 119 -1.253 -1.963 -6.046 658 3HD2 LEU 119 3HD2 LEU 119 -2.322 -1.960 -7.449 659 H GLU 120 H GLU 120 3.058 -4.750 -7.518 660 HA GLU 120 HA GLU 120 3.239 -7.673 -7.547 661 1HB GLU 120 2HB GLU 120 5.526 -5.729 -7.807 662 2HB GLU 120 1HB GLU 120 5.472 -7.414 -8.287 663 1HG GLU 120 2HG GLU 120 4.100 -6.957 -10.141 664 2HG GLU 120 1HG GLU 120 3.727 -5.335 -9.556 665 H GLU 121 H GLU 121 4.688 -8.752 -6.055 666 HA GLU 121 HA GLU 121 4.311 -8.054 -3.395 667 1HB GLU 121 2HB GLU 121 6.240 -9.894 -4.758 668 2HB GLU 121 1HB GLU 121 6.370 -9.604 -3.027 669 1HG GLU 121 2HG GLU 121 3.649 -10.183 -3.723 670 2HG GLU 121 1HG GLU 121 4.716 -11.439 -4.348 671 H GLY 122 H GLY 122 5.877 -7.490 -1.753 672 1HA GLY 122 2HA GLY 122 7.212 -5.835 -0.881 673 2HA GLY 122 1HA GLY 122 8.399 -6.542 -1.959 674 H GLU 123 H GLU 123 5.479 -4.732 -2.817 675 HA GLU 123 HA GLU 123 7.184 -2.888 -4.334 676 1HB GLU 123 2HB GLU 123 4.333 -3.746 -4.555 677 2HB GLU 123 1HB GLU 123 4.803 -2.183 -5.207 678 1HG GLU 123 2HG GLU 123 6.303 -4.665 -5.936 679 2HG GLU 123 1HG GLU 123 4.808 -4.225 -6.759 680 H SER 124 H SER 124 6.841 -0.632 -4.302 681 HA SER 124 HA SER 124 5.676 0.356 -1.782 682 1HB SER 124 2HB SER 124 7.950 1.441 -3.462 683 2HB SER 124 1HB SER 124 7.217 2.330 -2.128 684 HG SER 124 HG SER 124 8.450 -0.221 -1.939 685 H TYR 125 H TYR 125 3.909 1.595 -1.961 686 HA TYR 125 HA TYR 125 3.413 2.899 -4.551 687 1HB TYR 125 2HB TYR 125 1.529 1.378 -2.814 688 2HB TYR 125 1HB TYR 125 0.934 2.615 -3.900 689 HD1 TYR 125 1HD TYR 125 1.641 -0.809 -3.639 690 HD2 TYR 125 2HD TYR 125 1.889 2.456 -6.340 691 HE1 TYR 125 1HE TYR 125 1.719 -2.381 -5.526 692 HE2 TYR 125 2HE TYR 125 1.968 0.919 -8.223 693 HH TYR 125 HH TYR 125 1.045 -1.714 -8.503 694 H VAL 126 H VAL 126 2.034 4.698 -4.550 695 HA VAL 126 HA VAL 126 2.277 6.297 -2.073 696 HB VAL 126 HB VAL 126 2.714 7.012 -4.928 697 1HG1 VAL 126 1HG1 VAL 126 1.329 8.789 -2.961 698 2HG1 VAL 126 2HG1 VAL 126 1.020 8.568 -4.683 699 3HG1 VAL 126 3HG1 VAL 126 2.433 9.479 -4.151 700 1HG2 VAL 126 1HG2 VAL 126 3.973 8.516 -2.741 701 2HG2 VAL 126 2HG2 VAL 126 4.689 7.782 -4.177 702 3HG2 VAL 126 3HG2 VAL 126 4.324 6.787 -2.766 703 H CYS 127 H CYS 127 0.523 7.357 -1.286 704 HA CYS 127 HA CYS 127 -2.045 6.654 -2.493 705 1HB CYS 127 2HB CYS 127 -1.190 7.590 0.219 706 2HB CYS 127 1HB CYS 127 -2.866 7.791 -0.280 707 HG CYS 127 HG CYS 127 -2.825 5.101 -0.654 708 H SER 128 H SER 128 -3.270 8.051 -3.589 709 HA SER 128 HA SER 128 -2.799 10.931 -3.244 710 1HB SER 128 2HB SER 128 -3.189 9.573 -5.922 711 2HB SER 128 1HB SER 128 -2.895 11.290 -5.642 712 HG SER 128 HG SER 128 -0.861 10.815 -5.738 713 H SER 129 H SER 129 -4.593 12.249 -4.178 714 HA SER 129 HA SER 129 -7.149 10.922 -4.490 715 1HB SER 129 2HB SER 129 -7.951 12.761 -2.663 716 2HB SER 129 1HB SER 129 -7.577 11.087 -2.257 717 HG SER 129 HG SER 129 -5.845 13.325 -2.057 718 H ASP 130 H ASP 130 -5.538 14.038 -3.975 719 HA ASP 130 HA ASP 130 -6.726 15.057 -6.428 720 1HB ASP 130 2HB ASP 130 -7.540 17.113 -5.356 721 2HB ASP 130 1HB ASP 130 -8.358 15.694 -4.710 722 H ASN 131 H ASN 131 -4.687 15.740 -3.617 723 HA ASN 131 HA ASN 131 -3.210 17.867 -4.499 724 1HB ASN 131 2HB ASN 131 -1.565 17.266 -2.907 725 2HB ASN 131 1HB ASN 131 -3.082 16.653 -2.259 726 1HD2 ASN 131 1HD2 ASN 131 -3.546 14.315 -3.118 727 2HD2 ASN 131 2HD2 ASN 131 -2.224 13.215 -2.958 728 H PHE 132 H PHE 132 -0.941 17.928 -5.275 729 HA PHE 132 HA PHE 132 -0.679 16.269 -7.645 730 1HB PHE 132 2HB PHE 132 1.298 17.782 -8.102 731 2HB PHE 132 1HB PHE 132 -0.262 18.591 -8.008 732 HD1 PHE 132 1HD PHE 132 2.596 17.661 -5.799 733 HD2 PHE 132 2HD PHE 132 -0.406 20.517 -6.770 734 HE1 PHE 132 1HE PHE 132 3.496 19.181 -4.087 735 HE2 PHE 132 2HE PHE 132 0.490 22.044 -5.060 736 HZ PHE 132 HZ PHE 132 2.442 21.377 -3.716 737 H PHE 133 H PHE 133 1.662 15.550 -8.171 738 HA PHE 133 HA PHE 133 2.447 13.736 -6.103 739 1HB PHE 133 2HB PHE 133 2.545 13.220 -8.558 740 2HB PHE 133 1HB PHE 133 3.911 14.326 -8.680 741 HD1 PHE 133 1HD PHE 133 2.762 11.260 -6.925 742 HD2 PHE 133 2HD PHE 133 6.068 13.568 -8.287 743 HE1 PHE 133 1HE PHE 133 4.289 9.435 -6.298 744 HE2 PHE 133 2HE PHE 133 7.601 11.746 -7.664 745 HZ PHE 133 HZ PHE 133 6.712 9.676 -6.668 746 H LYS 134 H LYS 134 4.396 13.633 -4.988 747 HA LYS 134 HA LYS 134 6.089 16.031 -5.058 748 1HB LYS 134 2HB LYS 134 4.728 14.807 -2.675 749 2HB LYS 134 1HB LYS 134 6.232 15.697 -2.485 750 1HG LYS 134 2HG LYS 134 4.765 17.430 -3.982 751 2HG LYS 134 1HG LYS 134 3.519 16.666 -2.993 752 1HD LYS 134 2HD LYS 134 5.897 17.371 -1.466 753 2HD LYS 134 1HD LYS 134 5.142 18.768 -2.237 754 1HE LYS 134 2HE LYS 134 3.291 18.646 -0.946 755 2HE LYS 134 1HE LYS 134 3.305 16.884 -0.908 756 1HZ LYS 134 1HZ LYS 134 5.462 17.409 0.543 757 2HZ LYS 134 2HZ LYS 134 3.917 17.248 1.213 758 3HZ LYS 134 3HZ LYS 134 4.547 18.786 0.903 759 H LYS 135 H LYS 135 8.100 15.428 -5.484 760 HA LYS 135 HA LYS 135 8.929 12.694 -5.156 761 1HB LYS 135 2HB LYS 135 11.150 13.620 -6.020 762 2HB LYS 135 1HB LYS 135 9.770 13.709 -7.104 763 1HG LYS 135 2HG LYS 135 10.217 16.064 -5.390 764 2HG LYS 135 1HG LYS 135 11.430 15.759 -6.634 765 1HD LYS 135 2HD LYS 135 8.614 15.537 -7.488 766 2HD LYS 135 1HD LYS 135 9.167 17.158 -7.063 767 1HE LYS 135 2HE LYS 135 10.618 15.342 -8.979 768 2HE LYS 135 1HE LYS 135 9.425 16.539 -9.482 769 1HZ LYS 135 1HZ LYS 135 10.830 18.241 -8.382 770 2HZ LYS 135 2HZ LYS 135 11.582 17.490 -9.696 771 3HZ LYS 135 3HZ LYS 135 12.010 17.057 -8.118 772 H VAL 136 H VAL 136 9.188 12.064 -3.174 773 HA VAL 136 HA VAL 136 11.182 13.450 -1.520 774 HB VAL 136 HB VAL 136 9.565 13.890 -0.023 775 1HG1 VAL 136 1HG1 VAL 136 7.279 13.106 -0.206 776 2HG1 VAL 136 2HG1 VAL 136 7.775 11.906 -1.403 777 3HG1 VAL 136 3HG1 VAL 136 7.883 13.626 -1.781 778 1HG2 VAL 136 1HG2 VAL 136 9.400 10.894 0.236 779 2HG2 VAL 136 2HG2 VAL 136 8.746 12.052 1.395 780 3HG2 VAL 136 3HG2 VAL 136 10.485 11.965 1.121 781 H GLU 137 H GLU 137 12.145 11.914 0.137 782 HA GLU 137 HA GLU 137 12.891 9.518 -1.233 783 1HB GLU 137 2HB GLU 137 13.649 10.715 1.423 784 2HB GLU 137 1HB GLU 137 14.173 9.097 0.975 785 1HG GLU 137 2HG GLU 137 15.648 9.848 -0.567 786 2HG GLU 137 1HG GLU 137 14.671 11.255 -0.981 787 H TYR 138 H TYR 138 11.470 7.996 -1.393 788 HA TYR 138 HA TYR 138 9.770 7.272 0.865 789 1HB TYR 138 2HB TYR 138 9.774 6.700 -2.076 790 2HB TYR 138 1HB TYR 138 8.804 5.713 -0.982 791 HD1 TYR 138 1HD TYR 138 7.760 7.661 0.917 792 HD2 TYR 138 2HD TYR 138 8.306 8.011 -3.288 793 HE1 TYR 138 1HE TYR 138 5.973 9.350 0.832 794 HE2 TYR 138 2HE TYR 138 6.523 9.700 -3.386 795 HH TYR 138 HH TYR 138 5.362 11.235 -1.994 796 H THR 139 H THR 139 11.647 5.510 -1.597 797 HA THR 139 HA THR 139 12.097 3.354 0.330 798 HB THR 139 HB THR 139 12.736 1.998 -1.613 799 HG1 THR 139 1HG THR 139 12.692 2.845 -3.650 800 1HG2 THR 139 1HG2 THR 139 10.556 1.552 -1.575 801 2HG2 THR 139 2HG2 THR 139 10.464 2.612 -2.981 802 3HG2 THR 139 3HG2 THR 139 10.113 3.248 -1.374 803 H LYS 140 H LYS 140 13.639 6.096 -0.509 804 HA LYS 140 HA LYS 140 16.286 5.164 -1.013 805 1HB LYS 140 2HB LYS 140 15.000 7.776 -0.447 806 2HB LYS 140 1HB LYS 140 16.712 7.648 -0.068 807 1HG LYS 140 2HG LYS 140 16.546 6.540 -2.582 808 2HG LYS 140 1HG LYS 140 15.380 7.863 -2.641 809 1HD LYS 140 2HD LYS 140 17.272 9.262 -1.565 810 2HD LYS 140 1HD LYS 140 18.330 7.963 -2.121 811 1HE LYS 140 2HE LYS 140 18.234 8.663 -4.240 812 2HE LYS 140 1HE LYS 140 16.482 8.850 -4.181 813 1HZ LYS 140 1HZ LYS 140 18.582 10.816 -3.625 814 2HZ LYS 140 2HZ LYS 140 17.125 10.947 -2.778 815 3HZ LYS 140 3HZ LYS 140 17.127 11.002 -4.468 816 H ASN 141 H ASN 141 17.554 4.189 0.325 817 HA ASN 141 HA ASN 141 18.632 3.538 2.195 818 1HB ASN 141 2HB ASN 141 17.626 6.161 3.307 819 2HB ASN 141 1HB ASN 141 18.857 5.150 4.056 820 1HD2 ASN 141 1HD2 ASN 141 18.660 7.915 2.652 821 2HD2 ASN 141 2HD2 ASN 141 20.075 7.935 1.662 822 H VAL 142 H VAL 142 15.573 3.268 1.792 823 HA VAL 142 HA VAL 142 14.722 2.778 4.536 824 HB VAL 142 HB VAL 142 13.139 2.408 1.992 825 1HG1 VAL 142 1HG1 VAL 142 12.495 2.297 4.904 826 2HG1 VAL 142 2HG1 VAL 142 11.960 1.246 3.591 827 3HG1 VAL 142 3HG1 VAL 142 11.267 2.859 3.769 828 1HG2 VAL 142 1HG2 VAL 142 12.211 4.674 3.327 829 2HG2 VAL 142 2HG2 VAL 142 13.112 4.627 1.810 830 3HG2 VAL 142 3HG2 VAL 142 13.968 4.824 3.340 831 H ASN 143 H ASN 143 15.588 1.054 1.616 832 HA ASN 143 HA ASN 143 16.020 -1.143 1.213 833 1HB ASN 143 2HB ASN 143 16.371 -0.881 4.119 834 2HB ASN 143 1HB ASN 143 15.975 -2.515 3.593 835 1HD2 ASN 143 1HD2 ASN 143 18.032 -3.227 4.196 836 2HD2 ASN 143 2HD2 ASN 143 19.428 -2.882 3.239 837 HA PRO 144 HA PRO 144 11.735 -2.486 1.248 838 1HB PRO 144 2HB PRO 144 11.835 -4.063 -0.911 839 2HB PRO 144 1HB PRO 144 11.905 -2.302 -1.051 840 1HG PRO 144 2HG PRO 144 14.125 -4.303 -1.173 841 2HG PRO 144 1HG PRO 144 13.860 -2.861 -2.170 842 1HD PRO 144 2HD PRO 144 15.583 -2.972 -0.020 843 2HD PRO 144 1HD PRO 144 14.848 -1.480 -0.639 844 H ASN 145 H ASN 145 13.546 -3.768 3.086 845 HA ASN 145 HA ASN 145 13.204 -6.621 2.643 846 1HB ASN 145 2HB ASN 145 14.575 -5.060 4.838 847 2HB ASN 145 1HB ASN 145 14.463 -6.818 4.811 848 1HD2 ASN 145 1HD2 ASN 145 16.796 -5.052 4.715 849 2HD2 ASN 145 2HD2 ASN 145 17.653 -5.482 3.278 850 H TRP 146 H TRP 146 11.082 -4.426 3.505 851 HA TRP 146 HA TRP 146 10.124 -5.418 6.009 852 1HB TRP 146 2HB TRP 146 7.952 -4.139 5.032 853 2HB TRP 146 1HB TRP 146 9.280 -3.327 5.847 854 HD1 TRP 146 HD TRP 146 10.745 -1.671 4.437 855 HE1 TRP 146 1HE TRP 146 10.538 -0.713 2.058 856 HE3 TRP 146 3HE TRP 146 7.161 -4.824 2.593 857 HZ2 TRP 146 2HZ TRP 146 9.055 -1.222 -0.287 858 HZ3 TRP 146 3HZ TRP 146 6.402 -4.514 0.275 859 HH2 TRP 146 HH TRP 146 7.331 -2.752 -1.136 860 H SER 147 H SER 147 10.060 -6.760 2.970 861 HA SER 147 HA SER 147 7.430 -7.931 3.117 862 1HB SER 147 2HB SER 147 9.677 -7.944 1.191 863 2HB SER 147 1HB SER 147 8.677 -9.397 1.213 864 HG SER 147 HG SER 147 6.895 -8.161 0.736 865 H VAL 148 H VAL 148 10.665 -8.757 4.056 866 HA VAL 148 HA VAL 148 9.955 -11.526 4.599 867 HB VAL 148 HB VAL 148 12.318 -11.767 5.266 868 1HG1 VAL 148 1HG1 VAL 148 12.206 -12.339 3.074 869 2HG1 VAL 148 2HG1 VAL 148 13.196 -10.890 2.891 870 3HG1 VAL 148 3HG1 VAL 148 11.457 -10.811 2.605 871 1HG2 VAL 148 1HG2 VAL 148 12.281 -9.119 5.784 872 2HG2 VAL 148 2HG2 VAL 148 13.057 -9.121 4.199 873 3HG2 VAL 148 3HG2 VAL 148 13.761 -10.045 5.527 874 H ASN 149 H ASN 149 10.252 -8.502 6.202 875 HA ASN 149 HA ASN 149 10.351 -9.720 8.844 876 1HB ASN 149 2HB ASN 149 10.488 -6.846 7.935 877 2HB ASN 149 1HB ASN 149 10.519 -7.344 9.625 878 1HD2 ASN 149 1HD2 ASN 149 12.249 -8.873 10.228 879 2HD2 ASN 149 2HD2 ASN 149 13.793 -8.685 9.478 880 H VAL 150 H VAL 150 8.749 -6.827 9.037 881 HA VAL 150 HA VAL 150 6.092 -8.052 8.849 882 HB VAL 150 HB VAL 150 5.484 -6.784 10.968 883 1HG1 VAL 150 1HG1 VAL 150 6.262 -9.338 10.583 884 2HG1 VAL 150 2HG1 VAL 150 5.705 -8.702 12.131 885 3HG1 VAL 150 3HG1 VAL 150 7.434 -8.829 11.800 886 1HG2 VAL 150 1HG2 VAL 150 7.020 -5.710 12.197 887 2HG2 VAL 150 2HG2 VAL 150 7.996 -5.732 10.729 888 3HG2 VAL 150 3HG2 VAL 150 8.229 -6.972 11.961 Start of MODEL 17 1 1H GLY 38 1HT GLY 38 -6.000 -21.970 -15.990 2 2H GLY 38 2HT GLY 38 -5.343 -20.412 -15.926 3 3H GLY 38 3HT GLY 38 -4.331 -21.746 -16.164 4 1HA GLY 38 1HA GLY 38 -5.910 -20.264 -18.066 5 2HA GLY 38 2HA GLY 38 -4.464 -21.231 -18.320 6 H ALA 39 H ALA 39 -6.063 -21.568 -20.279 7 HA ALA 39 HA ALA 39 -7.971 -23.708 -19.732 8 1HB ALA 39 1HB ALA 39 -8.977 -23.208 -21.720 9 2HB ALA 39 2HB ALA 39 -7.466 -22.727 -22.491 10 3HB ALA 39 3HB ALA 39 -8.257 -21.641 -21.350 11 H MET 40 H MET 40 -4.862 -23.167 -21.232 12 HA MET 40 HA MET 40 -4.775 -25.867 -22.316 13 1HB MET 40 2HB MET 40 -3.813 -23.691 -23.399 14 2HB MET 40 1HB MET 40 -2.448 -23.978 -22.326 15 1HG MET 40 2HG MET 40 -1.840 -25.927 -23.402 16 2HG MET 40 1HG MET 40 -3.446 -26.170 -24.090 17 1HE MET 40 1HE MET 40 -0.699 -25.857 -26.821 18 2HE MET 40 2HE MET 40 -0.700 -26.517 -25.185 19 3HE MET 40 3HE MET 40 0.188 -25.035 -25.538 20 H ASP 41 H ASP 41 -2.623 -27.058 -21.953 21 HA ASP 41 HA ASP 41 -1.523 -28.396 -20.462 22 1HB ASP 41 2HB ASP 41 0.101 -27.194 -19.076 23 2HB ASP 41 1HB ASP 41 0.018 -26.504 -20.693 24 HA PRO 42 HA PRO 42 -4.911 -27.956 -17.212 25 1HB PRO 42 2HB PRO 42 -5.173 -30.832 -17.876 26 2HB PRO 42 1HB PRO 42 -6.427 -29.603 -17.683 27 1HG PRO 42 2HG PRO 42 -5.773 -30.530 -20.100 28 2HG PRO 42 1HG PRO 42 -6.181 -28.822 -19.850 29 1HD PRO 42 2HD PRO 42 -3.492 -30.100 -20.183 30 2HD PRO 42 1HD PRO 42 -4.098 -28.563 -20.837 31 H GLU 43 H GLU 43 -5.256 -30.193 -15.631 32 HA GLU 43 HA GLU 43 -4.380 -31.141 -13.755 33 1HB GLU 43 2HB GLU 43 -2.396 -31.805 -15.897 34 2HB GLU 43 1HB GLU 43 -2.065 -32.272 -14.234 35 1HG GLU 43 2HG GLU 43 -4.727 -33.031 -14.834 36 2HG GLU 43 1HG GLU 43 -3.695 -33.570 -16.157 37 H PHE 44 H PHE 44 -4.220 -28.808 -13.024 38 HA PHE 44 HA PHE 44 -3.143 -27.219 -11.811 39 1HB PHE 44 2HB PHE 44 -1.469 -29.630 -11.493 40 2HB PHE 44 1HB PHE 44 -0.664 -28.107 -11.129 41 HD1 PHE 44 1HD PHE 44 -2.126 -30.700 -9.581 42 HD2 PHE 44 2HD PHE 44 -2.548 -26.472 -9.823 43 HE1 PHE 44 1HE PHE 44 -3.181 -30.682 -7.359 44 HE2 PHE 44 2HE PHE 44 -3.602 -26.446 -7.600 45 HZ PHE 44 HZ PHE 44 -3.920 -28.553 -6.365 46 H ALA 45 H ALA 45 -0.178 -28.566 -13.202 47 HA ALA 45 HA ALA 45 1.389 -27.695 -14.600 48 1HB ALA 45 1HB ALA 45 0.686 -26.675 -16.553 49 2HB ALA 45 2HB ALA 45 -0.630 -25.815 -15.754 50 3HB ALA 45 3HB ALA 45 -0.759 -27.549 -16.046 51 H LEU 46 H LEU 46 1.199 -26.594 -12.033 52 HA LEU 46 HA LEU 46 2.062 -24.888 -10.800 53 1HB LEU 46 2HB LEU 46 2.885 -23.491 -13.323 54 2HB LEU 46 1HB LEU 46 3.663 -23.468 -11.752 55 HG LEU 46 HG LEU 46 3.603 -25.828 -13.633 56 1HD1 LEU 46 1HD1 LEU 46 5.010 -23.738 -14.205 57 2HD1 LEU 46 2HD1 LEU 46 5.776 -25.326 -14.253 58 3HD1 LEU 46 3HD1 LEU 46 6.034 -24.263 -12.869 59 1HD2 LEU 46 1HD2 LEU 46 5.303 -26.740 -12.058 60 2HD2 LEU 46 2HD2 LEU 46 3.687 -26.598 -11.367 61 3HD2 LEU 46 3HD2 LEU 46 4.927 -25.414 -10.958 62 H SER 47 H SER 47 2.137 -22.218 -10.978 63 HA SER 47 HA SER 47 0.869 -20.339 -10.789 64 1HB SER 47 2HB SER 47 0.708 -20.723 -13.292 65 2HB SER 47 1HB SER 47 -0.854 -21.486 -12.993 66 HG SER 47 HG SER 47 -0.126 -18.815 -12.881 67 H ASN 48 H ASN 48 -1.839 -19.847 -11.025 68 HA ASN 48 HA ASN 48 -3.890 -20.163 -10.070 69 1HB ASN 48 2HB ASN 48 -3.469 -22.625 -10.696 70 2HB ASN 48 1HB ASN 48 -3.018 -22.841 -9.008 71 1HD2 ASN 48 1HD2 ASN 48 -5.575 -21.039 -10.690 72 2HD2 ASN 48 2HD2 ASN 48 -6.880 -21.712 -9.779 73 H GLU 49 H GLU 49 -1.290 -21.513 -8.023 74 HA GLU 49 HA GLU 49 -2.521 -20.591 -5.610 75 1HB GLU 49 2HB GLU 49 -0.998 -22.592 -5.806 76 2HB GLU 49 1HB GLU 49 0.342 -21.469 -5.987 77 1HG GLU 49 2HG GLU 49 -1.160 -20.727 -3.688 78 2HG GLU 49 1HG GLU 49 -0.820 -22.454 -3.612 79 H LYS 50 H LYS 50 -2.730 -18.338 -6.534 80 HA LYS 50 HA LYS 50 -0.290 -16.753 -6.410 81 1HB LYS 50 2HB LYS 50 -1.811 -14.873 -7.067 82 2HB LYS 50 1HB LYS 50 -1.758 -16.201 -8.217 83 1HG LYS 50 2HG LYS 50 -3.863 -16.528 -6.242 84 2HG LYS 50 1HG LYS 50 -4.021 -15.033 -7.167 85 1HD LYS 50 2HD LYS 50 -4.286 -16.145 -9.170 86 2HD LYS 50 1HD LYS 50 -3.439 -17.585 -8.603 87 1HE LYS 50 2HE LYS 50 -5.337 -18.124 -7.153 88 2HE LYS 50 1HE LYS 50 -6.181 -16.686 -7.726 89 1HZ LYS 50 1HZ LYS 50 -5.262 -18.753 -9.620 90 2HZ LYS 50 2HZ LYS 50 -6.483 -17.601 -9.819 91 3HZ LYS 50 3HZ LYS 50 -6.730 -18.926 -8.798 92 H LYS 51 H LYS 51 0.393 -16.115 -4.475 93 HA LYS 51 HA LYS 51 -1.411 -15.885 -2.237 94 1HB LYS 51 2HB LYS 51 1.480 -16.000 -2.651 95 2HB LYS 51 1HB LYS 51 1.014 -14.849 -1.406 96 1HG LYS 51 2HG LYS 51 -0.447 -16.822 -0.527 97 2HG LYS 51 1HG LYS 51 0.668 -17.808 -1.476 98 1HD LYS 51 2HD LYS 51 1.830 -17.782 0.476 99 2HD LYS 51 1HD LYS 51 2.450 -16.278 -0.209 100 1HE LYS 51 2HE LYS 51 1.493 -15.042 1.387 101 2HE LYS 51 1HE LYS 51 -0.040 -15.900 1.244 102 1HZ LYS 51 1HZ LYS 51 2.203 -16.387 3.045 103 2HZ LYS 51 2HZ LYS 51 1.370 -17.745 2.479 104 3HZ LYS 51 3HZ LYS 51 0.540 -16.537 3.322 105 H ALA 52 H ALA 52 -0.642 -13.817 -0.760 106 HA ALA 52 HA ALA 52 -1.758 -11.563 -2.176 107 1HB ALA 52 1HB ALA 52 -0.704 -11.163 0.548 108 2HB ALA 52 2HB ALA 52 -1.968 -12.382 0.382 109 3HB ALA 52 3HB ALA 52 -2.266 -10.724 -0.143 110 H LYS 53 H LYS 53 -0.764 -9.443 -2.191 111 HA LYS 53 HA LYS 53 2.133 -9.630 -2.604 112 1HB LYS 53 2HB LYS 53 0.247 -7.446 -3.501 113 2HB LYS 53 1HB LYS 53 1.927 -7.645 -3.977 114 1HG LYS 53 2HG LYS 53 1.191 -8.756 -5.747 115 2HG LYS 53 1HG LYS 53 0.733 -10.058 -4.648 116 1HD LYS 53 2HD LYS 53 -1.454 -8.787 -4.321 117 2HD LYS 53 1HD LYS 53 -0.976 -7.832 -5.726 118 1HE LYS 53 2HE LYS 53 -1.124 -9.644 -7.167 119 2HE LYS 53 1HE LYS 53 -0.971 -10.821 -5.862 120 1HZ LYS 53 1HZ LYS 53 -3.180 -10.984 -6.166 121 2HZ LYS 53 2HZ LYS 53 -3.330 -9.443 -6.848 122 3HZ LYS 53 3HZ LYS 53 -3.234 -9.618 -5.169 123 H LYS 54 H LYS 54 3.543 -8.527 -1.374 124 HA LYS 54 HA LYS 54 2.483 -6.945 0.821 125 1HB LYS 54 2HB LYS 54 4.794 -8.661 0.431 126 2HB LYS 54 1HB LYS 54 5.260 -7.098 1.089 127 1HG LYS 54 2HG LYS 54 4.830 -8.764 2.834 128 2HG LYS 54 1HG LYS 54 3.742 -7.378 2.943 129 1HD LYS 54 2HD LYS 54 1.918 -8.598 2.144 130 2HD LYS 54 1HD LYS 54 2.946 -9.859 1.459 131 1HE LYS 54 2HE LYS 54 3.084 -10.977 3.405 132 2HE LYS 54 1HE LYS 54 3.213 -9.499 4.358 133 1HZ LYS 54 1HZ LYS 54 1.008 -9.427 4.704 134 2HZ LYS 54 2HZ LYS 54 1.074 -11.084 4.367 135 3HZ LYS 54 3HZ LYS 54 0.619 -9.994 3.156 136 H VAL 55 H VAL 55 2.477 -4.842 0.716 137 HA VAL 55 HA VAL 55 4.490 -3.474 -0.942 138 HB VAL 55 HB VAL 55 2.775 -1.803 -1.587 139 1HG1 VAL 55 1HG1 VAL 55 3.417 -3.982 -2.892 140 2HG1 VAL 55 2HG1 VAL 55 2.107 -2.937 -3.446 141 3HG1 VAL 55 3HG1 VAL 55 1.741 -4.415 -2.555 142 1HG2 VAL 55 1HG2 VAL 55 0.368 -2.683 -1.416 143 2HG2 VAL 55 2HG2 VAL 55 1.108 -1.956 0.016 144 3HG2 VAL 55 3HG2 VAL 55 0.996 -3.712 -0.129 145 H ARG 56 H ARG 56 4.985 -1.356 -0.366 146 HA ARG 56 HA ARG 56 4.337 -0.671 2.418 147 1HB ARG 56 2HB ARG 56 6.753 -0.948 1.912 148 2HB ARG 56 1HB ARG 56 6.623 0.295 0.676 149 1HG ARG 56 2HG ARG 56 7.593 1.239 2.655 150 2HG ARG 56 1HG ARG 56 5.980 1.917 2.424 151 1HD ARG 56 2HD ARG 56 5.696 1.396 4.587 152 2HD ARG 56 1HD ARG 56 5.436 -0.239 3.982 153 HE ARG 56 HE ARG 56 8.092 -0.193 4.321 154 1HH1 ARG 56 1HH1 ARG 56 5.481 0.778 6.427 155 2HH1 ARG 56 2HH1 ARG 56 6.352 0.415 7.878 156 1HH2 ARG 56 1HH2 ARG 56 9.235 -0.671 6.228 157 2HH2 ARG 56 2HH2 ARG 56 8.484 -0.406 7.767 158 H PHE 57 H PHE 57 2.592 0.631 2.389 159 HA PHE 57 HA PHE 57 2.206 2.432 0.149 160 1HB PHE 57 2HB PHE 57 0.485 1.601 2.468 161 2HB PHE 57 1HB PHE 57 0.029 2.935 1.417 162 HD1 PHE 57 1HD PHE 57 -1.823 0.812 1.647 163 HD2 PHE 57 2HD PHE 57 1.616 1.022 -0.859 164 HE1 PHE 57 1HE PHE 57 -2.858 -0.777 0.081 165 HE2 PHE 57 2HE PHE 57 0.580 -0.550 -2.419 166 HZ PHE 57 HZ PHE 57 -1.660 -1.456 -1.957 167 H TYR 58 H TYR 58 2.567 4.473 0.116 168 HA TYR 58 HA TYR 58 3.157 5.919 2.608 169 1HB TYR 58 2HB TYR 58 4.254 6.577 -0.115 170 2HB TYR 58 1HB TYR 58 4.701 7.308 1.409 171 HD1 TYR 58 1HD TYR 58 5.144 4.404 -0.768 172 HD2 TYR 58 2HD TYR 58 6.173 6.154 2.969 173 HE1 TYR 58 1HE TYR 58 6.992 2.801 -0.534 174 HE2 TYR 58 2HE TYR 58 8.025 4.556 3.214 175 HH TYR 58 HH TYR 58 9.045 2.515 0.624 176 H ARG 59 H ARG 59 2.369 7.999 2.789 177 HA ARG 59 HA ARG 59 0.123 8.586 1.004 178 1HB ARG 59 2HB ARG 59 0.697 10.197 3.460 179 2HB ARG 59 1HB ARG 59 -0.850 9.802 2.726 180 1HG ARG 59 2HG ARG 59 -1.042 8.386 4.447 181 2HG ARG 59 1HG ARG 59 0.001 7.342 3.479 182 1HD ARG 59 2HD ARG 59 0.930 7.428 5.666 183 2HD ARG 59 1HD ARG 59 1.963 8.397 4.624 184 HE ARG 59 HE ARG 59 1.144 10.351 5.655 185 1HH1 ARG 59 1HH1 ARG 59 -0.154 7.445 7.113 186 2HH1 ARG 59 2HH1 ARG 59 -0.646 8.251 8.560 187 1HH2 ARG 59 1HH2 ARG 59 0.493 11.395 7.561 188 2HH2 ARG 59 2HH2 ARG 59 -0.283 10.487 8.814 189 H ASN 60 H ASN 60 0.494 9.923 -0.617 190 HA ASN 60 HA ASN 60 2.730 11.225 -1.307 191 1HB ASN 60 2HB ASN 60 0.784 11.102 -2.758 192 2HB ASN 60 1HB ASN 60 -0.075 12.246 -1.741 193 1HD2 ASN 60 1HD2 ASN 60 0.002 12.919 -4.253 194 2HD2 ASN 60 2HD2 ASN 60 1.153 14.168 -4.570 195 H GLY 61 H GLY 61 3.996 12.664 -0.424 196 1HA GLY 61 2HA GLY 61 4.624 14.696 0.524 197 2HA GLY 61 1HA GLY 61 2.926 15.067 0.791 198 H ASP 62 H ASP 62 4.951 12.345 1.865 199 HA ASP 62 HA ASP 62 4.763 13.247 4.621 200 1HB ASP 62 2HB ASP 62 2.767 11.643 3.821 201 2HB ASP 62 1HB ASP 62 3.963 10.412 4.212 202 H ARG 63 H ARG 63 7.067 13.425 3.801 203 HA ARG 63 HA ARG 63 8.566 11.002 3.509 204 1HB ARG 63 2HB ARG 63 10.503 12.429 3.360 205 2HB ARG 63 1HB ARG 63 9.195 13.133 2.417 206 1HG ARG 63 2HG ARG 63 9.118 14.151 5.096 207 2HG ARG 63 1HG ARG 63 10.733 14.359 4.415 208 1HD ARG 63 2HD ARG 63 8.611 15.032 2.536 209 2HD ARG 63 1HD ARG 63 8.564 16.011 4.002 210 HE ARG 63 HE ARG 63 10.496 16.150 1.903 211 1HH1 ARG 63 1HH1 ARG 63 10.040 16.606 5.333 212 2HH1 ARG 63 2HH1 ARG 63 11.332 17.750 5.480 213 1HH2 ARG 63 1HH2 ARG 63 12.196 17.654 2.095 214 2HH2 ARG 63 2HH2 ARG 63 12.556 18.345 3.641 215 H TYR 64 H TYR 64 7.202 12.379 6.184 216 HA TYR 64 HA TYR 64 9.308 11.330 7.954 217 1HB TYR 64 2HB TYR 64 7.689 13.787 8.071 218 2HB TYR 64 1HB TYR 64 7.785 12.893 9.584 219 HD1 TYR 64 1HD TYR 64 10.066 14.037 6.849 220 HD2 TYR 64 2HD TYR 64 9.498 13.443 11.023 221 HE1 TYR 64 1HE TYR 64 12.277 15.020 7.284 222 HE2 TYR 64 2HE TYR 64 11.707 14.426 11.470 223 HH TYR 64 HH TYR 64 13.265 16.266 9.852 224 H PHE 65 H PHE 65 7.905 9.386 7.149 225 HA PHE 65 HA PHE 65 6.384 8.511 9.409 226 1HB PHE 65 2HB PHE 65 4.601 9.730 8.341 227 2HB PHE 65 1HB PHE 65 4.966 8.998 6.783 228 HD1 PHE 65 1HD PHE 65 3.288 7.598 6.114 229 HD2 PHE 65 2HD PHE 65 4.411 7.637 10.217 230 HE1 PHE 65 1HE PHE 65 1.666 5.806 6.568 231 HE2 PHE 65 2HE PHE 65 2.791 5.844 10.682 232 HZ PHE 65 HZ PHE 65 1.415 4.926 8.856 233 H LYS 66 H LYS 66 7.326 7.949 6.053 234 HA LYS 66 HA LYS 66 8.337 6.147 5.085 235 1HB LYS 66 2HB LYS 66 8.767 5.638 7.810 236 2HB LYS 66 1HB LYS 66 8.102 4.146 7.158 237 1HG LYS 66 2HG LYS 66 9.923 4.739 5.258 238 2HG LYS 66 1HG LYS 66 10.701 5.430 6.682 239 1HD LYS 66 2HD LYS 66 9.648 2.874 7.376 240 2HD LYS 66 1HD LYS 66 10.577 2.711 5.883 241 1HE LYS 66 2HE LYS 66 11.952 2.364 7.900 242 2HE LYS 66 1HE LYS 66 12.505 3.726 6.925 243 1HZ LYS 66 1HZ LYS 66 10.620 4.572 8.876 244 2HZ LYS 66 2HZ LYS 66 12.210 5.092 8.629 245 3HZ LYS 66 3HZ LYS 66 11.903 3.750 9.610 246 H GLY 67 H GLY 67 5.256 6.444 6.030 247 1HA GLY 67 2HA GLY 67 3.316 5.515 5.234 248 2HA GLY 67 1HA GLY 67 4.303 4.544 4.156 249 H ILE 68 H ILE 68 2.264 3.227 4.877 250 HA ILE 68 HA ILE 68 3.106 1.480 7.094 251 HB ILE 68 HB ILE 68 1.117 2.679 7.780 252 1HG1 ILE 68 2HG1 ILE 68 0.241 -0.099 6.985 253 2HG1 ILE 68 1HG1 ILE 68 1.389 0.207 8.286 254 1HG2 ILE 68 1HG2 ILE 68 -0.602 3.207 6.456 255 2HG2 ILE 68 2HG2 ILE 68 -0.741 1.559 5.839 256 3HG2 ILE 68 3HG2 ILE 68 0.422 2.672 5.122 257 1HD1 ILE 68 1HD1 ILE 68 -0.202 0.971 9.692 258 2HD1 ILE 68 2HD1 ILE 68 -1.227 -0.057 8.689 259 3HD1 ILE 68 3HD1 ILE 68 -1.165 1.683 8.397 260 H VAL 69 H VAL 69 3.079 -0.708 6.711 261 HA VAL 69 HA VAL 69 2.926 -1.515 3.936 262 HB VAL 69 HB VAL 69 3.534 -3.252 6.328 263 1HG1 VAL 69 1HG1 VAL 69 4.748 -3.803 3.710 264 2HG1 VAL 69 2HG1 VAL 69 3.001 -4.020 3.784 265 3HG1 VAL 69 3HG1 VAL 69 4.047 -4.906 4.893 266 1HG2 VAL 69 1HG2 VAL 69 5.694 -2.578 6.351 267 2HG2 VAL 69 2HG2 VAL 69 4.994 -1.087 5.723 268 3HG2 VAL 69 3HG2 VAL 69 5.725 -2.251 4.619 269 H TYR 70 H TYR 70 1.377 -2.708 2.985 270 HA TYR 70 HA TYR 70 -0.651 -3.982 4.647 271 1HB TYR 70 2HB TYR 70 -1.042 -1.727 2.838 272 2HB TYR 70 1HB TYR 70 -2.064 -3.098 2.426 273 HD1 TYR 70 1HD TYR 70 -0.957 -1.440 5.601 274 HD2 TYR 70 2HD TYR 70 -4.180 -2.966 3.279 275 HE1 TYR 70 1HE TYR 70 -2.530 -0.828 7.390 276 HE2 TYR 70 2HE TYR 70 -5.760 -2.356 5.061 277 HH TYR 70 HH TYR 70 -4.951 -1.756 8.109 278 H ALA 71 H ALA 71 -1.722 -5.680 3.676 279 HA ALA 71 HA ALA 71 -0.275 -6.931 1.449 280 1HB ALA 71 1HB ALA 71 -1.148 -9.047 2.224 281 2HB ALA 71 2HB ALA 71 -2.148 -8.232 3.429 282 3HB ALA 71 3HB ALA 71 -0.390 -8.204 3.576 283 H VAL 72 H VAL 72 -1.424 -7.714 -0.352 284 HA VAL 72 HA VAL 72 -4.281 -7.112 -0.442 285 HB VAL 72 HB VAL 72 -2.684 -6.343 -2.835 286 1HG1 VAL 72 1HG1 VAL 72 -4.565 -5.266 -3.448 287 2HG1 VAL 72 2HG1 VAL 72 -4.891 -4.688 -1.815 288 3HG1 VAL 72 3HG1 VAL 72 -5.326 -6.334 -2.270 289 1HG2 VAL 72 1HG2 VAL 72 -2.975 -4.594 -0.391 290 2HG2 VAL 72 2HG2 VAL 72 -2.384 -4.063 -1.965 291 3HG2 VAL 72 3HG2 VAL 72 -1.468 -5.247 -1.034 292 H SER 73 H SER 73 -5.444 -8.531 -1.506 293 HA SER 73 HA SER 73 -4.339 -10.233 -3.562 294 1HB SER 73 2HB SER 73 -5.427 -12.223 -2.085 295 2HB SER 73 1HB SER 73 -3.715 -11.807 -2.037 296 HG SER 73 HG SER 73 -5.754 -11.022 -0.234 297 H SER 74 H SER 74 -6.184 -11.998 -4.056 298 HA SER 74 HA SER 74 -8.508 -10.424 -4.711 299 1HB SER 74 2HB SER 74 -7.633 -13.233 -5.354 300 2HB SER 74 1HB SER 74 -9.246 -12.653 -5.771 301 HG SER 74 HG SER 74 -6.895 -11.270 -6.519 302 H ASP 75 H ASP 75 -7.630 -12.632 -2.224 303 HA ASP 75 HA ASP 75 -10.325 -13.407 -1.580 304 1HB ASP 75 2HB ASP 75 -7.625 -14.163 -0.813 305 2HB ASP 75 1HB ASP 75 -8.693 -14.044 0.574 306 H ARG 76 H ARG 76 -8.015 -10.990 -0.560 307 HA ARG 76 HA ARG 76 -9.666 -10.237 1.724 308 1HB ARG 76 2HB ARG 76 -6.893 -9.688 0.843 309 2HB ARG 76 1HB ARG 76 -7.695 -8.398 1.729 310 1HG ARG 76 2HG ARG 76 -8.059 -9.829 3.610 311 2HG ARG 76 1HG ARG 76 -7.476 -11.233 2.714 312 1HD ARG 76 2HD ARG 76 -5.270 -10.051 2.500 313 2HD ARG 76 1HD ARG 76 -5.890 -8.837 3.619 314 HE ARG 76 HE ARG 76 -4.996 -11.496 4.259 315 1HH1 ARG 76 1HH1 ARG 76 -6.987 -8.817 5.282 316 2HH1 ARG 76 2HH1 ARG 76 -6.949 -9.266 6.954 317 1HH2 ARG 76 1HH2 ARG 76 -4.947 -12.088 6.458 318 2HH2 ARG 76 2HH2 ARG 76 -5.791 -11.121 7.623 319 H PHE 77 H PHE 77 -8.469 -8.824 -1.306 320 HA PHE 77 HA PHE 77 -10.627 -6.831 -1.116 321 1HB PHE 77 2HB PHE 77 -7.876 -6.368 -2.281 322 2HB PHE 77 1HB PHE 77 -9.175 -5.183 -2.165 323 HD1 PHE 77 1HD PHE 77 -6.460 -6.829 -0.447 324 HD2 PHE 77 2HD PHE 77 -9.882 -4.353 0.062 325 HE1 PHE 77 1HE PHE 77 -5.642 -6.162 1.776 326 HE2 PHE 77 2HE PHE 77 -9.070 -3.679 2.285 327 HZ PHE 77 HZ PHE 77 -6.946 -4.585 3.144 328 H ARG 78 H ARG 78 -12.062 -7.092 -2.660 329 HA ARG 78 HA ARG 78 -11.698 -8.787 -4.878 330 1HB ARG 78 2HB ARG 78 -13.803 -7.173 -3.690 331 2HB ARG 78 1HB ARG 78 -13.870 -7.157 -5.439 332 1HG ARG 78 2HG ARG 78 -14.088 -9.522 -5.537 333 2HG ARG 78 1HG ARG 78 -13.723 -9.679 -3.817 334 1HD ARG 78 2HD ARG 78 -15.796 -8.962 -3.170 335 2HD ARG 78 1HD ARG 78 -16.024 -7.980 -4.617 336 HE ARG 78 HE ARG 78 -15.988 -10.815 -5.117 337 1HH1 ARG 78 1HH1 ARG 78 -17.979 -8.078 -4.262 338 2HH1 ARG 78 2HH1 ARG 78 -19.443 -8.807 -4.829 339 1HH2 ARG 78 1HH2 ARG 78 -17.913 -11.773 -5.865 340 2HH2 ARG 78 2HH2 ARG 78 -19.406 -10.904 -5.741 341 H SER 79 H SER 79 -11.239 -5.370 -4.378 342 HA SER 79 HA SER 79 -9.907 -5.122 -6.909 343 1HB SER 79 2HB SER 79 -11.383 -3.265 -7.736 344 2HB SER 79 1HB SER 79 -12.140 -4.857 -7.758 345 HG SER 79 HG SER 79 -13.364 -2.990 -6.834 346 H PHE 80 H PHE 80 -9.443 -2.648 -7.302 347 HA PHE 80 HA PHE 80 -7.833 -1.775 -5.187 348 1HB PHE 80 2HB PHE 80 -8.108 -1.118 -7.842 349 2HB PHE 80 1HB PHE 80 -8.680 0.340 -7.036 350 HD1 PHE 80 1HD PHE 80 -6.990 1.909 -7.259 351 HD2 PHE 80 2HD PHE 80 -6.003 -2.056 -6.079 352 HE1 PHE 80 1HE PHE 80 -4.666 2.604 -6.884 353 HE2 PHE 80 2HE PHE 80 -3.679 -1.364 -5.692 354 HZ PHE 80 HZ PHE 80 -3.003 0.965 -6.099 355 H ASP 81 H ASP 81 -11.140 -0.985 -6.047 356 HA ASP 81 HA ASP 81 -11.451 1.314 -4.468 357 1HB ASP 81 2HB ASP 81 -13.064 -0.134 -6.168 358 2HB ASP 81 1HB ASP 81 -13.823 -0.406 -4.603 359 H ALA 82 H ALA 82 -11.788 -2.111 -3.718 360 HA ALA 82 HA ALA 82 -12.792 -1.757 -1.085 361 1HB ALA 82 1HB ALA 82 -12.030 -3.942 -2.797 362 2HB ALA 82 2HB ALA 82 -13.175 -3.908 -1.455 363 3HB ALA 82 3HB ALA 82 -11.463 -4.196 -1.147 364 H LEU 83 H LEU 83 -9.554 -2.297 -2.422 365 HA LEU 83 HA LEU 83 -8.199 -2.427 0.057 366 1HB LEU 83 2HB LEU 83 -7.242 -3.153 -2.116 367 2HB LEU 83 1HB LEU 83 -7.169 -1.480 -2.621 368 HG LEU 83 HG LEU 83 -5.590 -1.009 -0.778 369 1HD1 LEU 83 1HD1 LEU 83 -6.004 -3.925 -0.251 370 2HD1 LEU 83 2HD1 LEU 83 -6.014 -2.572 0.881 371 3HD1 LEU 83 3HD1 LEU 83 -4.492 -3.132 0.189 372 1HD2 LEU 83 1HD2 LEU 83 -5.027 -2.939 -2.960 373 2HD2 LEU 83 2HD2 LEU 83 -3.766 -2.658 -1.757 374 3HD2 LEU 83 3HD2 LEU 83 -4.406 -1.310 -2.697 375 H LEU 84 H LEU 84 -8.822 0.157 -2.246 376 HA LEU 84 HA LEU 84 -7.539 2.228 -0.875 377 1HB LEU 84 2HB LEU 84 -9.757 2.106 -2.882 378 2HB LEU 84 1HB LEU 84 -9.358 3.640 -2.127 379 HG LEU 84 HG LEU 84 -7.380 1.932 -3.631 380 1HD1 LEU 84 1HD1 LEU 84 -8.727 2.622 -5.345 381 2HD1 LEU 84 2HD1 LEU 84 -7.626 3.997 -5.227 382 3HD1 LEU 84 3HD1 LEU 84 -9.233 4.088 -4.506 383 1HD2 LEU 84 1HD2 LEU 84 -6.196 4.224 -3.632 384 2HD2 LEU 84 2HD2 LEU 84 -6.153 3.247 -2.162 385 3HD2 LEU 84 3HD2 LEU 84 -7.275 4.602 -2.290 386 H ALA 85 H ALA 85 -10.706 0.745 -0.474 387 HA ALA 85 HA ALA 85 -11.838 2.748 1.187 388 1HB ALA 85 1HB ALA 85 -13.085 0.891 0.075 389 2HB ALA 85 2HB ALA 85 -13.468 1.096 1.784 390 3HB ALA 85 3HB ALA 85 -12.400 -0.210 1.270 391 H ASP 86 H ASP 86 -10.028 -0.211 1.896 392 HA ASP 86 HA ASP 86 -10.081 0.142 4.726 393 1HB ASP 86 2HB ASP 86 -8.778 -1.715 2.811 394 2HB ASP 86 1HB ASP 86 -7.984 -1.515 4.370 395 H LEU 87 H LEU 87 -7.936 1.031 2.121 396 HA LEU 87 HA LEU 87 -5.693 1.784 3.646 397 1HB LEU 87 2HB LEU 87 -6.719 2.642 0.949 398 2HB LEU 87 1HB LEU 87 -5.267 3.344 1.626 399 HG LEU 87 HG LEU 87 -5.717 0.625 0.512 400 1HD1 LEU 87 1HD1 LEU 87 -4.488 2.688 -0.504 401 2HD1 LEU 87 2HD1 LEU 87 -3.827 1.066 -0.705 402 3HD1 LEU 87 3HD1 LEU 87 -3.157 2.146 0.518 403 1HD2 LEU 87 1HD2 LEU 87 -3.674 1.201 2.658 404 2HD2 LEU 87 2HD2 LEU 87 -3.758 -0.264 1.683 405 3HD2 LEU 87 3HD2 LEU 87 -5.058 0.120 2.809 406 H THR 88 H THR 88 -8.610 3.524 2.752 407 HA THR 88 HA THR 88 -7.824 6.083 3.580 408 HB THR 88 HB THR 88 -10.623 5.487 4.156 409 HG1 THR 88 1HG THR 88 -11.214 4.630 2.281 410 1HG2 THR 88 1HG2 THR 88 -10.933 7.481 3.259 411 2HG2 THR 88 2HG2 THR 88 -10.148 7.000 1.755 412 3HG2 THR 88 3HG2 THR 88 -9.180 7.602 3.101 413 H ARG 89 H ARG 89 -9.261 3.376 5.315 414 HA ARG 89 HA ARG 89 -9.575 4.718 7.788 415 1HB ARG 89 2HB ARG 89 -9.447 1.786 7.093 416 2HB ARG 89 1HB ARG 89 -9.803 2.389 8.705 417 1HG ARG 89 2HG ARG 89 -11.439 3.434 6.469 418 2HG ARG 89 1HG ARG 89 -11.702 1.762 6.968 419 1HD ARG 89 2HD ARG 89 -12.524 2.356 9.009 420 2HD ARG 89 1HD ARG 89 -11.545 3.819 9.097 421 HE ARG 89 HE ARG 89 -13.318 4.342 7.106 422 1HH1 ARG 89 1HH1 ARG 89 -13.639 3.311 10.425 423 2HH1 ARG 89 2HH1 ARG 89 -15.174 4.082 10.647 424 1HH2 ARG 89 1HH2 ARG 89 -15.336 5.357 7.397 425 2HH2 ARG 89 2HH2 ARG 89 -16.138 5.243 8.928 426 H SER 90 H SER 90 -7.017 2.519 6.570 427 HA SER 90 HA SER 90 -5.564 2.657 9.038 428 1HB SER 90 2HB SER 90 -5.551 0.933 6.917 429 2HB SER 90 1HB SER 90 -4.052 1.829 6.661 430 HG SER 90 HG SER 90 -4.819 0.497 9.049 431 H LEU 91 H LEU 91 -5.248 4.263 5.898 432 HA LEU 91 HA LEU 91 -2.897 5.671 6.853 433 1HB LEU 91 2HB LEU 91 -4.028 4.923 4.266 434 2HB LEU 91 1HB LEU 91 -3.367 6.535 4.306 435 HG LEU 91 HG LEU 91 -1.945 3.930 4.773 436 1HD1 LEU 91 1HD1 LEU 91 -1.597 6.207 2.843 437 2HD1 LEU 91 2HD1 LEU 91 -2.054 4.541 2.486 438 3HD1 LEU 91 3HD1 LEU 91 -0.423 4.907 3.048 439 1HD2 LEU 91 1HD2 LEU 91 -1.149 6.682 5.624 440 2HD2 LEU 91 2HD2 LEU 91 0.075 5.507 5.143 441 3HD2 LEU 91 3HD2 LEU 91 -1.004 5.154 6.493 442 H SER 92 H SER 92 -6.150 6.156 7.040 443 HA SER 92 HA SER 92 -6.915 8.556 6.151 444 1HB SER 92 2HB SER 92 -7.809 8.781 8.732 445 2HB SER 92 1HB SER 92 -8.589 7.825 7.474 446 HG SER 92 HG SER 92 -7.248 7.010 9.709 447 H ASP 93 H ASP 93 -6.302 10.592 6.213 448 HA ASP 93 HA ASP 93 -5.021 11.743 8.525 449 1HB ASP 93 2HB ASP 93 -3.538 11.293 5.959 450 2HB ASP 93 1HB ASP 93 -3.157 12.681 6.968 451 H ASN 94 H ASN 94 -5.549 13.824 8.725 452 HA ASN 94 HA ASN 94 -7.390 14.972 6.863 453 1HB ASN 94 2HB ASN 94 -6.111 16.193 9.314 454 2HB ASN 94 1HB ASN 94 -7.488 16.852 8.436 455 1HD2 ASN 94 1HD2 ASN 94 -6.442 14.691 10.834 456 2HD2 ASN 94 2HD2 ASN 94 -7.976 13.991 11.209 457 H ILE 95 H ILE 95 -3.968 15.319 7.442 458 HA ILE 95 HA ILE 95 -3.886 17.646 5.661 459 HB ILE 95 HB ILE 95 -1.963 16.583 7.711 460 1HG1 ILE 95 2HG1 ILE 95 -2.182 19.293 8.032 461 2HG1 ILE 95 1HG1 ILE 95 -3.783 18.875 7.430 462 1HG2 ILE 95 1HG2 ILE 95 -1.397 18.575 5.531 463 2HG2 ILE 95 2HG2 ILE 95 -0.553 17.065 5.867 464 3HG2 ILE 95 3HG2 ILE 95 -0.420 18.417 6.991 465 1HD1 ILE 95 1HD1 ILE 95 -3.965 18.766 9.749 466 2HD1 ILE 95 2HD1 ILE 95 -2.418 17.938 9.922 467 3HD1 ILE 95 3HD1 ILE 95 -3.802 17.084 9.242 468 H ASN 96 H ASN 96 -2.896 14.316 5.945 469 HA ASN 96 HA ASN 96 -1.179 14.517 3.599 470 1HB ASN 96 2HB ASN 96 -1.577 12.542 5.761 471 2HB ASN 96 1HB ASN 96 -1.182 11.873 4.181 472 1HD2 ASN 96 1HD2 ASN 96 0.015 13.290 6.981 473 2HD2 ASN 96 2HD2 ASN 96 1.639 13.556 6.456 474 H LEU 97 H LEU 97 -4.381 13.518 4.452 475 HA LEU 97 HA LEU 97 -4.887 12.882 1.649 476 1HB LEU 97 2HB LEU 97 -5.568 11.048 3.946 477 2HB LEU 97 1HB LEU 97 -6.238 10.886 2.332 478 HG LEU 97 HG LEU 97 -3.272 10.920 2.630 479 1HD1 LEU 97 1HD1 LEU 97 -3.729 8.280 2.744 480 2HD1 LEU 97 2HD1 LEU 97 -5.077 8.860 3.722 481 3HD1 LEU 97 3HD1 LEU 97 -3.422 9.276 4.167 482 1HD2 LEU 97 1HD2 LEU 97 -4.689 8.999 0.906 483 2HD2 LEU 97 2HD2 LEU 97 -3.282 10.008 0.570 484 3HD2 LEU 97 3HD2 LEU 97 -4.902 10.701 0.498 485 HA PRO 98 HA PRO 98 -7.879 16.048 3.262 486 1HB PRO 98 2HB PRO 98 -8.315 15.785 0.303 487 2HB PRO 98 1HB PRO 98 -8.367 17.226 1.316 488 1HG PRO 98 2HG PRO 98 -6.216 16.701 -0.143 489 2HG PRO 98 1HG PRO 98 -6.051 17.340 1.503 490 1HD PRO 98 2HD PRO 98 -5.539 14.600 0.479 491 2HD PRO 98 1HD PRO 98 -4.797 15.453 1.845 492 H GLN 99 H GLN 99 -8.933 14.112 0.476 493 HA GLN 99 HA GLN 99 -11.394 13.471 1.927 494 1HB GLN 99 2HB GLN 99 -12.085 12.628 -0.424 495 2HB GLN 99 1HB GLN 99 -11.978 14.361 -0.142 496 1HG GLN 99 2HG GLN 99 -9.926 14.518 -1.301 497 2HG GLN 99 1HG GLN 99 -9.730 12.767 -1.329 498 1HE2 GLN 99 1HE2 GLN 99 -9.618 14.457 -3.586 499 2HE2 GLN 99 2HE2 GLN 99 -10.928 14.038 -4.631 500 H GLY 100 H GLY 100 -8.688 12.078 2.218 501 1HA GLY 100 2HA GLY 100 -8.236 9.920 2.901 502 2HA GLY 100 1HA GLY 100 -9.790 9.418 2.251 503 H VAL 101 H VAL 101 -7.634 7.864 1.883 504 HA VAL 101 HA VAL 101 -6.186 8.316 -0.503 505 HB VAL 101 HB VAL 101 -6.876 5.624 0.686 506 1HG1 VAL 101 1HG1 VAL 101 -5.025 4.775 -0.480 507 2HG1 VAL 101 2HG1 VAL 101 -4.406 6.385 -0.839 508 3HG1 VAL 101 3HG1 VAL 101 -5.859 5.805 -1.642 509 1HG2 VAL 101 1HG2 VAL 101 -5.388 5.901 2.340 510 2HG2 VAL 101 2HG2 VAL 101 -5.625 7.624 2.049 511 3HG2 VAL 101 3HG2 VAL 101 -4.259 6.786 1.311 512 H ARG 102 H ARG 102 -7.264 8.727 -2.322 513 HA ARG 102 HA ARG 102 -9.565 7.072 -3.036 514 1HB ARG 102 2HB ARG 102 -8.787 9.827 -3.523 515 2HB ARG 102 1HB ARG 102 -9.259 9.008 -5.006 516 1HG ARG 102 2HG ARG 102 -10.988 8.752 -2.600 517 2HG ARG 102 1HG ARG 102 -11.027 10.243 -3.544 518 1HD ARG 102 2HD ARG 102 -12.645 8.267 -4.107 519 2HD ARG 102 1HD ARG 102 -11.907 9.214 -5.392 520 HE ARG 102 HE ARG 102 -10.189 7.332 -5.459 521 1HH1 ARG 102 1HH1 ARG 102 -13.527 6.820 -4.522 522 2HH1 ARG 102 2HH1 ARG 102 -13.527 5.160 -5.006 523 1HH2 ARG 102 1HH2 ARG 102 -10.209 5.156 -6.091 524 2HH2 ARG 102 2HH2 ARG 102 -11.650 4.216 -5.896 525 H TYR 103 H TYR 103 -6.339 7.937 -4.121 526 HA TYR 103 HA TYR 103 -6.497 5.697 -5.994 527 1HB TYR 103 2HB TYR 103 -5.187 8.254 -6.879 528 2HB TYR 103 1HB TYR 103 -5.687 6.874 -7.836 529 HD1 TYR 103 1HD TYR 103 -6.812 9.956 -6.225 530 HD2 TYR 103 2HD TYR 103 -7.979 6.565 -8.510 531 HE1 TYR 103 1HE TYR 103 -8.932 11.071 -6.790 532 HE2 TYR 103 2HE TYR 103 -10.090 7.664 -9.086 533 HH TYR 103 HH TYR 103 -10.669 10.987 -8.459 534 H ILE 104 H ILE 104 -4.411 4.981 -6.780 535 HA ILE 104 HA ILE 104 -2.238 5.541 -4.872 536 HB ILE 104 HB ILE 104 -2.935 2.888 -6.133 537 1HG1 ILE 104 2HG1 ILE 104 -3.220 3.916 -3.306 538 2HG1 ILE 104 1HG1 ILE 104 -4.515 3.432 -4.396 539 1HG2 ILE 104 1HG2 ILE 104 -0.988 2.044 -5.455 540 2HG2 ILE 104 2HG2 ILE 104 -1.035 2.916 -3.922 541 3HG2 ILE 104 3HG2 ILE 104 -0.453 3.723 -5.376 542 1HD1 ILE 104 1HD1 ILE 104 -2.789 1.222 -4.160 543 2HD1 ILE 104 2HD1 ILE 104 -4.428 1.397 -3.534 544 3HD1 ILE 104 3HD1 ILE 104 -3.048 1.851 -2.534 545 H TYR 105 H TYR 105 -0.366 6.142 -5.780 546 HA TYR 105 HA TYR 105 -0.109 5.894 -8.684 547 1HB TYR 105 2HB TYR 105 0.458 8.007 -6.774 548 2HB TYR 105 1HB TYR 105 1.830 7.678 -7.834 549 HD1 TYR 105 1HD TYR 105 1.299 7.474 -10.342 550 HD2 TYR 105 2HD TYR 105 -1.248 9.372 -7.529 551 HE1 TYR 105 1HE TYR 105 0.211 8.675 -12.161 552 HE2 TYR 105 2HE TYR 105 -2.355 10.590 -9.336 553 HH TYR 105 HH TYR 105 -2.704 10.458 -11.717 554 H THR 106 H THR 106 2.076 5.701 -9.559 555 HA THR 106 HA THR 106 3.403 3.454 -8.392 556 HB THR 106 HB THR 106 5.151 4.289 -10.282 557 HG1 THR 106 1HG THR 106 3.699 6.160 -10.598 558 1HG2 THR 106 1HG2 THR 106 3.362 3.141 -11.923 559 2HG2 THR 106 2HG2 THR 106 2.756 2.592 -10.361 560 3HG2 THR 106 3HG2 THR 106 4.419 2.244 -10.834 561 H ILE 107 H ILE 107 5.631 3.355 -7.730 562 HA ILE 107 HA ILE 107 6.360 5.050 -5.728 563 HB ILE 107 HB ILE 107 7.439 2.865 -6.216 564 1HG1 ILE 107 2HG1 ILE 107 9.635 3.494 -5.359 565 2HG1 ILE 107 1HG1 ILE 107 9.375 5.162 -5.862 566 1HG2 ILE 107 1HG2 ILE 107 7.829 3.536 -8.676 567 2HG2 ILE 107 2HG2 ILE 107 9.052 2.565 -7.858 568 3HG2 ILE 107 3HG2 ILE 107 9.300 4.297 -8.071 569 1HD1 ILE 107 1HD1 ILE 107 9.038 4.612 -3.409 570 2HD1 ILE 107 2HD1 ILE 107 7.557 3.795 -3.911 571 3HD1 ILE 107 3HD1 ILE 107 7.760 5.522 -4.212 572 H ASP 108 H ASP 108 6.810 5.548 -9.143 573 HA ASP 108 HA ASP 108 8.492 7.892 -8.668 574 1HB ASP 108 2HB ASP 108 7.707 6.417 -11.183 575 2HB ASP 108 1HB ASP 108 8.585 7.944 -11.205 576 H GLY 109 H GLY 109 5.252 6.993 -9.514 577 1HA GLY 109 2HA GLY 109 3.398 8.430 -9.312 578 2HA GLY 109 1HA GLY 109 4.481 9.809 -9.439 579 H SER 110 H SER 110 4.864 7.269 -11.738 580 HA SER 110 HA SER 110 4.381 8.998 -13.922 581 1HB SER 110 2HB SER 110 5.053 6.122 -13.577 582 2HB SER 110 1HB SER 110 4.349 6.602 -15.120 583 HG SER 110 HG SER 110 6.577 7.897 -13.939 584 H ARG 111 H ARG 111 2.532 6.225 -12.651 585 HA ARG 111 HA ARG 111 0.101 7.421 -13.687 586 1HB ARG 111 2HB ARG 111 -0.578 5.122 -14.555 587 2HB ARG 111 1HB ARG 111 0.599 6.013 -15.511 588 1HG ARG 111 2HG ARG 111 1.685 4.047 -15.500 589 2HG ARG 111 1HG ARG 111 2.260 4.611 -13.929 590 1HD ARG 111 2HD ARG 111 0.394 3.413 -12.850 591 2HD ARG 111 1HD ARG 111 -0.106 2.806 -14.429 592 HE ARG 111 HE ARG 111 2.622 2.194 -13.776 593 1HH1 ARG 111 1HH1 ARG 111 -0.695 1.165 -13.433 594 2HH1 ARG 111 2HH1 ARG 111 -0.284 -0.498 -13.179 595 1HH2 ARG 111 1HH2 ARG 111 3.164 0.006 -13.442 596 2HH2 ARG 111 2HH2 ARG 111 1.907 -1.156 -13.182 597 H LYS 112 H LYS 112 -1.804 6.457 -12.812 598 HA LYS 112 HA LYS 112 -1.399 5.504 -10.084 599 1HB LYS 112 2HB LYS 112 -2.863 7.247 -9.886 600 2HB LYS 112 1HB LYS 112 -3.520 7.030 -11.493 601 1HG LYS 112 2HG LYS 112 -4.598 4.882 -10.389 602 2HG LYS 112 1HG LYS 112 -4.361 5.821 -8.916 603 1HD LYS 112 2HD LYS 112 -5.941 6.601 -11.363 604 2HD LYS 112 1HD LYS 112 -6.562 6.290 -9.741 605 1HE LYS 112 2HE LYS 112 -6.514 8.566 -9.681 606 2HE LYS 112 1HE LYS 112 -4.873 8.238 -9.126 607 1HZ LYS 112 1HZ LYS 112 -5.320 8.514 -12.005 608 2HZ LYS 112 2HZ LYS 112 -3.973 8.942 -11.077 609 3HZ LYS 112 3HZ LYS 112 -5.353 9.919 -11.064 610 H ILE 113 H ILE 113 -2.203 3.588 -9.322 611 HA ILE 113 HA ILE 113 -2.705 1.535 -11.276 612 HB ILE 113 HB ILE 113 -2.716 1.355 -8.262 613 1HG1 ILE 113 2HG1 ILE 113 -0.570 2.146 -9.503 614 2HG1 ILE 113 1HG1 ILE 113 -0.446 0.874 -8.294 615 1HG2 ILE 113 1HG2 ILE 113 -3.106 -0.606 -10.413 616 2HG2 ILE 113 2HG2 ILE 113 -3.637 -0.636 -8.731 617 3HG2 ILE 113 3HG2 ILE 113 -1.983 -1.090 -9.143 618 1HD1 ILE 113 1HD1 ILE 113 -0.930 -0.132 -10.981 619 2HD1 ILE 113 2HD1 ILE 113 0.272 -0.618 -9.782 620 3HD1 ILE 113 3HD1 ILE 113 0.573 0.778 -10.820 621 H GLY 114 H GLY 114 -4.566 0.429 -11.626 622 1HA GLY 114 2HA GLY 114 -6.971 1.411 -10.217 623 2HA GLY 114 1HA GLY 114 -6.957 0.997 -11.925 624 H SER 115 H SER 115 -5.175 -1.358 -11.314 625 HA SER 115 HA SER 115 -7.234 -3.094 -10.121 626 1HB SER 115 2HB SER 115 -6.703 -4.819 -11.720 627 2HB SER 115 1HB SER 115 -7.029 -3.332 -12.610 628 HG SER 115 HG SER 115 -5.061 -3.363 -13.330 629 H MET 116 H MET 116 -6.535 -4.911 -8.985 630 HA MET 116 HA MET 116 -4.272 -4.544 -7.362 631 1HB MET 116 2HB MET 116 -6.547 -6.081 -7.254 632 2HB MET 116 1HB MET 116 -5.296 -7.288 -7.511 633 1HG MET 116 2HG MET 116 -4.285 -6.870 -5.499 634 2HG MET 116 1HG MET 116 -4.896 -5.219 -5.411 635 1HE MET 116 1HE MET 116 -8.510 -5.529 -4.553 636 2HE MET 116 2HE MET 116 -7.191 -4.617 -5.285 637 3HE MET 116 3HE MET 116 -7.257 -4.821 -3.534 638 H ASP 117 H ASP 117 -4.754 -6.200 -10.373 639 HA ASP 117 HA ASP 117 -2.669 -8.028 -10.327 640 1HB ASP 117 2HB ASP 117 -4.448 -6.825 -12.281 641 2HB ASP 117 1HB ASP 117 -2.862 -7.149 -12.952 642 H GLU 118 H GLU 118 -2.566 -4.591 -10.496 643 HA GLU 118 HA GLU 118 0.076 -4.540 -11.706 644 1HB GLU 118 2HB GLU 118 -1.710 -2.354 -10.641 645 2HB GLU 118 1HB GLU 118 -0.116 -2.065 -11.324 646 1HG GLU 118 2HG GLU 118 -2.380 -3.383 -12.801 647 2HG GLU 118 1HG GLU 118 -1.989 -1.666 -12.898 648 H LEU 119 H LEU 119 -1.258 -4.789 -8.576 649 HA LEU 119 HA LEU 119 0.967 -3.565 -7.202 650 1HB LEU 119 2HB LEU 119 -0.939 -5.370 -5.802 651 2HB LEU 119 1HB LEU 119 -0.205 -3.877 -5.252 652 HG LEU 119 HG LEU 119 -2.445 -4.076 -7.260 653 1HD1 LEU 119 1HD1 LEU 119 -2.989 -4.681 -4.875 654 2HD1 LEU 119 2HD1 LEU 119 -3.905 -3.338 -5.555 655 3HD1 LEU 119 3HD1 LEU 119 -2.569 -3.023 -4.448 656 1HD2 LEU 119 1HD2 LEU 119 -2.522 -1.723 -7.256 657 2HD2 LEU 119 2HD2 LEU 119 -0.823 -2.144 -7.476 658 3HD2 LEU 119 3HD2 LEU 119 -1.403 -1.610 -5.899 659 H GLU 120 H GLU 120 2.875 -4.584 -7.271 660 HA GLU 120 HA GLU 120 2.933 -7.506 -7.083 661 1HB GLU 120 2HB GLU 120 5.301 -5.730 -7.610 662 2HB GLU 120 1HB GLU 120 5.101 -7.428 -7.993 663 1HG GLU 120 2HG GLU 120 3.670 -6.978 -9.790 664 2HG GLU 120 1HG GLU 120 3.408 -5.315 -9.268 665 H GLU 121 H GLU 121 4.290 -8.551 -5.566 666 HA GLU 121 HA GLU 121 4.204 -7.520 -2.974 667 1HB GLU 121 2HB GLU 121 5.916 -9.368 -2.485 668 2HB GLU 121 1HB GLU 121 4.347 -9.847 -3.117 669 1HG GLU 121 2HG GLU 121 6.400 -9.348 -5.148 670 2HG GLU 121 1HG GLU 121 6.720 -10.707 -4.072 671 H GLY 122 H GLY 122 6.099 -7.216 -1.513 672 1HA GLY 122 2HA GLY 122 7.799 -5.801 -0.897 673 2HA GLY 122 1HA GLY 122 8.670 -6.606 -2.185 674 H GLU 123 H GLU 123 5.840 -4.647 -2.820 675 HA GLU 123 HA GLU 123 7.555 -2.793 -4.311 676 1HB GLU 123 2HB GLU 123 4.640 -3.492 -4.494 677 2HB GLU 123 1HB GLU 123 5.285 -2.052 -5.264 678 1HG GLU 123 2HG GLU 123 6.159 -4.881 -5.795 679 2HG GLU 123 1HG GLU 123 5.138 -3.891 -6.835 680 H SER 124 H SER 124 6.653 -0.511 -4.467 681 HA SER 124 HA SER 124 5.716 0.428 -1.839 682 1HB SER 124 2HB SER 124 8.065 1.345 -3.460 683 2HB SER 124 1HB SER 124 7.198 2.514 -2.466 684 HG SER 124 HG SER 124 8.168 0.050 -1.461 685 H TYR 125 H TYR 125 4.052 1.841 -1.914 686 HA TYR 125 HA TYR 125 3.428 3.092 -4.496 687 1HB TYR 125 2HB TYR 125 1.612 1.496 -2.758 688 2HB TYR 125 1HB TYR 125 0.966 2.757 -3.784 689 HD1 TYR 125 1HD TYR 125 1.526 2.676 -6.246 690 HD2 TYR 125 2HD TYR 125 2.048 -0.648 -3.660 691 HE1 TYR 125 1HE TYR 125 1.564 1.201 -8.183 692 HE2 TYR 125 2HE TYR 125 2.078 -2.158 -5.597 693 HH TYR 125 HH TYR 125 0.956 -1.743 -8.274 694 H VAL 126 H VAL 126 2.004 4.872 -4.418 695 HA VAL 126 HA VAL 126 2.145 6.346 -1.857 696 HB VAL 126 HB VAL 126 2.919 7.238 -4.583 697 1HG1 VAL 126 1HG1 VAL 126 2.575 9.660 -3.694 698 2HG1 VAL 126 2HG1 VAL 126 1.328 8.925 -2.689 699 3HG1 VAL 126 3HG1 VAL 126 1.221 8.814 -4.445 700 1HG2 VAL 126 1HG2 VAL 126 3.900 8.585 -2.165 701 2HG2 VAL 126 2HG2 VAL 126 4.787 7.931 -3.544 702 3HG2 VAL 126 3HG2 VAL 126 4.242 6.856 -2.257 703 H CYS 127 H CYS 127 0.387 7.508 -1.218 704 HA CYS 127 HA CYS 127 -2.104 6.889 -2.595 705 1HB CYS 127 2HB CYS 127 -1.560 8.165 0.090 706 2HB CYS 127 1HB CYS 127 -3.164 7.818 -0.543 707 HG CYS 127 HG CYS 127 -1.133 5.675 0.398 708 H SER 128 H SER 128 -3.307 8.321 -3.682 709 HA SER 128 HA SER 128 -2.662 11.176 -3.463 710 1HB SER 128 2HB SER 128 -3.044 9.668 -6.063 711 2HB SER 128 1HB SER 128 -2.816 11.413 -5.906 712 HG SER 128 HG SER 128 -0.942 9.538 -4.915 713 H SER 129 H SER 129 -4.352 12.570 -4.402 714 HA SER 129 HA SER 129 -6.978 11.414 -4.768 715 1HB SER 129 2HB SER 129 -7.890 13.058 -2.976 716 2HB SER 129 1HB SER 129 -7.173 11.541 -2.433 717 HG SER 129 HG SER 129 -5.537 12.600 -1.588 718 H ASP 130 H ASP 130 -5.200 14.428 -4.170 719 HA ASP 130 HA ASP 130 -6.218 15.531 -6.655 720 1HB ASP 130 2HB ASP 130 -7.650 16.107 -4.424 721 2HB ASP 130 1HB ASP 130 -6.465 17.409 -4.384 722 H ASN 131 H ASN 131 -3.634 14.680 -5.611 723 HA ASN 131 HA ASN 131 -2.202 17.255 -5.578 724 1HB ASN 131 2HB ASN 131 -0.972 14.657 -4.712 725 2HB ASN 131 1HB ASN 131 -0.514 16.297 -4.266 726 1HD2 ASN 131 1HD2 ASN 131 -2.379 13.566 -3.480 727 2HD2 ASN 131 2HD2 ASN 131 -3.163 14.210 -2.081 728 H PHE 132 H PHE 132 -0.082 17.276 -6.644 729 HA PHE 132 HA PHE 132 -0.237 15.913 -9.211 730 1HB PHE 132 2HB PHE 132 1.702 18.032 -8.261 731 2HB PHE 132 1HB PHE 132 1.522 17.456 -9.915 732 HD1 PHE 132 1HD PHE 132 -0.277 19.188 -7.176 733 HD2 PHE 132 2HD PHE 132 -0.028 18.432 -11.357 734 HE1 PHE 132 1HE PHE 132 -1.983 20.914 -7.586 735 HE2 PHE 132 2HE PHE 132 -1.733 20.157 -11.774 736 HZ PHE 132 HZ PHE 132 -2.713 21.400 -9.887 737 H PHE 133 H PHE 133 0.720 14.717 -6.504 738 HA PHE 133 HA PHE 133 2.172 13.089 -5.873 739 1HB PHE 133 2HB PHE 133 1.703 12.168 -8.129 740 2HB PHE 133 1HB PHE 133 3.053 13.100 -8.764 741 HD1 PHE 133 1HD PHE 133 5.371 12.608 -7.898 742 HD2 PHE 133 2HD PHE 133 2.036 10.075 -7.140 743 HE1 PHE 133 1HE PHE 133 6.902 10.762 -7.349 744 HE2 PHE 133 2HE PHE 133 3.562 8.225 -6.589 745 HZ PHE 133 HZ PHE 133 5.998 8.568 -6.692 746 H LYS 134 H LYS 134 3.859 13.503 -4.623 747 HA LYS 134 HA LYS 134 5.858 15.448 -5.542 748 1HB LYS 134 2HB LYS 134 4.853 14.624 -2.849 749 2HB LYS 134 1HB LYS 134 6.480 15.278 -2.989 750 1HG LYS 134 2HG LYS 134 5.751 17.372 -3.453 751 2HG LYS 134 1HG LYS 134 4.308 16.802 -4.295 752 1HD LYS 134 2HD LYS 134 3.362 16.143 -2.084 753 2HD LYS 134 1HD LYS 134 4.758 16.898 -1.314 754 1HE LYS 134 2HE LYS 134 3.930 18.901 -2.936 755 2HE LYS 134 1HE LYS 134 2.393 18.119 -2.572 756 1HZ LYS 134 1HZ LYS 134 2.944 19.878 -0.987 757 2HZ LYS 134 2HZ LYS 134 4.350 19.049 -0.541 758 3HZ LYS 134 3HZ LYS 134 2.832 18.370 -0.228 759 H LYS 135 H LYS 135 7.817 14.777 -6.099 760 HA LYS 135 HA LYS 135 8.548 12.010 -5.794 761 1HB LYS 135 2HB LYS 135 9.526 14.337 -7.306 762 2HB LYS 135 1HB LYS 135 10.784 13.222 -6.790 763 1HG LYS 135 2HG LYS 135 10.173 12.473 -8.908 764 2HG LYS 135 1HG LYS 135 9.333 11.386 -7.802 765 1HD LYS 135 2HD LYS 135 7.460 11.885 -8.904 766 2HD LYS 135 1HD LYS 135 7.559 13.490 -8.176 767 1HE LYS 135 2HE LYS 135 8.704 14.365 -10.072 768 2HE LYS 135 1HE LYS 135 8.932 12.754 -10.753 769 1HZ LYS 135 1HZ LYS 135 6.609 14.485 -10.833 770 2HZ LYS 135 2HZ LYS 135 6.275 12.852 -10.543 771 3HZ LYS 135 3HZ LYS 135 7.122 13.308 -11.935 772 H VAL 136 H VAL 136 8.989 11.500 -3.703 773 HA VAL 136 HA VAL 136 11.217 12.956 -2.434 774 HB VAL 136 HB VAL 136 9.955 11.717 -0.327 775 1HG1 VAL 136 1HG1 VAL 136 9.227 13.994 0.290 776 2HG1 VAL 136 2HG1 VAL 136 9.638 14.535 -1.338 777 3HG1 VAL 136 3HG1 VAL 136 10.899 13.924 -0.266 778 1HG2 VAL 136 1HG2 VAL 136 7.795 12.913 -2.060 779 2HG2 VAL 136 2HG2 VAL 136 7.603 12.258 -0.433 780 3HG2 VAL 136 3HG2 VAL 136 8.019 11.188 -1.772 781 H GLU 137 H GLU 137 12.069 11.450 -0.511 782 HA GLU 137 HA GLU 137 13.093 9.116 -1.844 783 1HB GLU 137 2HB GLU 137 13.568 10.332 0.874 784 2HB GLU 137 1HB GLU 137 14.254 8.776 0.430 785 1HG GLU 137 2HG GLU 137 15.985 9.902 -0.372 786 2HG GLU 137 1HG GLU 137 14.929 10.411 -1.689 787 H TYR 138 H TYR 138 10.784 8.442 -2.023 788 HA TYR 138 HA TYR 138 9.255 7.407 0.027 789 1HB TYR 138 2HB TYR 138 9.618 6.718 -2.863 790 2HB TYR 138 1HB TYR 138 8.460 5.829 -1.865 791 HD1 TYR 138 1HD TYR 138 8.514 8.169 -4.262 792 HD2 TYR 138 2HD TYR 138 7.170 7.787 -0.244 793 HE1 TYR 138 1HE TYR 138 6.861 9.948 -4.653 794 HE2 TYR 138 2HE TYR 138 5.511 9.563 -0.624 795 HH TYR 138 HH TYR 138 5.130 11.439 -2.113 796 H THR 139 H THR 139 11.992 5.983 -1.671 797 HA THR 139 HA THR 139 12.171 3.921 0.389 798 HB THR 139 HB THR 139 12.367 2.103 -1.149 799 HG1 THR 139 1HG THR 139 12.976 2.419 -3.113 800 1HG2 THR 139 1HG2 THR 139 10.213 1.819 -1.599 801 2HG2 THR 139 2HG2 THR 139 10.144 3.252 -2.624 802 3HG2 THR 139 3HG2 THR 139 9.982 3.408 -0.876 803 H LYS 140 H LYS 140 13.658 6.385 -0.842 804 HA LYS 140 HA LYS 140 16.163 5.319 -1.722 805 1HB LYS 140 2HB LYS 140 14.981 7.965 -1.315 806 2HB LYS 140 1HB LYS 140 16.686 7.901 -0.894 807 1HG LYS 140 2HG LYS 140 17.346 7.591 -3.035 808 2HG LYS 140 1HG LYS 140 15.904 6.669 -3.464 809 1HD LYS 140 2HD LYS 140 14.725 9.000 -3.096 810 2HD LYS 140 1HD LYS 140 16.344 9.615 -3.434 811 1HE LYS 140 2HE LYS 140 15.698 7.587 -5.339 812 2HE LYS 140 1HE LYS 140 14.376 8.751 -5.271 813 1HZ LYS 140 1HZ LYS 140 15.799 9.655 -6.829 814 2HZ LYS 140 2HZ LYS 140 17.198 9.199 -5.994 815 3HZ LYS 140 3HZ LYS 140 16.254 10.480 -5.423 816 H ASN 141 H ASN 141 17.525 4.317 -0.499 817 HA ASN 141 HA ASN 141 18.923 3.823 1.204 818 1HB ASN 141 2HB ASN 141 18.006 6.332 2.608 819 2HB ASN 141 1HB ASN 141 19.521 5.462 2.835 820 1HD2 ASN 141 1HD2 ASN 141 17.812 7.777 0.970 821 2HD2 ASN 141 2HD2 ASN 141 19.114 8.228 -0.072 822 H VAL 142 H VAL 142 15.780 3.572 1.246 823 HA VAL 142 HA VAL 142 15.382 3.031 4.082 824 HB VAL 142 HB VAL 142 13.414 2.661 1.819 825 1HG1 VAL 142 1HG1 VAL 142 13.006 2.901 4.800 826 2HG1 VAL 142 2HG1 VAL 142 12.883 1.417 3.856 827 3HG1 VAL 142 3HG1 VAL 142 11.734 2.728 3.590 828 1HG2 VAL 142 1HG2 VAL 142 12.663 4.894 3.301 829 2HG2 VAL 142 2HG2 VAL 142 13.338 4.883 1.670 830 3HG2 VAL 142 3HG2 VAL 142 14.402 5.080 3.065 831 H ASN 143 H ASN 143 15.050 1.014 4.948 832 HA ASN 143 HA ASN 143 16.178 -1.196 3.511 833 1HB ASN 143 2HB ASN 143 15.623 -2.470 5.610 834 2HB ASN 143 1HB ASN 143 16.644 -1.056 5.856 835 1HD2 ASN 143 1HD2 ASN 143 14.606 -2.608 7.511 836 2HD2 ASN 143 2HD2 ASN 143 13.607 -1.372 8.188 837 HA PRO 144 HA PRO 144 12.094 -2.419 2.043 838 1HB PRO 144 2HB PRO 144 12.891 -3.845 -0.057 839 2HB PRO 144 1HB PRO 144 13.042 -2.083 -0.050 840 1HG PRO 144 2HG PRO 144 15.133 -4.168 0.394 841 2HG PRO 144 1HG PRO 144 15.250 -2.628 -0.475 842 1HD PRO 144 2HD PRO 144 16.089 -3.085 2.152 843 2HD PRO 144 1HD PRO 144 15.801 -1.494 1.420 844 H ASN 145 H ASN 145 13.501 -3.855 4.234 845 HA ASN 145 HA ASN 145 13.187 -6.657 3.539 846 1HB ASN 145 2HB ASN 145 13.982 -5.398 6.171 847 2HB ASN 145 1HB ASN 145 14.074 -7.111 5.769 848 1HD2 ASN 145 1HD2 ASN 145 16.333 -6.741 6.423 849 2HD2 ASN 145 2HD2 ASN 145 17.452 -6.202 5.222 850 H TRP 146 H TRP 146 10.915 -4.538 3.993 851 HA TRP 146 HA TRP 146 9.473 -5.584 6.229 852 1HB TRP 146 2HB TRP 146 7.517 -4.376 4.781 853 2HB TRP 146 1HB TRP 146 8.576 -3.538 5.904 854 HD1 TRP 146 HD TRP 146 10.427 -1.923 4.877 855 HE1 TRP 146 1HE TRP 146 10.674 -0.844 2.554 856 HE3 TRP 146 3HE TRP 146 7.120 -4.829 2.265 857 HZ2 TRP 146 2HZ TRP 146 9.613 -1.178 -0.039 858 HZ3 TRP 146 3HZ TRP 146 6.792 -4.375 -0.126 859 HH2 TRP 146 HH TRP 146 8.016 -2.593 -1.256 860 H SER 147 H SER 147 9.277 -6.049 2.722 861 HA SER 147 HA SER 147 7.162 -8.005 3.007 862 1HB SER 147 2HB SER 147 7.206 -8.146 0.589 863 2HB SER 147 1HB SER 147 7.277 -6.446 1.055 864 HG SER 147 HG SER 147 9.139 -8.002 -0.237 865 H VAL 148 H VAL 148 9.082 -8.959 4.529 866 HA VAL 148 HA VAL 148 9.931 -11.346 3.123 867 HB VAL 148 HB VAL 148 11.968 -9.723 4.643 868 1HG1 VAL 148 1HG1 VAL 148 12.357 -12.121 2.859 869 2HG1 VAL 148 2HG1 VAL 148 12.239 -12.205 4.616 870 3HG1 VAL 148 3HG1 VAL 148 13.568 -11.323 3.862 871 1HG2 VAL 148 1HG2 VAL 148 11.604 -10.036 1.664 872 2HG2 VAL 148 2HG2 VAL 148 13.002 -9.294 2.442 873 3HG2 VAL 148 3HG2 VAL 148 11.410 -8.553 2.598 874 H ASN 149 H ASN 149 9.820 -9.536 6.126 875 HA ASN 149 HA ASN 149 9.894 -12.000 7.681 876 1HB ASN 149 2HB ASN 149 9.948 -9.108 8.555 877 2HB ASN 149 1HB ASN 149 10.064 -10.492 9.638 878 1HD2 ASN 149 1HD2 ASN 149 12.073 -10.416 10.383 879 2HD2 ASN 149 2HD2 ASN 149 13.500 -10.360 9.410 880 H VAL 150 H VAL 150 8.250 -9.708 9.400 881 HA VAL 150 HA VAL 150 5.613 -10.583 8.472 882 HB VAL 150 HB VAL 150 4.874 -10.896 10.816 883 1HG1 VAL 150 1HG1 VAL 150 6.534 -12.985 11.142 884 2HG1 VAL 150 2HG1 VAL 150 6.846 -12.610 9.448 885 3HG1 VAL 150 3HG1 VAL 150 5.204 -12.969 9.985 886 1HG2 VAL 150 1HG2 VAL 150 6.890 -11.371 12.416 887 2HG2 VAL 150 2HG2 VAL 150 6.297 -9.724 12.195 888 3HG2 VAL 150 3HG2 VAL 150 7.743 -10.262 11.341 Start of MODEL 18 1 1H GLY 38 1HT GLY 38 4.008 -27.881 16.622 2 2H GLY 38 2HT GLY 38 4.919 -26.702 17.422 3 3H GLY 38 3HT GLY 38 3.748 -27.584 18.267 4 1HA GLY 38 1HA GLY 38 6.164 -28.249 18.607 5 2HA GLY 38 2HA GLY 38 4.995 -29.522 18.287 6 H ALA 39 H ALA 39 5.248 -30.795 16.531 7 HA ALA 39 HA ALA 39 6.241 -31.767 14.729 8 1HB ALA 39 1HB ALA 39 5.698 -30.250 13.158 9 2HB ALA 39 2HB ALA 39 7.418 -29.863 13.202 10 3HB ALA 39 3HB ALA 39 6.272 -28.891 14.124 11 H MET 40 H MET 40 8.513 -31.516 13.373 12 HA MET 40 HA MET 40 10.712 -30.963 15.190 13 1HB MET 40 2HB MET 40 9.685 -33.525 15.106 14 2HB MET 40 1HB MET 40 11.025 -33.603 13.970 15 1HG MET 40 2HG MET 40 11.710 -34.255 16.207 16 2HG MET 40 1HG MET 40 12.549 -32.797 15.677 17 1HE MET 40 1HE MET 40 11.736 -33.107 19.602 18 2HE MET 40 2HE MET 40 12.090 -34.289 18.342 19 3HE MET 40 3HE MET 40 10.442 -34.108 18.944 20 H ASP 41 H ASP 41 9.741 -32.286 12.042 21 HA ASP 41 HA ASP 41 11.567 -30.512 10.696 22 1HB ASP 41 2HB ASP 41 12.731 -32.354 9.471 23 2HB ASP 41 1HB ASP 41 13.126 -32.283 11.185 24 HA PRO 42 HA PRO 42 8.171 -30.900 7.845 25 1HB PRO 42 2HB PRO 42 9.157 -29.386 5.836 26 2HB PRO 42 1HB PRO 42 8.571 -28.685 7.350 27 1HG PRO 42 2HG PRO 42 11.381 -29.265 6.493 28 2HG PRO 42 1HG PRO 42 10.734 -27.827 7.304 29 1HD PRO 42 2HD PRO 42 12.044 -29.806 8.632 30 2HD PRO 42 1HD PRO 42 10.762 -28.831 9.378 31 H GLU 43 H GLU 43 7.770 -31.585 5.586 32 HA GLU 43 HA GLU 43 9.854 -32.927 4.143 33 1HB GLU 43 2HB GLU 43 8.181 -34.413 6.024 34 2HB GLU 43 1HB GLU 43 8.120 -35.066 4.392 35 1HG GLU 43 2HG GLU 43 10.442 -35.459 4.354 36 2HG GLU 43 1HG GLU 43 10.706 -34.486 5.800 37 H PHE 44 H PHE 44 9.209 -31.731 2.382 38 HA PHE 44 HA PHE 44 8.047 -31.238 0.493 39 1HB PHE 44 2HB PHE 44 7.537 -33.978 1.024 40 2HB PHE 44 1HB PHE 44 6.015 -33.265 0.500 41 HD1 PHE 44 1HD PHE 44 6.918 -31.254 -1.430 42 HD2 PHE 44 2HD PHE 44 8.277 -35.233 -0.768 43 HE1 PHE 44 1HE PHE 44 7.665 -31.385 -3.771 44 HE2 PHE 44 2HE PHE 44 9.028 -35.370 -3.107 45 HZ PHE 44 HZ PHE 44 8.723 -33.444 -4.612 46 H ALA 45 H ALA 45 7.311 -29.793 2.661 47 HA ALA 45 HA ALA 45 4.644 -29.012 1.976 48 1HB ALA 45 1HB ALA 45 3.441 -29.646 3.808 49 2HB ALA 45 2HB ALA 45 4.856 -29.692 4.860 50 3HB ALA 45 3HB ALA 45 4.565 -31.002 3.715 51 H LEU 46 H LEU 46 5.195 -26.932 1.700 52 HA LEU 46 HA LEU 46 5.766 -25.342 4.021 53 1HB LEU 46 2HB LEU 46 7.846 -24.411 3.343 54 2HB LEU 46 1HB LEU 46 8.022 -26.154 3.324 55 HG LEU 46 HG LEU 46 9.147 -25.412 1.407 56 1HD1 LEU 46 1HD1 LEU 46 8.072 -26.502 -0.339 57 2HD1 LEU 46 2HD1 LEU 46 6.468 -26.022 0.218 58 3HD1 LEU 46 3HD1 LEU 46 7.379 -27.248 1.101 59 1HD2 LEU 46 1HD2 LEU 46 7.694 -23.151 1.586 60 2HD2 LEU 46 2HD2 LEU 46 6.935 -23.905 0.183 61 3HD2 LEU 46 3HD2 LEU 46 8.669 -23.585 0.182 62 H SER 47 H SER 47 5.505 -23.081 3.646 63 HA SER 47 HA SER 47 4.800 -22.125 1.028 64 1HB SER 47 2HB SER 47 2.688 -22.725 3.070 65 2HB SER 47 1HB SER 47 2.475 -21.366 1.968 66 HG SER 47 HG SER 47 3.108 -23.976 1.075 67 H ASN 48 H ASN 48 4.611 -21.531 4.522 68 HA ASN 48 HA ASN 48 5.263 -19.752 5.784 69 1HB ASN 48 2HB ASN 48 6.858 -19.509 3.404 70 2HB ASN 48 1HB ASN 48 6.382 -17.906 3.953 71 1HD2 ASN 48 1HD2 ASN 48 7.576 -17.002 5.464 72 2HD2 ASN 48 2HD2 ASN 48 8.679 -17.821 6.511 73 H GLU 49 H GLU 49 4.396 -18.378 2.602 74 HA GLU 49 HA GLU 49 1.953 -17.278 3.627 75 1HB GLU 49 2HB GLU 49 4.202 -15.734 4.057 76 2HB GLU 49 1HB GLU 49 3.554 -15.072 2.564 77 1HG GLU 49 2HG GLU 49 1.617 -15.536 4.739 78 2HG GLU 49 1HG GLU 49 2.802 -14.256 4.997 79 H LYS 50 H LYS 50 0.986 -18.343 1.920 80 HA LYS 50 HA LYS 50 1.843 -17.772 -0.799 81 1HB LYS 50 2HB LYS 50 -0.007 -19.711 0.494 82 2HB LYS 50 1HB LYS 50 -0.340 -19.265 -1.174 83 1HG LYS 50 2HG LYS 50 1.883 -19.991 -1.834 84 2HG LYS 50 1HG LYS 50 2.258 -20.397 -0.157 85 1HD LYS 50 2HD LYS 50 0.951 -22.269 -0.173 86 2HD LYS 50 1HD LYS 50 -0.175 -21.604 -1.358 87 1HE LYS 50 2HE LYS 50 1.364 -22.006 -3.144 88 2HE LYS 50 1HE LYS 50 2.643 -22.448 -2.012 89 1HZ LYS 50 1HZ LYS 50 1.394 -24.391 -1.377 90 2HZ LYS 50 2HZ LYS 50 1.600 -24.385 -3.055 91 3HZ LYS 50 3HZ LYS 50 0.108 -23.951 -2.385 92 H LYS 51 H LYS 51 0.205 -17.156 -2.432 93 HA LYS 51 HA LYS 51 -1.235 -15.608 -3.273 94 1HB LYS 51 2HB LYS 51 -2.681 -16.522 -0.801 95 2HB LYS 51 1HB LYS 51 -3.378 -15.313 -1.871 96 1HG LYS 51 2HG LYS 51 -3.374 -16.865 -3.710 97 2HG LYS 51 1HG LYS 51 -2.528 -18.069 -2.734 98 1HD LYS 51 2HD LYS 51 -4.421 -18.272 -1.258 99 2HD LYS 51 1HD LYS 51 -5.253 -16.952 -2.081 100 1HE LYS 51 2HE LYS 51 -4.423 -19.106 -3.870 101 2HE LYS 51 1HE LYS 51 -5.555 -19.627 -2.623 102 1HZ LYS 51 1HZ LYS 51 -6.712 -17.374 -3.433 103 2HZ LYS 51 2HZ LYS 51 -7.058 -18.888 -4.101 104 3HZ LYS 51 3HZ LYS 51 -5.973 -17.851 -4.878 105 H ALA 52 H ALA 52 -2.437 -13.506 -2.770 106 HA ALA 52 HA ALA 52 -2.468 -11.374 -1.970 107 1HB ALA 52 1HB ALA 52 -2.189 -11.007 0.250 108 2HB ALA 52 2HB ALA 52 -0.696 -11.942 0.331 109 3HB ALA 52 3HB ALA 52 -2.252 -12.770 0.283 110 H LYS 53 H LYS 53 -0.956 -9.518 -1.433 111 HA LYS 53 HA LYS 53 1.759 -9.957 -2.455 112 1HB LYS 53 2HB LYS 53 0.067 -7.629 -3.362 113 2HB LYS 53 1HB LYS 53 1.630 -8.134 -3.987 114 1HG LYS 53 2HG LYS 53 -0.454 -10.175 -4.203 115 2HG LYS 53 1HG LYS 53 -0.777 -8.703 -5.119 116 1HD LYS 53 2HD LYS 53 1.582 -8.928 -6.029 117 2HD LYS 53 1HD LYS 53 1.591 -10.549 -5.331 118 1HE LYS 53 2HE LYS 53 -0.258 -11.217 -6.696 119 2HE LYS 53 1HE LYS 53 -0.502 -9.565 -7.264 120 1HZ LYS 53 1HZ LYS 53 2.093 -10.852 -7.733 121 2HZ LYS 53 2HZ LYS 53 1.290 -9.682 -8.655 122 3HZ LYS 53 3HZ LYS 53 0.782 -11.294 -8.708 123 H LYS 54 H LYS 54 3.288 -8.819 -1.371 124 HA LYS 54 HA LYS 54 2.402 -7.162 0.833 125 1HB LYS 54 2HB LYS 54 5.051 -8.417 0.128 126 2HB LYS 54 1HB LYS 54 4.872 -7.272 1.451 127 1HG LYS 54 2HG LYS 54 3.309 -9.833 1.232 128 2HG LYS 54 1HG LYS 54 4.823 -9.670 2.125 129 1HD LYS 54 2HD LYS 54 3.751 -7.855 3.462 130 2HD LYS 54 1HD LYS 54 2.229 -8.226 2.649 131 1HE LYS 54 2HE LYS 54 2.393 -10.546 3.495 132 2HE LYS 54 1HE LYS 54 3.849 -10.092 4.379 133 1HZ LYS 54 1HZ LYS 54 1.069 -9.513 4.965 134 2HZ LYS 54 2HZ LYS 54 2.140 -8.230 5.221 135 3HZ LYS 54 3HZ LYS 54 2.382 -9.703 6.017 136 H VAL 55 H VAL 55 2.384 -5.075 0.701 137 HA VAL 55 HA VAL 55 4.307 -3.704 -1.056 138 HB VAL 55 HB VAL 55 2.565 -2.025 -1.612 139 1HG1 VAL 55 1HG1 VAL 55 1.487 -4.620 -2.574 140 2HG1 VAL 55 2HG1 VAL 55 3.152 -4.188 -2.969 141 3HG1 VAL 55 3HG1 VAL 55 1.825 -3.131 -3.456 142 1HG2 VAL 55 1HG2 VAL 55 0.836 -3.950 -0.113 143 2HG2 VAL 55 2HG2 VAL 55 0.166 -2.894 -1.357 144 3HG2 VAL 55 3HG2 VAL 55 0.965 -2.197 0.058 145 H ARG 56 H ARG 56 4.805 -1.571 -0.491 146 HA ARG 56 HA ARG 56 4.243 -0.905 2.317 147 1HB ARG 56 2HB ARG 56 6.679 -1.227 1.484 148 2HB ARG 56 1HB ARG 56 6.451 0.314 0.666 149 1HG ARG 56 2HG ARG 56 7.408 0.984 2.637 150 2HG ARG 56 1HG ARG 56 5.694 1.132 3.024 151 1HD ARG 56 2HD ARG 56 5.740 -1.050 4.108 152 2HD ARG 56 1HD ARG 56 7.443 -1.231 3.694 153 HE ARG 56 HE ARG 56 6.372 0.210 5.894 154 1HH1 ARG 56 1HH1 ARG 56 8.973 0.244 3.567 155 2HH1 ARG 56 2HH1 ARG 56 10.049 1.127 4.597 156 1HH2 ARG 56 1HH2 ARG 56 7.786 1.371 7.249 157 2HH2 ARG 56 2HH2 ARG 56 9.376 1.767 6.686 158 H PHE 57 H PHE 57 2.526 0.422 2.333 159 HA PHE 57 HA PHE 57 2.106 2.234 0.113 160 1HB PHE 57 2HB PHE 57 0.446 1.468 2.502 161 2HB PHE 57 1HB PHE 57 -0.022 2.776 1.425 162 HD1 PHE 57 1HD PHE 57 -1.833 0.584 1.844 163 HD2 PHE 57 2HD PHE 57 1.405 0.873 -0.910 164 HE1 PHE 57 1HE PHE 57 -2.941 -1.034 0.361 165 HE2 PHE 57 2HE PHE 57 0.293 -0.727 -2.390 166 HZ PHE 57 HZ PHE 57 -1.883 -1.688 -1.759 167 H TYR 58 H TYR 58 2.510 4.267 0.061 168 HA TYR 58 HA TYR 58 3.197 5.721 2.526 169 1HB TYR 58 2HB TYR 58 4.278 6.317 -0.217 170 2HB TYR 58 1HB TYR 58 4.776 7.036 1.296 171 HD1 TYR 58 1HD TYR 58 6.220 5.820 2.846 172 HD2 TYR 58 2HD TYR 58 5.091 4.126 -0.888 173 HE1 TYR 58 1HE TYR 58 8.019 4.158 3.062 174 HE2 TYR 58 2HE TYR 58 6.880 2.455 -0.679 175 HH TYR 58 HH TYR 58 9.406 2.726 1.429 176 H ARG 59 H ARG 59 2.473 7.833 2.686 177 HA ARG 59 HA ARG 59 0.226 8.466 0.913 178 1HB ARG 59 2HB ARG 59 0.975 9.876 3.478 179 2HB ARG 59 1HB ARG 59 -0.562 9.945 2.626 180 1HG ARG 59 2HG ARG 59 -1.172 8.469 4.210 181 2HG ARG 59 1HG ARG 59 -0.439 7.310 3.099 182 1HD ARG 59 2HD ARG 59 0.313 6.988 5.419 183 2HD ARG 59 1HD ARG 59 1.639 7.396 4.336 184 HE ARG 59 HE ARG 59 1.886 9.426 5.417 185 1HH1 ARG 59 1HH1 ARG 59 -0.951 7.768 6.602 186 2HH1 ARG 59 2HH1 ARG 59 -1.138 8.810 7.972 187 1HH2 ARG 59 1HH2 ARG 59 1.632 10.798 7.214 188 2HH2 ARG 59 2HH2 ARG 59 0.323 10.532 8.316 189 H ASN 60 H ASN 60 0.604 9.782 -0.720 190 HA ASN 60 HA ASN 60 2.882 11.041 -1.415 191 1HB ASN 60 2HB ASN 60 1.070 10.914 -2.963 192 2HB ASN 60 1HB ASN 60 0.048 11.918 -1.945 193 1HD2 ASN 60 1HD2 ASN 60 -0.139 13.039 -4.068 194 2HD2 ASN 60 2HD2 ASN 60 1.007 14.283 -4.414 195 H GLY 61 H GLY 61 4.077 12.693 -0.793 196 1HA GLY 61 2HA GLY 61 4.735 14.649 0.223 197 2HA GLY 61 1HA GLY 61 3.037 15.091 0.332 198 H ASP 62 H ASP 62 5.651 13.344 1.903 199 HA ASP 62 HA ASP 62 4.413 13.896 4.481 200 1HB ASP 62 2HB ASP 62 4.973 11.506 5.207 201 2HB ASP 62 1HB ASP 62 3.556 11.716 4.183 202 H ARG 63 H ARG 63 7.173 12.288 2.903 203 HA ARG 63 HA ARG 63 9.399 12.245 3.400 204 1HB ARG 63 2HB ARG 63 8.673 15.093 4.067 205 2HB ARG 63 1HB ARG 63 10.332 14.512 4.071 206 1HG ARG 63 2HG ARG 63 10.464 14.468 1.830 207 2HG ARG 63 1HG ARG 63 8.794 13.935 1.633 208 1HD ARG 63 2HD ARG 63 8.336 16.015 0.974 209 2HD ARG 63 1HD ARG 63 8.552 16.491 2.658 210 HE ARG 63 HE ARG 63 11.002 16.411 1.160 211 1HH1 ARG 63 1HH1 ARG 63 8.236 18.361 2.013 212 2HH1 ARG 63 2HH1 ARG 63 9.050 19.863 1.728 213 1HH2 ARG 63 1HH2 ARG 63 12.075 18.387 0.786 214 2HH2 ARG 63 2HH2 ARG 63 11.228 19.878 1.032 215 H TYR 64 H TYR 64 7.464 11.574 5.604 216 HA TYR 64 HA TYR 64 9.423 11.554 7.743 217 1HB TYR 64 2HB TYR 64 6.879 13.080 7.790 218 2HB TYR 64 1HB TYR 64 7.279 12.169 9.237 219 HD1 TYR 64 1HD TYR 64 8.861 13.002 10.780 220 HD2 TYR 64 2HD TYR 64 8.562 14.758 6.916 221 HE1 TYR 64 1HE TYR 64 10.364 14.814 11.492 222 HE2 TYR 64 2HE TYR 64 10.063 16.573 7.616 223 HH TYR 64 HH TYR 64 10.627 17.543 10.352 224 H PHE 65 H PHE 65 6.128 10.710 6.761 225 HA PHE 65 HA PHE 65 5.992 8.414 8.470 226 1HB PHE 65 2HB PHE 65 4.016 9.815 7.697 227 2HB PHE 65 1HB PHE 65 4.198 9.049 6.123 228 HD1 PHE 65 1HD PHE 65 3.018 7.133 5.677 229 HD2 PHE 65 2HD PHE 65 3.812 8.168 9.725 230 HE1 PHE 65 1HE PHE 65 1.624 5.250 6.424 231 HE2 PHE 65 2HE PHE 65 2.421 6.285 10.484 232 HZ PHE 65 HZ PHE 65 1.323 4.823 8.833 233 H LYS 66 H LYS 66 6.870 6.513 8.062 234 HA LYS 66 HA LYS 66 8.114 5.960 5.547 235 1HB LYS 66 2HB LYS 66 7.725 3.973 7.770 236 2HB LYS 66 1HB LYS 66 9.026 4.051 6.586 237 1HG LYS 66 2HG LYS 66 9.014 6.498 8.022 238 2HG LYS 66 1HG LYS 66 8.923 5.176 9.190 239 1HD LYS 66 2HD LYS 66 11.221 5.519 8.871 240 2HD LYS 66 1HD LYS 66 10.843 4.115 7.871 241 1HE LYS 66 2HE LYS 66 11.564 5.167 6.053 242 2HE LYS 66 1HE LYS 66 10.453 6.504 6.344 243 1HZ LYS 66 1HZ LYS 66 13.241 6.206 7.285 244 2HZ LYS 66 2HZ LYS 66 12.180 7.322 7.983 245 3HZ LYS 66 3HZ LYS 66 12.579 7.446 6.344 246 H GLY 67 H GLY 67 4.955 5.695 6.517 247 1HA GLY 67 2HA GLY 67 3.216 4.888 5.173 248 2HA GLY 67 1HA GLY 67 4.380 3.913 4.293 249 H ILE 68 H ILE 68 2.149 2.669 4.795 250 HA ILE 68 HA ILE 68 2.752 0.914 7.084 251 HB ILE 68 HB ILE 68 0.738 2.166 7.592 252 1HG1 ILE 68 2HG1 ILE 68 -0.292 -0.530 6.775 253 2HG1 ILE 68 1HG1 ILE 68 0.979 -0.407 7.987 254 1HG2 ILE 68 1HG2 ILE 68 0.256 2.321 4.970 255 2HG2 ILE 68 2HG2 ILE 68 -0.997 2.559 6.191 256 3HG2 ILE 68 3HG2 ILE 68 -0.836 0.999 5.379 257 1HD1 ILE 68 1HD1 ILE 68 -1.464 1.246 8.325 258 2HD1 ILE 68 2HD1 ILE 68 -0.405 0.528 9.539 259 3HD1 ILE 68 3HD1 ILE 68 -1.552 -0.483 8.661 260 H VAL 69 H VAL 69 2.711 -1.262 6.725 261 HA VAL 69 HA VAL 69 2.747 -2.108 3.957 262 HB VAL 69 HB VAL 69 3.153 -3.819 6.411 263 1HG1 VAL 69 1HG1 VAL 69 4.634 -5.024 4.621 264 2HG1 VAL 69 2HG1 VAL 69 3.573 -4.196 3.481 265 3HG1 VAL 69 3HG1 VAL 69 2.894 -5.304 4.672 266 1HG2 VAL 69 1HG2 VAL 69 5.243 -3.058 6.670 267 2HG2 VAL 69 2HG2 VAL 69 4.706 -1.662 5.737 268 3HG2 VAL 69 3HG2 VAL 69 5.534 -2.995 4.932 269 H TYR 70 H TYR 70 1.243 -3.284 2.926 270 HA TYR 70 HA TYR 70 -0.936 -4.471 4.456 271 1HB TYR 70 2HB TYR 70 -1.124 -2.231 2.605 272 2HB TYR 70 1HB TYR 70 -2.150 -3.576 2.119 273 HD1 TYR 70 1HD TYR 70 -4.319 -3.382 2.798 274 HD2 TYR 70 2HD TYR 70 -1.256 -1.912 5.360 275 HE1 TYR 70 1HE TYR 70 -6.022 -2.710 4.438 276 HE2 TYR 70 2HE TYR 70 -2.952 -1.235 7.008 277 HH TYR 70 HH TYR 70 -6.334 -1.264 6.285 278 H ALA 71 H ALA 71 -1.908 -6.210 3.526 279 HA ALA 71 HA ALA 71 -0.411 -7.488 1.350 280 1HB ALA 71 1HB ALA 71 -0.466 -8.780 3.407 281 2HB ALA 71 2HB ALA 71 -1.388 -9.595 2.144 282 3HB ALA 71 3HB ALA 71 -2.229 -8.717 3.421 283 H VAL 72 H VAL 72 -1.329 -7.342 -0.568 284 HA VAL 72 HA VAL 72 -4.195 -6.902 -0.768 285 HB VAL 72 HB VAL 72 -2.414 -6.812 -3.159 286 1HG1 VAL 72 1HG1 VAL 72 -4.881 -5.369 -2.222 287 2HG1 VAL 72 2HG1 VAL 72 -4.720 -6.481 -3.582 288 3HG1 VAL 72 3HG1 VAL 72 -3.972 -4.885 -3.653 289 1HG2 VAL 72 1HG2 VAL 72 -2.314 -4.967 -0.834 290 2HG2 VAL 72 2HG2 VAL 72 -2.241 -4.265 -2.450 291 3HG2 VAL 72 3HG2 VAL 72 -1.036 -5.450 -1.949 292 H SER 73 H SER 73 -5.471 -8.464 -1.216 293 HA SER 73 HA SER 73 -4.804 -10.509 -3.151 294 1HB SER 73 2HB SER 73 -5.887 -11.984 -0.982 295 2HB SER 73 1HB SER 73 -4.279 -12.126 -1.692 296 HG SER 73 HG SER 73 -5.021 -11.068 0.688 297 H SER 74 H SER 74 -6.629 -11.700 -3.886 298 HA SER 74 HA SER 74 -8.987 -10.198 -4.090 299 1HB SER 74 2HB SER 74 -7.995 -12.162 -5.563 300 2HB SER 74 1HB SER 74 -9.062 -13.146 -4.563 301 HG SER 74 HG SER 74 -10.541 -12.530 -5.918 302 H ASP 75 H ASP 75 -7.943 -12.320 -1.616 303 HA ASP 75 HA ASP 75 -10.570 -13.057 -0.716 304 1HB ASP 75 2HB ASP 75 -7.811 -13.743 -0.108 305 2HB ASP 75 1HB ASP 75 -8.776 -13.546 1.343 306 H ARG 76 H ARG 76 -8.247 -10.542 -0.078 307 HA ARG 76 HA ARG 76 -9.705 -9.647 2.286 308 1HB ARG 76 2HB ARG 76 -7.009 -9.548 1.506 309 2HB ARG 76 1HB ARG 76 -7.570 -7.883 1.465 310 1HG ARG 76 2HG ARG 76 -7.213 -7.807 3.649 311 2HG ARG 76 1HG ARG 76 -8.587 -8.898 3.842 312 1HD ARG 76 2HD ARG 76 -7.107 -10.820 3.706 313 2HD ARG 76 1HD ARG 76 -5.725 -9.759 3.436 314 HE ARG 76 HE ARG 76 -6.885 -8.963 5.820 315 1HH1 ARG 76 1HH1 ARG 76 -5.352 -11.824 4.539 316 2HH1 ARG 76 2HH1 ARG 76 -4.749 -12.342 6.078 317 1HH2 ARG 76 1HH2 ARG 76 -6.094 -9.642 7.844 318 2HH2 ARG 76 2HH2 ARG 76 -5.172 -11.104 7.955 319 H PHE 77 H PHE 77 -8.802 -8.478 -0.938 320 HA PHE 77 HA PHE 77 -11.034 -6.575 -0.788 321 1HB PHE 77 2HB PHE 77 -8.473 -5.869 -2.193 322 2HB PHE 77 1HB PHE 77 -9.766 -4.801 -1.659 323 HD1 PHE 77 1HD PHE 77 -10.019 -4.287 0.752 324 HD2 PHE 77 2HD PHE 77 -6.689 -6.464 -0.756 325 HE1 PHE 77 1HE PHE 77 -8.789 -3.838 2.834 326 HE2 PHE 77 2HE PHE 77 -5.451 -6.020 1.325 327 HZ PHE 77 HZ PHE 77 -6.502 -4.706 3.124 328 H ARG 78 H ARG 78 -12.433 -6.902 -2.362 329 HA ARG 78 HA ARG 78 -11.993 -8.732 -4.454 330 1HB ARG 78 2HB ARG 78 -14.161 -7.108 -3.407 331 2HB ARG 78 1HB ARG 78 -14.201 -7.205 -5.154 332 1HG ARG 78 2HG ARG 78 -14.077 -9.577 -3.309 333 2HG ARG 78 1HG ARG 78 -15.550 -8.946 -4.047 334 1HD ARG 78 2HD ARG 78 -14.426 -9.289 -6.282 335 2HD ARG 78 1HD ARG 78 -13.170 -10.176 -5.419 336 HE ARG 78 HE ARG 78 -14.613 -11.942 -5.195 337 1HH1 ARG 78 1HH1 ARG 78 -16.414 -9.121 -6.185 338 2HH1 ARG 78 2HH1 ARG 78 -17.876 -10.002 -6.473 339 1HH2 ARG 78 1HH2 ARG 78 -16.536 -13.102 -5.572 340 2HH2 ARG 78 2HH2 ARG 78 -17.947 -12.261 -6.124 341 H SER 79 H SER 79 -11.398 -5.336 -4.178 342 HA SER 79 HA SER 79 -10.181 -5.279 -6.767 343 1HB SER 79 2HB SER 79 -11.595 -3.687 -7.861 344 2HB SER 79 1HB SER 79 -12.633 -4.995 -7.293 345 HG SER 79 HG SER 79 -12.950 -3.583 -5.380 346 H PHE 80 H PHE 80 -9.616 -2.866 -7.329 347 HA PHE 80 HA PHE 80 -7.933 -1.917 -5.301 348 1HB PHE 80 2HB PHE 80 -8.216 -1.442 -7.991 349 2HB PHE 80 1HB PHE 80 -8.738 0.087 -7.295 350 HD1 PHE 80 1HD PHE 80 -6.025 -2.396 -6.663 351 HD2 PHE 80 2HD PHE 80 -7.096 1.687 -7.177 352 HE1 PHE 80 1HE PHE 80 -3.675 -1.746 -6.367 353 HE2 PHE 80 2HE PHE 80 -4.749 2.344 -6.889 354 HZ PHE 80 HZ PHE 80 -3.031 0.624 -6.483 355 H ASP 81 H ASP 81 -11.202 -1.023 -6.225 356 HA ASP 81 HA ASP 81 -11.411 1.362 -4.752 357 1HB ASP 81 2HB ASP 81 -13.042 0.113 -6.482 358 2HB ASP 81 1HB ASP 81 -13.813 -0.376 -4.976 359 H ALA 82 H ALA 82 -12.076 -2.000 -3.894 360 HA ALA 82 HA ALA 82 -13.045 -1.464 -1.284 361 1HB ALA 82 1HB ALA 82 -11.937 -4.025 -1.277 362 2HB ALA 82 2HB ALA 82 -12.519 -3.759 -2.921 363 3HB ALA 82 3HB ALA 82 -13.621 -3.583 -1.555 364 H LEU 83 H LEU 83 -9.859 -2.177 -2.611 365 HA LEU 83 HA LEU 83 -8.506 -2.475 -0.143 366 1HB LEU 83 2HB LEU 83 -7.573 -3.160 -2.335 367 2HB LEU 83 1HB LEU 83 -7.455 -1.476 -2.797 368 HG LEU 83 HG LEU 83 -5.869 -1.131 -0.889 369 1HD1 LEU 83 1HD1 LEU 83 -5.574 -4.107 -0.801 370 2HD1 LEU 83 2HD1 LEU 83 -6.717 -3.280 0.257 371 3HD1 LEU 83 3HD1 LEU 83 -4.999 -2.893 0.341 372 1HD2 LEU 83 1HD2 LEU 83 -4.105 -2.769 -2.089 373 2HD2 LEU 83 2HD2 LEU 83 -4.636 -1.232 -2.773 374 3HD2 LEU 83 3HD2 LEU 83 -5.380 -2.739 -3.308 375 H LEU 84 H LEU 84 -8.962 0.221 -2.356 376 HA LEU 84 HA LEU 84 -7.637 2.184 -0.868 377 1HB LEU 84 2HB LEU 84 -9.817 2.261 -2.929 378 2HB LEU 84 1HB LEU 84 -9.268 3.737 -2.150 379 HG LEU 84 HG LEU 84 -7.475 1.848 -3.671 380 1HD1 LEU 84 1HD1 LEU 84 -8.532 2.719 -5.451 381 2HD1 LEU 84 2HD1 LEU 84 -7.518 4.124 -5.118 382 3HD1 LEU 84 3HD1 LEU 84 -9.183 4.078 -4.535 383 1HD2 LEU 84 1HD2 LEU 84 -6.149 2.985 -2.125 384 2HD2 LEU 84 2HD2 LEU 84 -7.068 4.481 -2.301 385 3HD2 LEU 84 3HD2 LEU 84 -6.006 3.942 -3.601 386 H ALA 85 H ALA 85 -10.918 0.890 -0.674 387 HA ALA 85 HA ALA 85 -11.992 2.890 1.021 388 1HB ALA 85 1HB ALA 85 -12.750 -0.024 0.965 389 2HB ALA 85 2HB ALA 85 -13.299 1.157 -0.224 390 3HB ALA 85 3HB ALA 85 -13.754 1.333 1.471 391 H ASP 86 H ASP 86 -10.411 -0.205 1.697 392 HA ASP 86 HA ASP 86 -10.578 0.058 4.534 393 1HB ASP 86 2HB ASP 86 -10.303 -2.114 3.233 394 2HB ASP 86 1HB ASP 86 -8.617 -1.658 3.003 395 H LEU 87 H LEU 87 -8.269 0.888 2.055 396 HA LEU 87 HA LEU 87 -6.056 1.459 3.698 397 1HB LEU 87 2HB LEU 87 -6.907 2.399 0.971 398 2HB LEU 87 1HB LEU 87 -5.473 3.058 1.725 399 HG LEU 87 HG LEU 87 -5.939 0.360 0.568 400 1HD1 LEU 87 1HD1 LEU 87 -3.337 1.796 0.724 401 2HD1 LEU 87 2HD1 LEU 87 -4.595 2.398 -0.355 402 3HD1 LEU 87 3HD1 LEU 87 -3.980 0.757 -0.548 403 1HD2 LEU 87 1HD2 LEU 87 -5.422 -0.204 2.877 404 2HD2 LEU 87 2HD2 LEU 87 -4.017 0.863 2.840 405 3HD2 LEU 87 3HD2 LEU 87 -4.054 -0.582 1.831 406 H THR 88 H THR 88 -8.818 3.412 2.734 407 HA THR 88 HA THR 88 -7.884 5.885 3.656 408 HB THR 88 HB THR 88 -10.741 5.480 4.113 409 HG1 THR 88 1HG THR 88 -11.302 4.825 2.110 410 1HG2 THR 88 1HG2 THR 88 -9.079 7.237 2.356 411 2HG2 THR 88 2HG2 THR 88 -10.127 7.679 3.705 412 3HG2 THR 88 3HG2 THR 88 -10.830 7.150 2.176 413 H ARG 89 H ARG 89 -9.548 3.240 5.288 414 HA ARG 89 HA ARG 89 -9.857 4.552 7.780 415 1HB ARG 89 2HB ARG 89 -9.807 1.609 7.107 416 2HB ARG 89 1HB ARG 89 -10.323 2.282 8.648 417 1HG ARG 89 2HG ARG 89 -11.778 3.604 6.612 418 2HG ARG 89 1HG ARG 89 -11.841 1.871 6.284 419 1HD ARG 89 2HD ARG 89 -12.271 1.867 8.938 420 2HD ARG 89 1HD ARG 89 -12.976 3.427 8.517 421 HE ARG 89 HE ARG 89 -13.996 0.817 7.848 422 1HH1 ARG 89 1HH1 ARG 89 -14.016 4.208 7.024 423 2HH1 ARG 89 2HH1 ARG 89 -15.553 4.134 6.230 424 1HH2 ARG 89 1HH2 ARG 89 -16.016 0.718 6.803 425 2HH2 ARG 89 2HH2 ARG 89 -16.689 2.153 6.106 426 H SER 90 H SER 90 -7.423 2.208 6.591 427 HA SER 90 HA SER 90 -5.999 2.233 9.085 428 1HB SER 90 2HB SER 90 -6.000 0.640 6.755 429 2HB SER 90 1HB SER 90 -4.366 1.286 6.919 430 HG SER 90 HG SER 90 -4.887 -0.740 8.079 431 H LEU 91 H LEU 91 -5.561 3.805 5.958 432 HA LEU 91 HA LEU 91 -3.129 5.070 6.904 433 1HB LEU 91 2HB LEU 91 -4.298 4.382 4.322 434 2HB LEU 91 1HB LEU 91 -3.584 5.971 4.356 435 HG LEU 91 HG LEU 91 -2.247 3.323 4.830 436 1HD1 LEU 91 1HD1 LEU 91 -1.091 5.390 3.083 437 2HD1 LEU 91 2HD1 LEU 91 -2.607 4.673 2.539 438 3HD1 LEU 91 3HD1 LEU 91 -1.211 3.644 2.861 439 1HD2 LEU 91 1HD2 LEU 91 -1.392 6.045 5.691 440 2HD2 LEU 91 2HD2 LEU 91 -0.178 4.891 5.138 441 3HD2 LEU 91 3HD2 LEU 91 -1.214 4.495 6.511 442 H SER 92 H SER 92 -6.340 5.729 7.138 443 HA SER 92 HA SER 92 -7.039 8.143 6.279 444 1HB SER 92 2HB SER 92 -7.787 8.485 8.873 445 2HB SER 92 1HB SER 92 -8.646 7.460 7.726 446 HG SER 92 HG SER 92 -6.755 6.701 9.686 447 H ASP 93 H ASP 93 -6.528 10.234 6.456 448 HA ASP 93 HA ASP 93 -4.756 11.197 8.534 449 1HB ASP 93 2HB ASP 93 -3.831 10.538 5.854 450 2HB ASP 93 1HB ASP 93 -3.520 12.220 6.249 451 H ASN 94 H ASN 94 -4.067 13.625 7.183 452 HA ASN 94 HA ASN 94 -6.460 14.865 6.197 453 1HB ASN 94 2HB ASN 94 -5.876 14.937 9.037 454 2HB ASN 94 1HB ASN 94 -5.900 16.559 8.350 455 1HD2 ASN 94 1HD2 ASN 94 -7.785 17.395 8.901 456 2HD2 ASN 94 2HD2 ASN 94 -9.326 16.655 8.660 457 H ILE 95 H ILE 95 -3.131 15.117 7.301 458 HA ILE 95 HA ILE 95 -2.784 17.642 5.890 459 HB ILE 95 HB ILE 95 -0.914 16.051 7.656 460 1HG1 ILE 95 2HG1 ILE 95 -1.642 18.770 8.451 461 2HG1 ILE 95 1HG1 ILE 95 -3.028 17.689 8.359 462 1HG2 ILE 95 1HG2 ILE 95 0.343 17.223 5.963 463 2HG2 ILE 95 2HG2 ILE 95 0.571 17.995 7.532 464 3HG2 ILE 95 3HG2 ILE 95 -0.502 18.724 6.338 465 1HD1 ILE 95 1HD1 ILE 95 -0.704 16.565 9.735 466 2HD1 ILE 95 2HD1 ILE 95 -2.410 16.552 10.180 467 3HD1 ILE 95 3HD1 ILE 95 -1.421 17.972 10.518 468 H ASN 96 H ASN 96 -1.881 14.254 5.813 469 HA ASN 96 HA ASN 96 -0.224 14.644 3.442 470 1HB ASN 96 2HB ASN 96 -0.805 12.162 5.077 471 2HB ASN 96 1HB ASN 96 0.302 12.239 3.713 472 1HD2 ASN 96 1HD2 ASN 96 -0.111 12.737 7.041 473 2HD2 ASN 96 2HD2 ASN 96 1.459 13.368 7.386 474 H LEU 97 H LEU 97 -3.282 13.314 4.478 475 HA LEU 97 HA LEU 97 -4.008 12.871 1.663 476 1HB LEU 97 2HB LEU 97 -4.371 11.053 4.010 477 2HB LEU 97 1HB LEU 97 -5.550 11.029 2.712 478 HG LEU 97 HG LEU 97 -2.616 10.664 2.168 479 1HD1 LEU 97 1HD1 LEU 97 -4.632 8.628 3.063 480 2HD1 LEU 97 2HD1 LEU 97 -3.018 8.935 3.703 481 3HD1 LEU 97 3HD1 LEU 97 -3.210 8.192 2.115 482 1HD2 LEU 97 1HD2 LEU 97 -3.236 10.133 0.068 483 2HD2 LEU 97 2HD2 LEU 97 -4.665 11.085 0.470 484 3HD2 LEU 97 3HD2 LEU 97 -4.714 9.326 0.592 485 HA PRO 98 HA PRO 98 -6.824 16.191 3.115 486 1HB PRO 98 2HB PRO 98 -7.781 15.398 0.382 487 2HB PRO 98 1HB PRO 98 -7.664 17.001 1.102 488 1HG PRO 98 2HG PRO 98 -5.804 16.155 -0.593 489 2HG PRO 98 1HG PRO 98 -5.357 17.097 0.841 490 1HD PRO 98 2HD PRO 98 -4.986 14.205 0.287 491 2HD PRO 98 1HD PRO 98 -4.039 15.288 1.326 492 H GLN 99 H GLN 99 -8.361 13.810 0.967 493 HA GLN 99 HA GLN 99 -10.491 13.492 2.954 494 1HB GLN 99 2HB GLN 99 -10.459 12.563 0.078 495 2HB GLN 99 1HB GLN 99 -11.850 12.626 1.152 496 1HG GLN 99 2HG GLN 99 -11.741 15.045 1.197 497 2HG GLN 99 1HG GLN 99 -10.293 15.018 0.193 498 1HE2 GLN 99 1HE2 GLN 99 -10.547 13.940 -1.941 499 2HE2 GLN 99 2HE2 GLN 99 -12.030 14.186 -2.791 500 H GLY 100 H GLY 100 -7.967 11.730 1.321 501 1HA GLY 100 2HA GLY 100 -7.328 9.797 2.902 502 2HA GLY 100 1HA GLY 100 -8.920 9.209 2.437 503 H VAL 101 H VAL 101 -7.165 7.491 1.844 504 HA VAL 101 HA VAL 101 -5.716 7.845 -0.573 505 HB VAL 101 HB VAL 101 -6.650 5.182 0.486 506 1HG1 VAL 101 1HG1 VAL 101 -5.089 4.254 -0.848 507 2HG1 VAL 101 2HG1 VAL 101 -3.948 5.576 -0.617 508 3HG1 VAL 101 3HG1 VAL 101 -5.279 5.751 -1.759 509 1HG2 VAL 101 1HG2 VAL 101 -4.015 5.835 1.391 510 2HG2 VAL 101 2HG2 VAL 101 -5.439 5.390 2.335 511 3HG2 VAL 101 3HG2 VAL 101 -5.143 7.081 1.927 512 H ARG 102 H ARG 102 -6.898 8.507 -2.270 513 HA ARG 102 HA ARG 102 -9.341 7.065 -2.966 514 1HB ARG 102 2HB ARG 102 -8.368 9.771 -3.352 515 2HB ARG 102 1HB ARG 102 -8.955 9.072 -4.856 516 1HG ARG 102 2HG ARG 102 -10.601 8.854 -2.381 517 2HG ARG 102 1HG ARG 102 -10.578 10.361 -3.301 518 1HD ARG 102 2HD ARG 102 -12.333 8.459 -3.813 519 2HD ARG 102 1HD ARG 102 -11.645 9.447 -5.096 520 HE ARG 102 HE ARG 102 -10.011 7.526 -5.393 521 1HH1 ARG 102 1HH1 ARG 102 -13.260 7.036 -4.170 522 2HH1 ARG 102 2HH1 ARG 102 -13.340 5.396 -4.715 523 1HH2 ARG 102 1HH2 ARG 102 -10.135 5.378 -6.101 524 2HH2 ARG 102 2HH2 ARG 102 -11.572 4.456 -5.809 525 H TYR 103 H TYR 103 -6.129 7.789 -4.188 526 HA TYR 103 HA TYR 103 -6.471 5.603 -6.090 527 1HB TYR 103 2HB TYR 103 -5.301 8.249 -6.962 528 2HB TYR 103 1HB TYR 103 -5.619 6.835 -7.943 529 HD1 TYR 103 1HD TYR 103 -7.898 6.201 -8.549 530 HD2 TYR 103 2HD TYR 103 -7.079 9.798 -6.433 531 HE1 TYR 103 1HE TYR 103 -10.116 7.043 -9.147 532 HE2 TYR 103 2HE TYR 103 -9.311 10.653 -7.017 533 HH TYR 103 HH TYR 103 -11.738 8.658 -8.411 534 H ILE 104 H ILE 104 -4.612 4.508 -6.610 535 HA ILE 104 HA ILE 104 -2.324 5.126 -4.882 536 HB ILE 104 HB ILE 104 -2.925 2.544 -6.318 537 1HG1 ILE 104 2HG1 ILE 104 -3.660 3.543 -3.576 538 2HG1 ILE 104 1HG1 ILE 104 -4.690 2.771 -4.777 539 1HG2 ILE 104 1HG2 ILE 104 -1.096 2.986 -3.981 540 2HG2 ILE 104 2HG2 ILE 104 -0.548 3.101 -5.653 541 3HG2 ILE 104 3HG2 ILE 104 -1.202 1.581 -5.043 542 1HD1 ILE 104 1HD1 ILE 104 -3.149 0.710 -4.361 543 2HD1 ILE 104 2HD1 ILE 104 -4.438 1.100 -3.223 544 3HD1 ILE 104 3HD1 ILE 104 -2.772 1.544 -2.854 545 H TYR 105 H TYR 105 -0.533 5.903 -5.757 546 HA TYR 105 HA TYR 105 -0.171 5.700 -8.650 547 1HB TYR 105 2HB TYR 105 0.211 7.825 -6.706 548 2HB TYR 105 1HB TYR 105 1.634 7.585 -7.721 549 HD1 TYR 105 1HD TYR 105 1.279 7.479 -10.224 550 HD2 TYR 105 2HD TYR 105 -1.620 9.000 -7.525 551 HE1 TYR 105 1HE TYR 105 0.189 8.636 -12.070 552 HE2 TYR 105 2HE TYR 105 -2.730 10.174 -9.361 553 HH TYR 105 HH TYR 105 -2.830 9.766 -12.024 554 H THR 106 H THR 106 2.060 5.655 -9.450 555 HA THR 106 HA THR 106 3.480 3.478 -8.241 556 HB THR 106 HB THR 106 5.233 4.323 -10.069 557 HG1 THR 106 1HG THR 106 4.251 5.456 -11.685 558 1HG2 THR 106 1HG2 THR 106 4.463 2.717 -11.451 559 2HG2 THR 106 2HG2 THR 106 2.787 3.249 -11.321 560 3HG2 THR 106 3HG2 THR 106 3.513 2.293 -10.028 561 H ILE 107 H ILE 107 5.655 3.506 -7.461 562 HA ILE 107 HA ILE 107 6.217 5.329 -5.496 563 HB ILE 107 HB ILE 107 7.359 3.127 -5.822 564 1HG1 ILE 107 2HG1 ILE 107 9.584 3.945 -4.966 565 2HG1 ILE 107 1HG1 ILE 107 9.036 5.585 -5.302 566 1HG2 ILE 107 1HG2 ILE 107 9.237 2.909 -7.256 567 2HG2 ILE 107 2HG2 ILE 107 9.208 4.626 -7.662 568 3HG2 ILE 107 3HG2 ILE 107 7.921 3.562 -8.231 569 1HD1 ILE 107 1HD1 ILE 107 7.950 5.666 -3.379 570 2HD1 ILE 107 2HD1 ILE 107 8.651 4.100 -2.973 571 3HD1 ILE 107 3HD1 ILE 107 7.072 4.183 -3.752 572 H ASP 108 H ASP 108 6.787 5.661 -8.905 573 HA ASP 108 HA ASP 108 8.454 8.029 -8.499 574 1HB ASP 108 2HB ASP 108 8.889 6.138 -10.247 575 2HB ASP 108 1HB ASP 108 7.663 6.975 -11.195 576 H GLY 109 H GLY 109 5.204 7.179 -9.102 577 1HA GLY 109 2HA GLY 109 3.367 8.596 -9.156 578 2HA GLY 109 1HA GLY 109 4.462 9.965 -9.275 579 H SER 110 H SER 110 4.879 7.341 -11.485 580 HA SER 110 HA SER 110 4.504 9.021 -13.735 581 1HB SER 110 2HB SER 110 4.756 6.013 -13.537 582 2HB SER 110 1HB SER 110 4.793 6.922 -15.048 583 HG SER 110 HG SER 110 6.567 7.457 -12.909 584 H ARG 111 H ARG 111 2.626 6.233 -12.541 585 HA ARG 111 HA ARG 111 0.210 7.439 -13.598 586 1HB ARG 111 2HB ARG 111 -0.404 5.126 -14.536 587 2HB ARG 111 1HB ARG 111 0.718 6.115 -15.462 588 1HG ARG 111 2HG ARG 111 1.915 4.218 -15.539 589 2HG ARG 111 1HG ARG 111 2.455 4.725 -13.937 590 1HD ARG 111 2HD ARG 111 0.751 3.348 -12.899 591 2HD ARG 111 1HD ARG 111 0.117 2.898 -14.481 592 HE ARG 111 HE ARG 111 2.340 1.736 -13.140 593 1HH1 ARG 111 1HH1 ARG 111 1.116 2.548 -16.306 594 2HH1 ARG 111 2HH1 ARG 111 2.024 1.313 -17.112 595 1HH2 ARG 111 1HH2 ARG 111 3.536 0.111 -14.199 596 2HH2 ARG 111 2HH2 ARG 111 3.397 -0.071 -15.915 597 H LYS 112 H LYS 112 -1.707 6.401 -12.814 598 HA LYS 112 HA LYS 112 -1.347 5.345 -10.116 599 1HB LYS 112 2HB LYS 112 -2.803 7.130 -9.946 600 2HB LYS 112 1HB LYS 112 -3.538 6.831 -11.506 601 1HG LYS 112 2HG LYS 112 -4.362 4.641 -10.139 602 2HG LYS 112 1HG LYS 112 -4.267 5.832 -8.846 603 1HD LYS 112 2HD LYS 112 -5.887 5.973 -11.383 604 2HD LYS 112 1HD LYS 112 -6.481 5.938 -9.723 605 1HE LYS 112 2HE LYS 112 -6.531 8.160 -9.780 606 2HE LYS 112 1HE LYS 112 -4.769 8.139 -9.835 607 1HZ LYS 112 1HZ LYS 112 -6.583 8.123 -12.187 608 2HZ LYS 112 2HZ LYS 112 -4.895 8.075 -12.255 609 3HZ LYS 112 3HZ LYS 112 -5.675 9.443 -11.643 610 H ILE 113 H ILE 113 -2.155 3.397 -9.454 611 HA ILE 113 HA ILE 113 -2.592 1.424 -11.502 612 HB ILE 113 HB ILE 113 -2.654 1.132 -8.498 613 1HG1 ILE 113 2HG1 ILE 113 -0.501 1.999 -9.664 614 2HG1 ILE 113 1HG1 ILE 113 -0.379 0.677 -8.511 615 1HG2 ILE 113 1HG2 ILE 113 -1.858 -1.266 -9.483 616 2HG2 ILE 113 2HG2 ILE 113 -3.014 -0.750 -10.711 617 3HG2 ILE 113 3HG2 ILE 113 -3.513 -0.866 -9.023 618 1HD1 ILE 113 1HD1 ILE 113 0.682 0.708 -11.023 619 2HD1 ILE 113 2HD1 ILE 113 -0.801 -0.220 -11.245 620 3HD1 ILE 113 3HD1 ILE 113 0.391 -0.735 -10.050 621 H GLY 114 H GLY 114 -4.464 0.520 -12.092 622 1HA GLY 114 2HA GLY 114 -6.896 1.343 -10.636 623 2HA GLY 114 1HA GLY 114 -6.838 1.014 -12.362 624 H SER 115 H SER 115 -5.024 -1.346 -11.737 625 HA SER 115 HA SER 115 -7.120 -3.164 -10.753 626 1HB SER 115 2HB SER 115 -6.339 -4.846 -12.353 627 2HB SER 115 1HB SER 115 -6.816 -3.371 -13.195 628 HG SER 115 HG SER 115 -4.316 -4.528 -12.908 629 H MET 116 H MET 116 -6.501 -4.891 -9.506 630 HA MET 116 HA MET 116 -4.290 -4.542 -7.810 631 1HB MET 116 2HB MET 116 -6.601 -6.035 -7.767 632 2HB MET 116 1HB MET 116 -5.359 -7.267 -7.935 633 1HG MET 116 2HG MET 116 -5.656 -7.045 -5.640 634 2HG MET 116 1HG MET 116 -4.195 -6.118 -5.983 635 1HE MET 116 1HE MET 116 -6.908 -5.457 -3.302 636 2HE MET 116 2HE MET 116 -7.405 -6.490 -4.643 637 3HE MET 116 3HE MET 116 -8.174 -4.920 -4.406 638 H ASP 117 H ASP 117 -4.683 -6.230 -10.813 639 HA ASP 117 HA ASP 117 -2.607 -8.085 -10.622 640 1HB ASP 117 2HB ASP 117 -4.362 -6.998 -12.664 641 2HB ASP 117 1HB ASP 117 -2.765 -7.350 -13.293 642 H GLU 118 H GLU 118 -2.477 -4.673 -10.849 643 HA GLU 118 HA GLU 118 0.130 -4.635 -12.127 644 1HB GLU 118 2HB GLU 118 -1.680 -2.483 -11.050 645 2HB GLU 118 1HB GLU 118 -0.052 -2.141 -11.621 646 1HG GLU 118 2HG GLU 118 -1.644 -3.699 -13.504 647 2HG GLU 118 1HG GLU 118 -2.320 -2.111 -13.143 648 H LEU 119 H LEU 119 -1.074 -4.983 -8.970 649 HA LEU 119 HA LEU 119 1.151 -3.726 -7.634 650 1HB LEU 119 2HB LEU 119 -0.657 -5.657 -6.262 651 2HB LEU 119 1HB LEU 119 0.071 -4.184 -5.650 652 HG LEU 119 HG LEU 119 -2.267 -4.358 -7.548 653 1HD1 LEU 119 1HD1 LEU 119 -2.615 -4.934 -5.110 654 2HD1 LEU 119 2HD1 LEU 119 -3.611 -3.634 -5.761 655 3HD1 LEU 119 3HD1 LEU 119 -2.212 -3.254 -4.758 656 1HD2 LEU 119 1HD2 LEU 119 -0.574 -2.410 -7.782 657 2HD2 LEU 119 2HD2 LEU 119 -1.284 -1.841 -6.271 658 3HD2 LEU 119 3HD2 LEU 119 -2.299 -2.055 -7.697 659 H GLU 120 H GLU 120 3.094 -4.623 -7.537 660 HA GLU 120 HA GLU 120 3.338 -7.538 -7.680 661 1HB GLU 120 2HB GLU 120 5.573 -5.525 -7.849 662 2HB GLU 120 1HB GLU 120 5.584 -7.200 -8.367 663 1HG GLU 120 2HG GLU 120 3.818 -6.555 -10.055 664 2HG GLU 120 1HG GLU 120 4.187 -4.880 -9.647 665 H GLU 121 H GLU 121 4.781 -8.645 -6.218 666 HA GLU 121 HA GLU 121 4.378 -8.043 -3.535 667 1HB GLU 121 2HB GLU 121 6.422 -9.784 -4.890 668 2HB GLU 121 1HB GLU 121 6.342 -9.628 -3.138 669 1HG GLU 121 2HG GLU 121 4.105 -10.511 -3.113 670 2HG GLU 121 1HG GLU 121 4.058 -10.541 -4.876 671 H GLY 122 H GLY 122 5.917 -7.515 -1.867 672 1HA GLY 122 2HA GLY 122 7.209 -5.858 -0.944 673 2HA GLY 122 1HA GLY 122 8.432 -6.577 -1.963 674 H GLU 123 H GLU 123 5.571 -4.676 -2.850 675 HA GLU 123 HA GLU 123 7.317 -2.925 -4.415 676 1HB GLU 123 2HB GLU 123 4.449 -3.681 -4.525 677 2HB GLU 123 1HB GLU 123 4.872 -2.068 -5.083 678 1HG GLU 123 2HG GLU 123 6.042 -4.645 -6.105 679 2HG GLU 123 1HG GLU 123 4.813 -3.673 -6.913 680 H SER 124 H SER 124 6.482 -0.596 -4.587 681 HA SER 124 HA SER 124 5.783 0.448 -1.926 682 1HB SER 124 2HB SER 124 8.029 1.271 -3.752 683 2HB SER 124 1HB SER 124 7.323 2.430 -2.625 684 HG SER 124 HG SER 124 8.621 -0.016 -2.035 685 H TYR 125 H TYR 125 3.891 1.480 -2.081 686 HA TYR 125 HA TYR 125 3.296 2.886 -4.597 687 1HB TYR 125 2HB TYR 125 1.522 1.310 -2.800 688 2HB TYR 125 1HB TYR 125 0.852 2.568 -3.811 689 HD1 TYR 125 1HD TYR 125 1.681 -0.853 -3.690 690 HD2 TYR 125 2HD TYR 125 1.587 2.486 -6.310 691 HE1 TYR 125 1HE TYR 125 1.658 -2.374 -5.618 692 HE2 TYR 125 2HE TYR 125 1.568 0.997 -8.236 693 HH TYR 125 HH TYR 125 2.325 -1.404 -8.727 694 H VAL 126 H VAL 126 1.907 4.675 -4.498 695 HA VAL 126 HA VAL 126 2.158 6.200 -1.978 696 HB VAL 126 HB VAL 126 2.699 7.049 -4.790 697 1HG1 VAL 126 1HG1 VAL 126 2.599 9.467 -3.743 698 2HG1 VAL 126 2HG1 VAL 126 1.369 8.729 -2.719 699 3HG1 VAL 126 3HG1 VAL 126 1.171 8.732 -4.471 700 1HG2 VAL 126 1HG2 VAL 126 4.058 8.315 -2.520 701 2HG2 VAL 126 2HG2 VAL 126 4.723 7.600 -3.991 702 3HG2 VAL 126 3HG2 VAL 126 4.276 6.568 -2.632 703 H CYS 127 H CYS 127 0.429 7.370 -1.273 704 HA CYS 127 HA CYS 127 -2.126 6.748 -2.531 705 1HB CYS 127 2HB CYS 127 -1.697 8.228 0.061 706 2HB CYS 127 1HB CYS 127 -3.141 7.375 -0.474 707 HG CYS 127 HG CYS 127 -2.064 5.157 0.108 708 H SER 128 H SER 128 -3.259 8.152 -3.693 709 HA SER 128 HA SER 128 -2.703 11.024 -3.408 710 1HB SER 128 2HB SER 128 -3.018 9.567 -6.045 711 2HB SER 128 1HB SER 128 -2.815 11.310 -5.842 712 HG SER 128 HG SER 128 -0.937 9.374 -4.959 713 H SER 129 H SER 129 -4.427 12.393 -4.334 714 HA SER 129 HA SER 129 -7.009 11.150 -4.750 715 1HB SER 129 2HB SER 129 -6.571 11.508 -2.197 716 2HB SER 129 1HB SER 129 -6.879 13.205 -2.564 717 HG SER 129 HG SER 129 -8.901 12.518 -3.467 718 H ASP 130 H ASP 130 -5.341 14.224 -4.110 719 HA ASP 130 HA ASP 130 -6.423 15.317 -6.574 720 1HB ASP 130 2HB ASP 130 -7.658 15.885 -4.094 721 2HB ASP 130 1HB ASP 130 -6.770 17.334 -4.554 722 H ASN 131 H ASN 131 -3.786 14.590 -5.463 723 HA ASN 131 HA ASN 131 -2.488 17.221 -5.333 724 1HB ASN 131 2HB ASN 131 -1.165 14.567 -4.791 725 2HB ASN 131 1HB ASN 131 -0.641 16.168 -4.281 726 1HD2 ASN 131 1HD2 ASN 131 -2.426 13.408 -3.484 727 2HD2 ASN 131 2HD2 ASN 131 -3.113 13.980 -2.005 728 H PHE 132 H PHE 132 0.102 16.245 -6.116 729 HA PHE 132 HA PHE 132 -0.206 15.289 -8.843 730 1HB PHE 132 2HB PHE 132 1.143 17.936 -8.274 731 2HB PHE 132 1HB PHE 132 0.967 17.165 -9.846 732 HD1 PHE 132 1HD PHE 132 -1.051 17.338 -11.087 733 HD2 PHE 132 2HD PHE 132 -0.821 18.880 -7.128 734 HE1 PHE 132 1HE PHE 132 -3.181 18.522 -11.429 735 HE2 PHE 132 2HE PHE 132 -2.951 20.067 -7.462 736 HZ PHE 132 HZ PHE 132 -4.133 19.888 -9.615 737 H PHE 133 H PHE 133 1.018 14.331 -6.369 738 HA PHE 133 HA PHE 133 2.870 13.222 -5.686 739 1HB PHE 133 2HB PHE 133 2.670 12.440 -8.105 740 2HB PHE 133 1HB PHE 133 3.942 13.596 -8.471 741 HD1 PHE 133 1HD PHE 133 6.109 12.829 -8.480 742 HD2 PHE 133 2HD PHE 133 3.223 10.842 -6.066 743 HE1 PHE 133 1HE PHE 133 7.797 11.155 -7.846 744 HE2 PHE 133 2HE PHE 133 4.905 9.165 -5.427 745 HZ PHE 133 HZ PHE 133 7.196 9.323 -6.316 746 H LYS 134 H LYS 134 4.537 13.889 -4.483 747 HA LYS 134 HA LYS 134 5.764 16.468 -5.154 748 1HB LYS 134 2HB LYS 134 5.931 15.031 -2.510 749 2HB LYS 134 1HB LYS 134 6.289 16.721 -2.842 750 1HG LYS 134 2HG LYS 134 3.541 15.621 -3.279 751 2HG LYS 134 1HG LYS 134 4.078 16.126 -1.676 752 1HD LYS 134 2HD LYS 134 4.210 18.344 -2.270 753 2HD LYS 134 1HD LYS 134 4.475 17.980 -3.977 754 1HE LYS 134 2HE LYS 134 2.317 18.746 -4.048 755 2HE LYS 134 1HE LYS 134 2.034 17.021 -3.818 756 1HZ LYS 134 1HZ LYS 134 0.726 17.784 -2.168 757 2HZ LYS 134 2HZ LYS 134 1.575 19.237 -1.992 758 3HZ LYS 134 3HZ LYS 134 2.175 17.818 -1.295 759 H LYS 135 H LYS 135 6.422 13.346 -5.668 760 HA LYS 135 HA LYS 135 8.295 12.011 -5.735 761 1HB LYS 135 2HB LYS 135 10.131 13.237 -7.086 762 2HB LYS 135 1HB LYS 135 8.561 12.969 -7.826 763 1HG LYS 135 2HG LYS 135 9.056 15.530 -6.394 764 2HG LYS 135 1HG LYS 135 9.751 15.288 -7.995 765 1HD LYS 135 2HD LYS 135 7.490 14.727 -8.843 766 2HD LYS 135 1HD LYS 135 6.833 15.113 -7.251 767 1HE LYS 135 2HE LYS 135 7.239 17.371 -7.483 768 2HE LYS 135 1HE LYS 135 8.525 17.124 -8.664 769 1HZ LYS 135 1HZ LYS 135 5.958 16.204 -9.568 770 2HZ LYS 135 2HZ LYS 135 7.082 17.202 -10.343 771 3HZ LYS 135 3HZ LYS 135 5.985 17.863 -9.238 772 H VAL 136 H VAL 136 8.887 11.696 -3.583 773 HA VAL 136 HA VAL 136 11.217 13.286 -2.730 774 HB VAL 136 HB VAL 136 10.255 12.258 -0.370 775 1HG1 VAL 136 1HG1 VAL 136 10.352 14.871 -1.697 776 2HG1 VAL 136 2HG1 VAL 136 10.950 14.371 -0.116 777 3HG1 VAL 136 3HG1 VAL 136 9.242 14.762 -0.330 778 1HG2 VAL 136 1HG2 VAL 136 8.149 11.564 -1.341 779 2HG2 VAL 136 2HG2 VAL 136 7.890 13.177 -2.003 780 3HG2 VAL 136 3HG2 VAL 136 7.883 12.930 -0.257 781 H GLU 137 H GLU 137 12.197 11.907 -0.690 782 HA GLU 137 HA GLU 137 13.193 9.531 -1.964 783 1HB GLU 137 2HB GLU 137 13.770 10.711 0.763 784 2HB GLU 137 1HB GLU 137 14.607 9.321 0.082 785 1HG GLU 137 2HG GLU 137 15.907 10.585 -1.226 786 2HG GLU 137 1HG GLU 137 14.591 11.681 -1.647 787 H TYR 138 H TYR 138 10.872 8.830 -1.965 788 HA TYR 138 HA TYR 138 9.515 7.842 0.233 789 1HB TYR 138 2HB TYR 138 9.645 7.136 -2.666 790 2HB TYR 138 1HB TYR 138 8.640 6.171 -1.578 791 HD1 TYR 138 1HD TYR 138 8.428 8.627 -3.905 792 HD2 TYR 138 2HD TYR 138 7.284 7.928 0.133 793 HE1 TYR 138 1HE TYR 138 6.637 10.298 -4.128 794 HE2 TYR 138 2HE TYR 138 5.488 9.596 -0.080 795 HH TYR 138 HH TYR 138 4.314 10.683 -2.895 796 H THR 139 H THR 139 12.152 6.421 -1.610 797 HA THR 139 HA THR 139 12.551 4.441 0.472 798 HB THR 139 HB THR 139 12.326 2.528 -0.832 799 HG1 THR 139 1HG THR 139 12.280 2.573 -3.095 800 1HG2 THR 139 1HG2 THR 139 10.232 4.425 -1.854 801 2HG2 THR 139 2HG2 THR 139 10.100 3.299 -0.504 802 3HG2 THR 139 3HG2 THR 139 10.223 2.687 -2.155 803 H LYS 140 H LYS 140 13.917 6.800 -1.039 804 HA LYS 140 HA LYS 140 16.236 5.607 -2.203 805 1HB LYS 140 2HB LYS 140 15.835 8.456 -1.298 806 2HB LYS 140 1HB LYS 140 17.108 7.876 -2.366 807 1HG LYS 140 2HG LYS 140 15.242 7.129 -3.923 808 2HG LYS 140 1HG LYS 140 14.170 8.108 -2.921 809 1HD LYS 140 2HD LYS 140 16.194 9.856 -3.372 810 2HD LYS 140 1HD LYS 140 16.215 8.926 -4.872 811 1HE LYS 140 2HE LYS 140 13.825 10.327 -3.679 812 2HE LYS 140 1HE LYS 140 14.764 10.879 -5.065 813 1HZ LYS 140 1HZ LYS 140 13.713 8.183 -5.263 814 2HZ LYS 140 2HZ LYS 140 13.774 9.410 -6.425 815 3HZ LYS 140 3HZ LYS 140 12.548 9.410 -5.259 816 H ASN 141 H ASN 141 15.271 5.930 0.916 817 HA ASN 141 HA ASN 141 17.908 5.228 1.807 818 1HB ASN 141 2HB ASN 141 16.822 7.886 2.239 819 2HB ASN 141 1HB ASN 141 17.203 7.089 3.761 820 1HD2 ASN 141 1HD2 ASN 141 18.469 8.328 0.775 821 2HD2 ASN 141 2HD2 ASN 141 20.133 8.307 1.236 822 H VAL 142 H VAL 142 14.931 4.354 1.714 823 HA VAL 142 HA VAL 142 14.449 3.824 4.539 824 HB VAL 142 HB VAL 142 12.724 2.990 2.211 825 1HG1 VAL 142 1HG1 VAL 142 10.947 2.995 3.932 826 2HG1 VAL 142 2HG1 VAL 142 12.166 3.362 5.152 827 3HG1 VAL 142 3HG1 VAL 142 12.230 1.833 4.274 828 1HG2 VAL 142 1HG2 VAL 142 13.003 5.389 2.072 829 2HG2 VAL 142 2HG2 VAL 142 12.640 5.560 3.790 830 3HG2 VAL 142 3HG2 VAL 142 11.387 5.018 2.675 831 H ASN 143 H ASN 143 14.255 1.748 5.402 832 HA ASN 143 HA ASN 143 15.960 -0.226 4.209 833 1HB ASN 143 2HB ASN 143 15.445 -1.554 6.222 834 2HB ASN 143 1HB ASN 143 15.936 0.086 6.632 835 1HD2 ASN 143 1HD2 ASN 143 13.523 -2.281 6.888 836 2HD2 ASN 143 2HD2 ASN 143 12.345 -1.333 7.724 837 HA PRO 144 HA PRO 144 12.405 -2.017 2.066 838 1HB PRO 144 2HB PRO 144 14.266 -3.583 0.521 839 2HB PRO 144 1HB PRO 144 13.300 -2.201 0.005 840 1HG PRO 144 2HG PRO 144 16.034 -2.171 0.227 841 2HG PRO 144 1HG PRO 144 15.009 -0.728 0.330 842 1HD PRO 144 2HD PRO 144 16.259 -2.331 2.530 843 2HD PRO 144 1HD PRO 144 16.073 -0.570 2.380 844 H ASN 145 H ASN 145 13.845 -3.227 4.537 845 HA ASN 145 HA ASN 145 13.619 -6.065 3.950 846 1HB ASN 145 2HB ASN 145 14.523 -4.540 6.390 847 2HB ASN 145 1HB ASN 145 14.339 -6.291 6.375 848 1HD2 ASN 145 1HD2 ASN 145 15.838 -3.708 4.461 849 2HD2 ASN 145 2HD2 ASN 145 17.298 -4.571 4.127 850 H TRP 146 H TRP 146 11.253 -4.098 4.180 851 HA TRP 146 HA TRP 146 9.822 -4.975 6.497 852 1HB TRP 146 2HB TRP 146 7.823 -4.035 4.962 853 2HB TRP 146 1HB TRP 146 8.873 -3.000 5.918 854 HD1 TRP 146 HD TRP 146 10.715 -1.564 4.588 855 HE1 TRP 146 1HE TRP 146 10.803 -0.771 2.141 856 HE3 TRP 146 3HE TRP 146 7.223 -4.719 2.579 857 HZ2 TRP 146 2HZ TRP 146 9.554 -1.395 -0.311 858 HZ3 TRP 146 3HZ TRP 146 6.723 -4.543 0.185 859 HH2 TRP 146 HH TRP 146 7.866 -2.923 -1.234 860 H SER 147 H SER 147 10.168 -6.128 3.245 861 HA SER 147 HA SER 147 7.879 -7.879 3.388 862 1HB SER 147 2HB SER 147 8.790 -8.777 1.223 863 2HB SER 147 1HB SER 147 8.483 -7.040 1.211 864 HG SER 147 HG SER 147 10.624 -6.645 1.283 865 H VAL 148 H VAL 148 11.220 -7.997 4.236 866 HA VAL 148 HA VAL 148 11.271 -10.907 4.358 867 HB VAL 148 HB VAL 148 13.454 -9.038 5.268 868 1HG1 VAL 148 1HG1 VAL 148 13.165 -11.802 5.407 869 2HG1 VAL 148 2HG1 VAL 148 14.652 -10.880 5.627 870 3HG1 VAL 148 3HG1 VAL 148 14.246 -11.534 4.040 871 1HG2 VAL 148 1HG2 VAL 148 12.571 -9.724 2.535 872 2HG2 VAL 148 2HG2 VAL 148 14.304 -9.831 2.840 873 3HG2 VAL 148 3HG2 VAL 148 13.451 -8.313 3.124 874 H ASN 149 H ASN 149 9.648 -9.026 6.188 875 HA ASN 149 HA ASN 149 10.297 -10.460 8.636 876 1HB ASN 149 2HB ASN 149 10.653 -7.550 8.251 877 2HB ASN 149 1HB ASN 149 9.816 -8.024 9.725 878 1HD2 ASN 149 1HD2 ASN 149 10.929 -8.999 11.347 879 2HD2 ASN 149 2HD2 ASN 149 12.642 -9.223 11.336 880 H VAL 150 H VAL 150 8.141 -10.657 6.755 881 HA VAL 150 HA VAL 150 5.868 -9.543 8.242 882 HB VAL 150 HB VAL 150 4.527 -10.334 6.251 883 1HG1 VAL 150 1HG1 VAL 150 5.685 -8.509 4.728 884 2HG1 VAL 150 2HG1 VAL 150 6.566 -8.174 6.218 885 3HG1 VAL 150 3HG1 VAL 150 4.806 -8.070 6.192 886 1HG2 VAL 150 1HG2 VAL 150 6.703 -11.787 5.608 887 2HG2 VAL 150 2HG2 VAL 150 6.963 -10.370 4.591 888 3HG2 VAL 150 3HG2 VAL 150 5.471 -11.301 4.443 Start of MODEL 19 1 1H GLY 38 1HT GLY 38 6.585 -32.987 14.616 2 2H GLY 38 2HT GLY 38 7.017 -32.071 13.262 3 3H GLY 38 3HT GLY 38 7.600 -33.649 13.435 4 1HA GLY 38 1HA GLY 38 5.926 -34.230 12.098 5 2HA GLY 38 2HA GLY 38 4.963 -34.083 13.561 6 H ALA 39 H ALA 39 6.428 -31.661 11.400 7 HA ALA 39 HA ALA 39 3.753 -30.454 11.120 8 1HB ALA 39 1HB ALA 39 5.915 -29.263 12.194 9 2HB ALA 39 2HB ALA 39 4.625 -28.392 11.364 10 3HB ALA 39 3HB ALA 39 6.110 -28.799 10.504 11 H MET 40 H MET 40 6.254 -32.023 9.445 12 HA MET 40 HA MET 40 4.922 -31.496 6.915 13 1HB MET 40 2HB MET 40 7.202 -31.125 5.827 14 2HB MET 40 1HB MET 40 6.536 -29.789 6.756 15 1HG MET 40 2HG MET 40 7.952 -30.403 8.651 16 2HG MET 40 1HG MET 40 8.624 -31.734 7.712 17 1HE MET 40 1HE MET 40 11.558 -29.438 8.059 18 2HE MET 40 2HE MET 40 11.476 -30.873 7.037 19 3HE MET 40 3HE MET 40 10.667 -30.859 8.604 20 H ASP 41 H ASP 41 5.156 -33.137 5.413 21 HA ASP 41 HA ASP 41 7.029 -35.283 5.827 22 1HB ASP 41 2HB ASP 41 4.793 -35.557 7.294 23 2HB ASP 41 1HB ASP 41 4.227 -36.259 5.782 24 HA PRO 42 HA PRO 42 6.532 -34.758 1.359 25 1HB PRO 42 2HB PRO 42 8.232 -37.208 1.484 26 2HB PRO 42 1HB PRO 42 8.429 -35.750 0.504 27 1HG PRO 42 2HG PRO 42 9.952 -36.149 2.646 28 2HG PRO 42 1HG PRO 42 9.334 -34.532 2.260 29 1HD PRO 42 2HD PRO 42 8.431 -36.458 4.355 30 2HD PRO 42 1HD PRO 42 8.500 -34.684 4.406 31 H GLU 43 H GLU 43 6.166 -36.510 -0.443 32 HA GLU 43 HA GLU 43 4.970 -38.255 -1.313 33 1HB GLU 43 2HB GLU 43 4.150 -39.117 1.450 34 2HB GLU 43 1HB GLU 43 4.272 -40.089 -0.009 35 1HG GLU 43 2HG GLU 43 6.833 -39.190 0.300 36 2HG GLU 43 1HG GLU 43 6.302 -39.406 1.967 37 H PHE 44 H PHE 44 3.399 -36.799 1.541 38 HA PHE 44 HA PHE 44 1.214 -35.895 -0.122 39 1HB PHE 44 2HB PHE 44 0.871 -38.359 0.931 40 2HB PHE 44 1HB PHE 44 0.270 -37.378 2.263 41 HD1 PHE 44 1HD PHE 44 -1.203 -35.265 1.188 42 HD2 PHE 44 2HD PHE 44 -0.812 -39.212 -0.354 43 HE1 PHE 44 1HE PHE 44 -3.366 -35.026 0.036 44 HE2 PHE 44 2HE PHE 44 -2.972 -38.979 -1.510 45 HZ PHE 44 HZ PHE 44 -4.251 -36.885 -1.315 46 H ALA 45 H ALA 45 2.647 -34.065 0.783 47 HA ALA 45 HA ALA 45 2.250 -33.332 3.524 48 1HB ALA 45 1HB ALA 45 3.781 -31.716 3.148 49 2HB ALA 45 2HB ALA 45 3.068 -31.248 1.605 50 3HB ALA 45 3HB ALA 45 4.113 -32.665 1.700 51 H LEU 46 H LEU 46 0.256 -32.823 4.184 52 HA LEU 46 HA LEU 46 -1.638 -31.512 2.453 53 1HB LEU 46 2HB LEU 46 -2.239 -33.250 4.162 54 2HB LEU 46 1HB LEU 46 -1.878 -32.070 5.407 55 HG LEU 46 HG LEU 46 -3.832 -31.251 3.333 56 1HD1 LEU 46 1HD1 LEU 46 -5.527 -32.424 5.041 57 2HD1 LEU 46 2HD1 LEU 46 -4.198 -33.581 5.112 58 3HD1 LEU 46 3HD1 LEU 46 -4.954 -33.199 3.565 59 1HD2 LEU 46 1HD2 LEU 46 -4.840 -30.101 5.170 60 2HD2 LEU 46 2HD2 LEU 46 -3.098 -29.830 5.251 61 3HD2 LEU 46 3HD2 LEU 46 -3.862 -30.993 6.335 62 H SER 47 H SER 47 -1.772 -29.393 2.165 63 HA SER 47 HA SER 47 -1.503 -27.552 4.358 64 1HB SER 47 2HB SER 47 0.401 -27.084 2.078 65 2HB SER 47 1HB SER 47 0.414 -26.377 3.693 66 HG SER 47 HG SER 47 1.115 -28.328 4.518 67 H ASN 48 H ASN 48 -2.116 -25.377 3.786 68 HA ASN 48 HA ASN 48 -3.074 -24.824 1.129 69 1HB ASN 48 2HB ASN 48 -4.847 -26.193 2.657 70 2HB ASN 48 1HB ASN 48 -5.256 -24.540 3.107 71 1HD2 ASN 48 1HD2 ASN 48 -5.579 -23.031 1.255 72 2HD2 ASN 48 2HD2 ASN 48 -6.405 -23.645 -0.134 73 H GLU 49 H GLU 49 -3.012 -22.692 0.736 74 HA GLU 49 HA GLU 49 -3.483 -20.725 2.766 75 1HB GLU 49 2HB GLU 49 -0.757 -21.605 2.207 76 2HB GLU 49 1HB GLU 49 -0.967 -19.875 1.970 77 1HG GLU 49 2HG GLU 49 -2.186 -20.848 4.428 78 2HG GLU 49 1HG GLU 49 -0.447 -21.127 4.350 79 H LYS 50 H LYS 50 -3.846 -18.687 1.918 80 HA LYS 50 HA LYS 50 -4.183 -18.608 -0.970 81 1HB LYS 50 2HB LYS 50 -5.130 -16.869 1.293 82 2HB LYS 50 1HB LYS 50 -5.261 -16.339 -0.378 83 1HG LYS 50 2HG LYS 50 -7.340 -17.275 0.123 84 2HG LYS 50 1HG LYS 50 -6.500 -18.518 -0.807 85 1HD LYS 50 2HD LYS 50 -5.820 -18.970 1.881 86 2HD LYS 50 1HD LYS 50 -7.553 -18.639 1.867 87 1HE LYS 50 2HE LYS 50 -6.210 -20.623 0.040 88 2HE LYS 50 1HE LYS 50 -6.929 -21.052 1.591 89 1HZ LYS 50 1HZ LYS 50 -8.253 -21.122 -0.709 90 2HZ LYS 50 2HZ LYS 50 -8.628 -19.547 -0.221 91 3HZ LYS 50 3HZ LYS 50 -9.005 -20.854 0.783 92 H LYS 51 H LYS 51 -3.152 -17.222 -2.346 93 HA LYS 51 HA LYS 51 -0.642 -16.137 -1.432 94 1HB LYS 51 2HB LYS 51 -1.450 -17.231 -3.788 95 2HB LYS 51 1HB LYS 51 -1.536 -15.517 -4.174 96 1HG LYS 51 2HG LYS 51 0.679 -15.321 -4.284 97 2HG LYS 51 1HG LYS 51 0.922 -16.240 -2.797 98 1HD LYS 51 2HD LYS 51 1.853 -17.736 -4.217 99 2HD LYS 51 1HD LYS 51 0.173 -18.227 -4.441 100 1HE LYS 51 2HE LYS 51 1.773 -16.363 -6.186 101 2HE LYS 51 1HE LYS 51 1.217 -17.984 -6.595 102 1HZ LYS 51 1HZ LYS 51 -0.580 -15.697 -6.001 103 2HZ LYS 51 2HZ LYS 51 -1.043 -17.231 -6.542 104 3HZ LYS 51 3HZ LYS 51 -0.162 -16.207 -7.560 105 H ALA 52 H ALA 52 0.039 -13.932 -1.888 106 HA ALA 52 HA ALA 52 -1.967 -11.921 -2.362 107 1HB ALA 52 1HB ALA 52 -2.246 -11.059 -0.288 108 2HB ALA 52 2HB ALA 52 -0.614 -11.485 0.228 109 3HB ALA 52 3HB ALA 52 -1.879 -12.714 0.199 110 H LYS 53 H LYS 53 -0.641 -9.726 -1.299 111 HA LYS 53 HA LYS 53 2.077 -9.825 -2.368 112 1HB LYS 53 2HB LYS 53 -0.120 -8.022 -3.368 113 2HB LYS 53 1HB LYS 53 1.580 -7.626 -3.574 114 1HG LYS 53 2HG LYS 53 1.684 -8.900 -5.378 115 2HG LYS 53 1HG LYS 53 1.164 -10.304 -4.446 116 1HD LYS 53 2HD LYS 53 -1.210 -9.221 -4.731 117 2HD LYS 53 1HD LYS 53 -0.447 -8.417 -6.104 118 1HE LYS 53 2HE LYS 53 -1.075 -10.269 -7.220 119 2HE LYS 53 1HE LYS 53 0.377 -10.960 -6.498 120 1HZ LYS 53 1HZ LYS 53 -1.074 -12.510 -5.797 121 2HZ LYS 53 2HZ LYS 53 -2.415 -11.485 -5.906 122 3HZ LYS 53 3HZ LYS 53 -1.393 -11.397 -4.562 123 H LYS 54 H LYS 54 3.445 -8.764 -1.095 124 HA LYS 54 HA LYS 54 2.397 -7.120 1.049 125 1HB LYS 54 2HB LYS 54 4.900 -8.652 0.572 126 2HB LYS 54 1HB LYS 54 5.021 -7.218 1.581 127 1HG LYS 54 2HG LYS 54 3.055 -9.439 2.075 128 2HG LYS 54 1HG LYS 54 4.654 -9.355 2.816 129 1HD LYS 54 2HD LYS 54 4.111 -7.452 4.054 130 2HD LYS 54 1HD LYS 54 2.732 -7.064 3.023 131 1HE LYS 54 2HE LYS 54 1.541 -9.018 3.875 132 2HE LYS 54 1HE LYS 54 2.925 -9.429 4.886 133 1HZ LYS 54 1HZ LYS 54 2.553 -7.024 5.776 134 2HZ LYS 54 2HZ LYS 54 1.612 -8.303 6.359 135 3HZ LYS 54 3HZ LYS 54 0.981 -7.253 5.194 136 H VAL 55 H VAL 55 2.404 -5.024 0.920 137 HA VAL 55 HA VAL 55 4.458 -3.677 -0.697 138 HB VAL 55 HB VAL 55 2.779 -2.017 -1.437 139 1HG1 VAL 55 1HG1 VAL 55 1.762 -4.634 -2.406 140 2HG1 VAL 55 2HG1 VAL 55 3.453 -4.216 -2.685 141 3HG1 VAL 55 3HG1 VAL 55 2.171 -3.172 -3.301 142 1HG2 VAL 55 1HG2 VAL 55 0.359 -2.903 -1.347 143 2HG2 VAL 55 2HG2 VAL 55 1.042 -2.113 0.079 144 3HG2 VAL 55 3HG2 VAL 55 0.939 -3.874 0.006 145 H ARG 56 H ARG 56 4.960 -1.578 -0.104 146 HA ARG 56 HA ARG 56 4.149 -0.838 2.623 147 1HB ARG 56 2HB ARG 56 6.631 -1.178 2.092 148 2HB ARG 56 1HB ARG 56 6.512 0.260 1.088 149 1HG ARG 56 2HG ARG 56 6.340 1.663 2.870 150 2HG ARG 56 1HG ARG 56 5.552 0.457 3.885 151 1HD ARG 56 2HD ARG 56 7.854 -0.749 3.766 152 2HD ARG 56 1HD ARG 56 8.458 0.840 3.305 153 HE ARG 56 HE ARG 56 6.838 0.845 5.684 154 1HH1 ARG 56 1HH1 ARG 56 10.063 0.456 4.407 155 2HH1 ARG 56 2HH1 ARG 56 10.837 0.878 5.897 156 1HH2 ARG 56 1HH2 ARG 56 7.856 1.399 7.643 157 2HH2 ARG 56 2HH2 ARG 56 9.585 1.413 7.734 158 H PHE 57 H PHE 57 2.436 0.502 2.465 159 HA PHE 57 HA PHE 57 2.218 2.240 0.156 160 1HB PHE 57 2HB PHE 57 0.359 1.554 2.423 161 2HB PHE 57 1HB PHE 57 -0.011 2.832 1.273 162 HD1 PHE 57 1HD PHE 57 -1.841 0.620 1.631 163 HD2 PHE 57 2HD PHE 57 1.570 0.898 -0.905 164 HE1 PHE 57 1HE PHE 57 -2.832 -1.033 0.104 165 HE2 PHE 57 2HE PHE 57 0.576 -0.737 -2.430 166 HZ PHE 57 HZ PHE 57 -1.628 -1.711 -1.929 167 H TYR 58 H TYR 58 2.658 4.276 0.093 168 HA TYR 58 HA TYR 58 3.212 5.728 2.589 169 1HB TYR 58 2HB TYR 58 4.366 6.324 -0.121 170 2HB TYR 58 1HB TYR 58 4.804 7.073 1.395 171 HD1 TYR 58 1HD TYR 58 6.571 6.224 2.665 172 HD2 TYR 58 2HD TYR 58 4.853 3.796 -0.376 173 HE1 TYR 58 1HE TYR 58 8.364 4.570 2.980 174 HE2 TYR 58 2HE TYR 58 6.637 2.136 -0.068 175 HH TYR 58 HH TYR 58 8.956 2.062 0.792 176 H ARG 59 H ARG 59 2.477 7.808 2.767 177 HA ARG 59 HA ARG 59 0.291 8.484 0.941 178 1HB ARG 59 2HB ARG 59 -0.174 10.256 2.776 179 2HB ARG 59 1HB ARG 59 -0.549 8.575 3.114 180 1HG ARG 59 2HG ARG 59 0.642 8.767 4.969 181 2HG ARG 59 1HG ARG 59 2.084 8.903 3.966 182 1HD ARG 59 2HD ARG 59 2.117 10.769 5.393 183 2HD ARG 59 1HD ARG 59 1.597 11.376 3.822 184 HE ARG 59 HE ARG 59 -0.747 10.997 4.924 185 1HH1 ARG 59 1HH1 ARG 59 2.132 12.320 6.403 186 2HH1 ARG 59 2HH1 ARG 59 1.250 13.297 7.527 187 1HH2 ARG 59 1HH2 ARG 59 -1.895 12.292 6.396 188 2HH2 ARG 59 2HH2 ARG 59 -1.031 13.278 7.526 189 H ASN 60 H ASN 60 0.724 9.830 -0.641 190 HA ASN 60 HA ASN 60 3.024 11.078 -1.246 191 1HB ASN 60 2HB ASN 60 1.266 11.026 -2.847 192 2HB ASN 60 1HB ASN 60 0.215 11.992 -1.826 193 1HD2 ASN 60 1HD2 ASN 60 0.101 13.162 -3.938 194 2HD2 ASN 60 2HD2 ASN 60 1.246 14.430 -4.199 195 H GLY 61 H GLY 61 4.221 12.708 -0.603 196 1HA GLY 61 2HA GLY 61 4.875 14.670 0.414 197 2HA GLY 61 1HA GLY 61 3.177 15.074 0.615 198 H ASP 62 H ASP 62 5.702 12.942 1.953 199 HA ASP 62 HA ASP 62 4.858 13.698 4.627 200 1HB ASP 62 2HB ASP 62 4.815 11.270 5.344 201 2HB ASP 62 1HB ASP 62 3.455 11.810 4.370 202 H ARG 63 H ARG 63 6.977 11.449 2.850 203 HA ARG 63 HA ARG 63 9.081 10.674 3.382 204 1HB ARG 63 2HB ARG 63 10.751 12.437 3.134 205 2HB ARG 63 1HB ARG 63 9.455 12.618 1.961 206 1HG ARG 63 2HG ARG 63 8.455 14.265 3.691 207 2HG ARG 63 1HG ARG 63 10.092 14.295 4.348 208 1HD ARG 63 2HD ARG 63 10.163 14.553 1.491 209 2HD ARG 63 1HD ARG 63 9.075 15.756 2.178 210 HE ARG 63 HE ARG 63 11.268 15.952 3.745 211 1HH1 ARG 63 1HH1 ARG 63 10.798 16.021 0.286 212 2HH1 ARG 63 2HH1 ARG 63 12.149 17.065 -0.002 213 1HH2 ARG 63 1HH2 ARG 63 13.045 17.324 3.367 214 2HH2 ARG 63 2HH2 ARG 63 13.426 17.804 1.746 215 H TYR 64 H TYR 64 7.507 10.817 5.751 216 HA TYR 64 HA TYR 64 9.647 10.967 7.696 217 1HB TYR 64 2HB TYR 64 7.575 13.012 7.477 218 2HB TYR 64 1HB TYR 64 7.644 12.282 9.075 219 HD1 TYR 64 1HD TYR 64 9.633 14.084 6.530 220 HD2 TYR 64 2HD TYR 64 9.400 12.807 10.581 221 HE1 TYR 64 1HE TYR 64 11.553 15.516 7.085 222 HE2 TYR 64 2HE TYR 64 11.319 14.236 11.148 223 HH TYR 64 HH TYR 64 12.450 16.663 9.179 224 H PHE 65 H PHE 65 6.230 10.339 7.037 225 HA PHE 65 HA PHE 65 5.813 8.780 9.395 226 1HB PHE 65 2HB PHE 65 3.888 9.809 8.483 227 2HB PHE 65 1HB PHE 65 4.233 9.210 6.865 228 HD1 PHE 65 1HD PHE 65 3.057 7.401 6.088 229 HD2 PHE 65 2HD PHE 65 3.470 7.940 10.289 230 HE1 PHE 65 1HE PHE 65 1.569 5.482 6.474 231 HE2 PHE 65 2HE PHE 65 1.981 6.021 10.685 232 HZ PHE 65 HZ PHE 65 1.028 4.789 8.777 233 H LYS 66 H LYS 66 7.163 8.131 6.301 234 HA LYS 66 HA LYS 66 8.059 6.264 5.373 235 1HB LYS 66 2HB LYS 66 7.816 5.423 8.236 236 2HB LYS 66 1HB LYS 66 8.289 4.244 7.022 237 1HG LYS 66 2HG LYS 66 9.853 6.571 6.618 238 2HG LYS 66 1HG LYS 66 9.887 6.185 8.339 239 1HD LYS 66 2HD LYS 66 10.542 3.878 7.789 240 2HD LYS 66 1HD LYS 66 10.545 4.300 6.075 241 1HE LYS 66 2HE LYS 66 12.361 5.800 6.358 242 2HE LYS 66 1HE LYS 66 12.233 5.727 8.115 243 1HZ LYS 66 1HZ LYS 66 13.554 3.926 6.288 244 2HZ LYS 66 2HZ LYS 66 12.625 3.147 7.468 245 3HZ LYS 66 3HZ LYS 66 13.852 4.216 7.929 246 H GLY 67 H GLY 67 4.993 6.665 5.822 247 1HA GLY 67 2HA GLY 67 3.087 5.602 5.132 248 2HA GLY 67 1HA GLY 67 4.144 4.592 4.164 249 H ILE 68 H ILE 68 2.126 3.249 4.835 250 HA ILE 68 HA ILE 68 2.893 1.634 7.171 251 HB ILE 68 HB ILE 68 0.884 2.857 7.754 252 1HG1 ILE 68 2HG1 ILE 68 -0.015 0.064 7.059 253 2HG1 ILE 68 1HG1 ILE 68 1.153 0.385 8.339 254 1HG2 ILE 68 1HG2 ILE 68 -0.897 1.642 5.785 255 2HG2 ILE 68 2HG2 ILE 68 0.265 2.775 5.095 256 3HG2 ILE 68 3HG2 ILE 68 -0.825 3.302 6.381 257 1HD1 ILE 68 1HD1 ILE 68 -0.591 0.579 9.693 258 2HD1 ILE 68 2HD1 ILE 68 -1.726 0.646 8.346 259 3HD1 ILE 68 3HD1 ILE 68 -0.922 2.117 8.895 260 H VAL 69 H VAL 69 2.902 -0.570 6.859 261 HA VAL 69 HA VAL 69 2.794 -1.463 4.109 262 HB VAL 69 HB VAL 69 3.426 -3.085 6.575 263 1HG1 VAL 69 1HG1 VAL 69 4.045 -3.575 3.663 264 2HG1 VAL 69 2HG1 VAL 69 2.826 -4.421 4.616 265 3HG1 VAL 69 3HG1 VAL 69 4.535 -4.598 5.014 266 1HG2 VAL 69 1HG2 VAL 69 5.779 -2.692 6.029 267 2HG2 VAL 69 2HG2 VAL 69 4.941 -1.180 6.380 268 3HG2 VAL 69 3HG2 VAL 69 5.296 -1.625 4.710 269 H TYR 70 H TYR 70 1.279 -2.705 3.177 270 HA TYR 70 HA TYR 70 -0.764 -3.947 4.842 271 1HB TYR 70 2HB TYR 70 -1.148 -1.753 2.965 272 2HB TYR 70 1HB TYR 70 -2.142 -3.147 2.566 273 HD1 TYR 70 1HD TYR 70 -4.284 -2.977 3.343 274 HD2 TYR 70 2HD TYR 70 -1.126 -1.435 5.743 275 HE1 TYR 70 1HE TYR 70 -5.915 -2.343 5.070 276 HE2 TYR 70 2HE TYR 70 -2.750 -0.798 7.478 277 HH TYR 70 HH TYR 70 -5.724 -1.971 7.733 278 H ALA 71 H ALA 71 -1.840 -5.652 3.892 279 HA ALA 71 HA ALA 71 -0.355 -7.005 1.750 280 1HB ALA 71 1HB ALA 71 -0.985 -9.055 2.664 281 2HB ALA 71 2HB ALA 71 -2.343 -8.355 3.546 282 3HB ALA 71 3HB ALA 71 -0.692 -8.057 4.088 283 H VAL 72 H VAL 72 -1.486 -7.858 -0.043 284 HA VAL 72 HA VAL 72 -4.342 -7.269 -0.189 285 HB VAL 72 HB VAL 72 -2.685 -6.536 -2.561 286 1HG1 VAL 72 1HG1 VAL 72 -4.534 -5.319 -3.206 287 2HG1 VAL 72 2HG1 VAL 72 -5.098 -5.099 -1.548 288 3HG1 VAL 72 3HG1 VAL 72 -5.279 -6.664 -2.341 289 1HG2 VAL 72 1HG2 VAL 72 -2.984 -4.892 -0.062 290 2HG2 VAL 72 2HG2 VAL 72 -2.728 -4.147 -1.641 291 3HG2 VAL 72 3HG2 VAL 72 -1.521 -5.249 -0.979 292 H SER 73 H SER 73 -5.489 -8.702 -1.266 293 HA SER 73 HA SER 73 -4.358 -10.441 -3.267 294 1HB SER 73 2HB SER 73 -3.682 -11.803 -1.469 295 2HB SER 73 1HB SER 73 -5.137 -11.451 -0.540 296 HG SER 73 HG SER 73 -5.203 -12.837 -3.005 297 H SER 74 H SER 74 -5.970 -11.643 -4.413 298 HA SER 74 HA SER 74 -8.338 -10.274 -4.886 299 1HB SER 74 2HB SER 74 -7.041 -12.283 -6.146 300 2HB SER 74 1HB SER 74 -8.386 -13.182 -5.445 301 HG SER 74 HG SER 74 -8.708 -10.802 -6.952 302 H ASP 75 H ASP 75 -7.611 -12.594 -2.429 303 HA ASP 75 HA ASP 75 -10.357 -13.265 -1.892 304 1HB ASP 75 2HB ASP 75 -7.719 -14.178 -1.082 305 2HB ASP 75 1HB ASP 75 -8.821 -14.062 0.279 306 H ARG 76 H ARG 76 -8.080 -10.869 -0.865 307 HA ARG 76 HA ARG 76 -9.633 -10.211 1.514 308 1HB ARG 76 2HB ARG 76 -6.937 -9.538 0.489 309 2HB ARG 76 1HB ARG 76 -7.737 -8.297 1.442 310 1HG ARG 76 2HG ARG 76 -7.845 -9.669 3.342 311 2HG ARG 76 1HG ARG 76 -7.481 -11.125 2.411 312 1HD ARG 76 2HD ARG 76 -5.244 -10.679 2.329 313 2HD ARG 76 1HD ARG 76 -5.480 -8.932 2.387 314 HE ARG 76 HE ARG 76 -4.985 -10.639 4.585 315 1HH1 ARG 76 1HH1 ARG 76 -6.855 -7.839 3.667 316 2HH1 ARG 76 2HH1 ARG 76 -6.926 -7.204 5.276 317 1HH2 ARG 76 1HH2 ARG 76 -5.078 -9.805 6.702 318 2HH2 ARG 76 2HH2 ARG 76 -5.917 -8.319 6.999 319 H PHE 77 H PHE 77 -8.623 -8.676 -1.529 320 HA PHE 77 HA PHE 77 -10.882 -6.816 -1.227 321 1HB PHE 77 2HB PHE 77 -8.252 -6.115 -2.535 322 2HB PHE 77 1HB PHE 77 -9.587 -5.028 -2.163 323 HD1 PHE 77 1HD PHE 77 -9.943 -4.220 0.082 324 HD2 PHE 77 2HD PHE 77 -6.745 -6.884 -0.805 325 HE1 PHE 77 1HE PHE 77 -8.912 -3.700 2.255 326 HE2 PHE 77 2HE PHE 77 -5.709 -6.370 1.368 327 HZ PHE 77 HZ PHE 77 -6.793 -4.776 2.900 328 H ARG 78 H ARG 78 -12.324 -7.071 -2.779 329 HA ARG 78 HA ARG 78 -11.921 -8.725 -5.017 330 1HB ARG 78 2HB ARG 78 -14.075 -7.208 -3.797 331 2HB ARG 78 1HB ARG 78 -14.156 -7.170 -5.546 332 1HG ARG 78 2HG ARG 78 -14.007 -9.658 -3.863 333 2HG ARG 78 1HG ARG 78 -15.470 -9.001 -4.597 334 1HD ARG 78 2HD ARG 78 -14.931 -9.750 -6.656 335 2HD ARG 78 1HD ARG 78 -13.213 -9.422 -6.437 336 HE ARG 78 HE ARG 78 -14.171 -11.649 -4.893 337 1HH1 ARG 78 1HH1 ARG 78 -12.920 -10.643 -7.992 338 2HH1 ARG 78 2HH1 ARG 78 -12.324 -12.217 -8.402 339 1HH2 ARG 78 1HH2 ARG 78 -13.387 -13.718 -5.430 340 2HH2 ARG 78 2HH2 ARG 78 -12.589 -13.963 -6.948 341 H SER 79 H SER 79 -11.360 -5.357 -4.486 342 HA SER 79 HA SER 79 -10.189 -5.071 -7.079 343 1HB SER 79 2HB SER 79 -12.844 -3.786 -6.494 344 2HB SER 79 1HB SER 79 -11.706 -3.036 -7.614 345 HG SER 79 HG SER 79 -11.693 -5.200 -8.655 346 H PHE 80 H PHE 80 -9.550 -2.684 -7.437 347 HA PHE 80 HA PHE 80 -7.905 -1.887 -5.316 348 1HB PHE 80 2HB PHE 80 -8.078 -1.256 -7.968 349 2HB PHE 80 1HB PHE 80 -8.646 0.234 -7.221 350 HD1 PHE 80 1HD PHE 80 -6.018 -2.210 -6.212 351 HD2 PHE 80 2HD PHE 80 -6.950 1.787 -7.329 352 HE1 PHE 80 1HE PHE 80 -3.690 -1.548 -5.774 353 HE2 PHE 80 2HE PHE 80 -4.630 2.455 -6.900 354 HZ PHE 80 HZ PHE 80 -2.992 0.787 -6.120 355 H ASP 81 H ASP 81 -11.156 -0.924 -6.213 356 HA ASP 81 HA ASP 81 -11.360 1.403 -4.659 357 1HB ASP 81 2HB ASP 81 -13.275 -0.507 -5.891 358 2HB ASP 81 1HB ASP 81 -13.898 0.524 -4.607 359 H ALA 82 H ALA 82 -11.871 -1.994 -3.881 360 HA ALA 82 HA ALA 82 -12.882 -1.565 -1.261 361 1HB ALA 82 1HB ALA 82 -11.624 -4.063 -1.320 362 2HB ALA 82 2HB ALA 82 -12.254 -3.794 -2.946 363 3HB ALA 82 3HB ALA 82 -13.335 -3.712 -1.554 364 H LEU 83 H LEU 83 -9.670 -2.129 -2.602 365 HA LEU 83 HA LEU 83 -8.302 -2.359 -0.135 366 1HB LEU 83 2HB LEU 83 -7.398 -3.010 -2.382 367 2HB LEU 83 1HB LEU 83 -7.239 -1.309 -2.760 368 HG LEU 83 HG LEU 83 -5.628 -1.034 -0.938 369 1HD1 LEU 83 1HD1 LEU 83 -6.427 -3.827 -0.370 370 2HD1 LEU 83 2HD1 LEU 83 -5.995 -2.521 0.733 371 3HD1 LEU 83 3HD1 LEU 83 -4.733 -3.403 -0.127 372 1HD2 LEU 83 1HD2 LEU 83 -4.427 -3.337 -2.282 373 2HD2 LEU 83 2HD2 LEU 83 -3.932 -1.645 -2.264 374 3HD2 LEU 83 3HD2 LEU 83 -5.190 -2.183 -3.376 375 H LEU 84 H LEU 84 -8.962 0.296 -2.337 376 HA LEU 84 HA LEU 84 -7.632 2.327 -0.948 377 1HB LEU 84 2HB LEU 84 -9.936 2.275 -2.866 378 2HB LEU 84 1HB LEU 84 -9.474 3.782 -2.095 379 HG LEU 84 HG LEU 84 -7.592 2.083 -3.730 380 1HD1 LEU 84 1HD1 LEU 84 -9.421 4.323 -4.483 381 2HD1 LEU 84 2HD1 LEU 84 -9.086 2.814 -5.332 382 3HD1 LEU 84 3HD1 LEU 84 -7.886 4.107 -5.323 383 1HD2 LEU 84 1HD2 LEU 84 -7.398 4.847 -2.551 384 2HD2 LEU 84 2HD2 LEU 84 -6.268 4.199 -3.740 385 3HD2 LEU 84 3HD2 LEU 84 -6.413 3.439 -2.153 386 H ALA 85 H ALA 85 -10.781 0.826 -0.486 387 HA ALA 85 HA ALA 85 -11.865 2.771 1.272 388 1HB ALA 85 1HB ALA 85 -13.142 0.939 0.155 389 2HB ALA 85 2HB ALA 85 -13.454 1.082 1.886 390 3HB ALA 85 3HB ALA 85 -12.396 -0.194 1.283 391 H ASP 86 H ASP 86 -10.025 -0.202 1.828 392 HA ASP 86 HA ASP 86 -9.952 0.088 4.667 393 1HB ASP 86 2HB ASP 86 -8.766 -1.743 2.657 394 2HB ASP 86 1HB ASP 86 -7.884 -1.577 4.172 395 H LEU 87 H LEU 87 -7.893 0.969 1.985 396 HA LEU 87 HA LEU 87 -5.600 1.708 3.449 397 1HB LEU 87 2HB LEU 87 -6.662 2.625 0.779 398 2HB LEU 87 1HB LEU 87 -5.135 3.187 1.424 399 HG LEU 87 HG LEU 87 -5.838 0.584 0.209 400 1HD1 LEU 87 1HD1 LEU 87 -3.160 1.908 0.396 401 2HD1 LEU 87 2HD1 LEU 87 -4.391 2.465 -0.736 402 3HD1 LEU 87 3HD1 LEU 87 -3.776 0.816 -0.844 403 1HD2 LEU 87 1HD2 LEU 87 -5.303 -0.034 2.561 404 2HD2 LEU 87 2HD2 LEU 87 -3.731 0.740 2.363 405 3HD2 LEU 87 3HD2 LEU 87 -4.153 -0.663 1.383 406 H THR 88 H THR 88 -8.431 3.559 2.428 407 HA THR 88 HA THR 88 -7.579 6.062 3.332 408 HB THR 88 HB THR 88 -10.309 4.823 2.972 409 HG1 THR 88 1HG THR 88 -10.251 5.785 1.059 410 1HG2 THR 88 1HG2 THR 88 -11.317 6.517 3.932 411 2HG2 THR 88 2HG2 THR 88 -10.488 7.631 2.846 412 3HG2 THR 88 3HG2 THR 88 -9.762 7.204 4.395 413 H ARG 89 H ARG 89 -9.169 3.369 4.925 414 HA ARG 89 HA ARG 89 -9.664 4.681 7.390 415 1HB ARG 89 2HB ARG 89 -10.860 2.645 6.637 416 2HB ARG 89 1HB ARG 89 -9.378 1.723 6.844 417 1HG ARG 89 2HG ARG 89 -10.228 3.254 9.202 418 2HG ARG 89 1HG ARG 89 -11.315 1.952 8.712 419 1HD ARG 89 2HD ARG 89 -9.886 0.361 9.374 420 2HD ARG 89 1HD ARG 89 -8.498 1.190 8.672 421 HE ARG 89 HE ARG 89 -9.007 2.671 10.855 422 1HH1 ARG 89 1HH1 ARG 89 -8.641 -0.771 10.401 423 2HH1 ARG 89 2HH1 ARG 89 -8.018 -1.040 11.994 424 1HH2 ARG 89 1HH2 ARG 89 -8.186 2.317 12.949 425 2HH2 ARG 89 2HH2 ARG 89 -7.759 0.711 13.440 426 H SER 90 H SER 90 -7.036 2.526 6.274 427 HA SER 90 HA SER 90 -5.699 2.577 8.803 428 1HB SER 90 2HB SER 90 -5.548 0.938 6.654 429 2HB SER 90 1HB SER 90 -4.108 1.925 6.401 430 HG SER 90 HG SER 90 -4.659 0.061 8.364 431 H LEU 91 H LEU 91 -5.310 4.362 5.773 432 HA LEU 91 HA LEU 91 -3.048 5.804 6.875 433 1HB LEU 91 2HB LEU 91 -4.141 5.227 4.220 434 2HB LEU 91 1HB LEU 91 -3.551 6.856 4.404 435 HG LEU 91 HG LEU 91 -2.026 4.281 4.593 436 1HD1 LEU 91 1HD1 LEU 91 -0.626 6.252 3.189 437 2HD1 LEU 91 2HD1 LEU 91 -2.309 6.399 2.679 438 3HD1 LEU 91 3HD1 LEU 91 -1.474 4.853 2.529 439 1HD2 LEU 91 1HD2 LEU 91 -0.074 5.920 5.172 440 2HD2 LEU 91 2HD2 LEU 91 -1.102 5.268 6.451 441 3HD2 LEU 91 3HD2 LEU 91 -1.370 6.906 5.849 442 H SER 92 H SER 92 -6.320 6.065 7.050 443 HA SER 92 HA SER 92 -7.287 8.441 6.369 444 1HB SER 92 2HB SER 92 -8.344 8.514 8.760 445 2HB SER 92 1HB SER 92 -8.742 7.187 7.669 446 HG SER 92 HG SER 92 -6.911 7.182 9.830 447 H ASP 93 H ASP 93 -6.798 10.491 6.510 448 HA ASP 93 HA ASP 93 -5.558 11.624 8.858 449 1HB ASP 93 2HB ASP 93 -4.021 10.981 6.464 450 2HB ASP 93 1HB ASP 93 -3.923 12.689 6.872 451 H ASN 94 H ASN 94 -4.779 14.084 7.610 452 HA ASN 94 HA ASN 94 -6.957 15.065 6.029 453 1HB ASN 94 2HB ASN 94 -7.780 16.699 7.704 454 2HB ASN 94 1HB ASN 94 -8.103 15.030 8.162 455 1HD2 ASN 94 1HD2 ASN 94 -7.693 14.555 10.186 456 2HD2 ASN 94 2HD2 ASN 94 -6.548 15.344 11.210 457 H ILE 95 H ILE 95 -3.977 15.014 6.144 458 HA ILE 95 HA ILE 95 -3.459 17.902 6.072 459 HB ILE 95 HB ILE 95 -1.046 16.336 5.950 460 1HG1 ILE 95 2HG1 ILE 95 -2.395 14.647 7.185 461 2HG1 ILE 95 1HG1 ILE 95 -1.072 15.302 8.144 462 1HG2 ILE 95 1HG2 ILE 95 -0.942 18.582 6.586 463 2HG2 ILE 95 2HG2 ILE 95 -0.613 17.677 8.063 464 3HG2 ILE 95 3HG2 ILE 95 -2.207 18.383 7.797 465 1HD1 ILE 95 1HD1 ILE 95 -3.580 15.026 9.044 466 2HD1 ILE 95 2HD1 ILE 95 -3.658 16.675 8.425 467 3HD1 ILE 95 3HD1 ILE 95 -2.455 16.246 9.641 468 H ASN 96 H ASN 96 -1.843 15.090 4.628 469 HA ASN 96 HA ASN 96 -1.719 16.501 2.078 470 1HB ASN 96 2HB ASN 96 -0.359 14.013 3.113 471 2HB ASN 96 1HB ASN 96 -0.214 14.560 1.447 472 1HD2 ASN 96 1HD2 ASN 96 0.783 15.007 4.689 473 2HD2 ASN 96 2HD2 ASN 96 1.919 16.277 4.402 474 H LEU 97 H LEU 97 -3.401 13.911 3.611 475 HA LEU 97 HA LEU 97 -4.464 12.999 1.024 476 1HB LEU 97 2HB LEU 97 -4.060 11.677 3.663 477 2HB LEU 97 1HB LEU 97 -5.396 11.140 2.665 478 HG LEU 97 HG LEU 97 -2.549 11.232 1.683 479 1HD1 LEU 97 1HD1 LEU 97 -2.224 9.602 3.204 480 2HD1 LEU 97 2HD1 LEU 97 -3.031 8.612 1.988 481 3HD1 LEU 97 3HD1 LEU 97 -3.945 9.247 3.356 482 1HD2 LEU 97 1HD2 LEU 97 -4.986 10.892 0.357 483 2HD2 LEU 97 2HD2 LEU 97 -4.279 9.281 0.476 484 3HD2 LEU 97 3HD2 LEU 97 -3.367 10.590 -0.275 485 HA PRO 98 HA PRO 98 -7.892 15.749 2.350 486 1HB PRO 98 2HB PRO 98 -8.843 14.498 -0.202 487 2HB PRO 98 1HB PRO 98 -8.985 16.164 0.351 488 1HG PRO 98 2HG PRO 98 -7.145 15.512 -1.439 489 2HG PRO 98 1HG PRO 98 -6.763 16.655 -0.137 490 1HD PRO 98 2HD PRO 98 -5.959 13.802 -0.452 491 2HD PRO 98 1HD PRO 98 -5.077 15.151 0.292 492 H GLN 99 H GLN 99 -8.993 12.895 0.541 493 HA GLN 99 HA GLN 99 -10.767 12.257 2.789 494 1HB GLN 99 2HB GLN 99 -10.965 11.265 -0.055 495 2HB GLN 99 1HB GLN 99 -12.179 11.118 1.208 496 1HG GLN 99 2HG GLN 99 -12.981 13.167 0.845 497 2HG GLN 99 1HG GLN 99 -11.373 13.870 0.673 498 1HE2 GLN 99 1HE2 GLN 99 -10.455 14.041 -1.341 499 2HE2 GLN 99 2HE2 GLN 99 -11.336 13.769 -2.802 500 H GLY 100 H GLY 100 -8.270 11.451 3.313 501 1HA GLY 100 2HA GLY 100 -7.236 9.554 4.131 502 2HA GLY 100 1HA GLY 100 -8.582 8.608 3.517 503 H VAL 101 H VAL 101 -8.577 8.059 1.235 504 HA VAL 101 HA VAL 101 -6.207 8.417 -0.352 505 HB VAL 101 HB VAL 101 -6.790 5.616 0.650 506 1HG1 VAL 101 1HG1 VAL 101 -5.956 5.887 -1.712 507 2HG1 VAL 101 2HG1 VAL 101 -4.947 4.897 -0.660 508 3HG1 VAL 101 3HG1 VAL 101 -4.477 6.556 -1.030 509 1HG2 VAL 101 1HG2 VAL 101 -4.530 7.493 1.324 510 2HG2 VAL 101 2HG2 VAL 101 -4.516 5.765 1.670 511 3HG2 VAL 101 3HG2 VAL 101 -5.720 6.805 2.430 512 H ARG 102 H ARG 102 -7.154 8.777 -2.247 513 HA ARG 102 HA ARG 102 -9.524 7.227 -2.980 514 1HB ARG 102 2HB ARG 102 -8.659 9.956 -3.443 515 2HB ARG 102 1HB ARG 102 -9.130 9.161 -4.939 516 1HG ARG 102 2HG ARG 102 -10.906 8.927 -2.566 517 2HG ARG 102 1HG ARG 102 -10.883 10.436 -3.484 518 1HD ARG 102 2HD ARG 102 -12.553 8.531 -4.117 519 2HD ARG 102 1HD ARG 102 -11.747 9.462 -5.373 520 HE ARG 102 HE ARG 102 -10.104 7.515 -5.415 521 1HH1 ARG 102 1HH1 ARG 102 -13.486 7.134 -4.587 522 2HH1 ARG 102 2HH1 ARG 102 -13.543 5.482 -5.094 523 1HH2 ARG 102 1HH2 ARG 102 -10.196 5.348 -6.077 524 2HH2 ARG 102 2HH2 ARG 102 -11.681 4.469 -5.938 525 H TYR 103 H TYR 103 -6.236 7.903 -3.985 526 HA TYR 103 HA TYR 103 -6.490 5.700 -5.884 527 1HB TYR 103 2HB TYR 103 -5.125 8.232 -6.774 528 2HB TYR 103 1HB TYR 103 -5.605 6.843 -7.727 529 HD1 TYR 103 1HD TYR 103 -7.923 6.487 -8.364 530 HD2 TYR 103 2HD TYR 103 -6.726 9.972 -6.243 531 HE1 TYR 103 1HE TYR 103 -10.027 7.576 -8.990 532 HE2 TYR 103 2HE TYR 103 -8.839 11.075 -6.855 533 HH TYR 103 HH TYR 103 -10.854 9.978 -9.259 534 H ILE 104 H ILE 104 -4.437 4.915 -6.693 535 HA ILE 104 HA ILE 104 -2.232 5.396 -4.802 536 HB ILE 104 HB ILE 104 -2.956 2.766 -6.095 537 1HG1 ILE 104 2HG1 ILE 104 -3.381 3.820 -3.298 538 2HG1 ILE 104 1HG1 ILE 104 -4.603 3.251 -4.430 539 1HG2 ILE 104 1HG2 ILE 104 -0.497 3.540 -5.310 540 2HG2 ILE 104 2HG2 ILE 104 -1.068 1.872 -5.281 541 3HG2 ILE 104 3HG2 ILE 104 -1.113 2.846 -3.812 542 1HD1 ILE 104 1HD1 ILE 104 -2.991 1.768 -2.524 543 2HD1 ILE 104 2HD1 ILE 104 -2.959 1.066 -4.141 544 3HD1 ILE 104 3HD1 ILE 104 -4.500 1.323 -3.323 545 H TYR 105 H TYR 105 -0.372 5.995 -5.730 546 HA TYR 105 HA TYR 105 -0.137 5.741 -8.631 547 1HB TYR 105 2HB TYR 105 0.468 7.856 -6.733 548 2HB TYR 105 1HB TYR 105 1.826 7.507 -7.804 549 HD1 TYR 105 1HD TYR 105 1.309 7.345 -10.302 550 HD2 TYR 105 2HD TYR 105 -1.264 9.198 -7.481 551 HE1 TYR 105 1HE TYR 105 0.217 8.553 -12.116 552 HE2 TYR 105 2HE TYR 105 -2.372 10.424 -9.283 553 HH TYR 105 HH TYR 105 -1.892 11.176 -11.580 554 H THR 106 H THR 106 2.066 5.582 -9.503 555 HA THR 106 HA THR 106 3.378 3.300 -8.383 556 HB THR 106 HB THR 106 5.120 3.994 -10.236 557 HG1 THR 106 1HG THR 106 3.920 6.102 -10.396 558 1HG2 THR 106 1HG2 THR 106 2.473 2.743 -10.490 559 2HG2 THR 106 2HG2 THR 106 4.068 2.146 -10.949 560 3HG2 THR 106 3HG2 THR 106 3.219 3.287 -11.993 561 H ILE 107 H ILE 107 5.671 3.223 -7.823 562 HA ILE 107 HA ILE 107 6.378 4.845 -5.741 563 HB ILE 107 HB ILE 107 7.491 2.706 -6.359 564 1HG1 ILE 107 2HG1 ILE 107 9.722 3.372 -5.543 565 2HG1 ILE 107 1HG1 ILE 107 9.329 5.059 -5.865 566 1HG2 ILE 107 1HG2 ILE 107 9.165 4.362 -8.230 567 2HG2 ILE 107 2HG2 ILE 107 7.820 3.352 -8.762 568 3HG2 ILE 107 3HG2 ILE 107 9.221 2.617 -7.980 569 1HD1 ILE 107 1HD1 ILE 107 7.929 5.216 -4.070 570 2HD1 ILE 107 2HD1 ILE 107 9.091 4.037 -3.463 571 3HD1 ILE 107 3HD1 ILE 107 7.531 3.498 -4.087 572 H ASP 108 H ASP 108 6.723 5.507 -9.140 573 HA ASP 108 HA ASP 108 8.343 7.886 -8.592 574 1HB ASP 108 2HB ASP 108 7.721 6.319 -11.076 575 2HB ASP 108 1HB ASP 108 8.300 7.978 -11.197 576 H GLY 109 H GLY 109 5.109 6.990 -9.091 577 1HA GLY 109 2HA GLY 109 3.225 8.334 -9.025 578 2HA GLY 109 1HA GLY 109 4.271 9.745 -9.073 579 H SER 110 H SER 110 4.870 7.428 -11.509 580 HA SER 110 HA SER 110 4.231 9.247 -13.579 581 1HB SER 110 2HB SER 110 5.146 6.403 -13.464 582 2HB SER 110 1HB SER 110 4.554 7.048 -14.994 583 HG SER 110 HG SER 110 6.675 7.520 -15.012 584 H ARG 111 H ARG 111 2.610 6.302 -12.407 585 HA ARG 111 HA ARG 111 0.144 7.240 -13.630 586 1HB ARG 111 2HB ARG 111 -0.270 4.879 -14.467 587 2HB ARG 111 1HB ARG 111 0.923 5.818 -15.355 588 1HG ARG 111 2HG ARG 111 2.725 4.663 -14.229 589 2HG ARG 111 1HG ARG 111 1.567 3.776 -13.236 590 1HD ARG 111 2HD ARG 111 0.651 3.192 -15.708 591 2HD ARG 111 1HD ARG 111 2.372 3.370 -16.040 592 HE ARG 111 HE ARG 111 1.792 1.701 -13.771 593 1HH1 ARG 111 1HH1 ARG 111 2.190 1.787 -17.238 594 2HH1 ARG 111 2HH1 ARG 111 2.594 0.108 -17.359 595 1HH2 ARG 111 1HH2 ARG 111 2.322 -0.507 -13.928 596 2HH2 ARG 111 2HH2 ARG 111 2.668 -1.195 -15.480 597 H LYS 112 H LYS 112 -1.709 6.442 -12.687 598 HA LYS 112 HA LYS 112 -1.363 5.387 -9.994 599 1HB LYS 112 2HB LYS 112 -2.784 7.185 -9.814 600 2HB LYS 112 1HB LYS 112 -3.491 6.936 -11.396 601 1HG LYS 112 2HG LYS 112 -4.510 4.797 -10.194 602 2HG LYS 112 1HG LYS 112 -4.263 5.806 -8.770 603 1HD LYS 112 2HD LYS 112 -5.892 6.458 -11.224 604 2HD LYS 112 1HD LYS 112 -6.486 6.198 -9.583 605 1HE LYS 112 2HE LYS 112 -6.481 8.481 -9.638 606 2HE LYS 112 1HE LYS 112 -4.845 8.193 -9.045 607 1HZ LYS 112 1HZ LYS 112 -5.405 9.748 -11.126 608 2HZ LYS 112 2HZ LYS 112 -5.146 8.284 -11.932 609 3HZ LYS 112 3HZ LYS 112 -3.933 8.933 -10.947 610 H ILE 113 H ILE 113 -2.209 3.471 -9.288 611 HA ILE 113 HA ILE 113 -2.704 1.471 -11.298 612 HB ILE 113 HB ILE 113 -2.734 1.232 -8.289 613 1HG1 ILE 113 2HG1 ILE 113 -0.576 2.019 -9.490 614 2HG1 ILE 113 1HG1 ILE 113 -0.470 0.700 -8.331 615 1HG2 ILE 113 1HG2 ILE 113 -3.127 -0.698 -10.474 616 2HG2 ILE 113 2HG2 ILE 113 -3.694 -0.735 -8.804 617 3HG2 ILE 113 3HG2 ILE 113 -2.038 -1.208 -9.184 618 1HD1 ILE 113 1HD1 ILE 113 0.261 -0.724 -9.873 619 2HD1 ILE 113 2HD1 ILE 113 0.527 0.700 -10.882 620 3HD1 ILE 113 3HD1 ILE 113 -0.967 -0.223 -11.036 621 H GLY 114 H GLY 114 -4.566 0.363 -11.675 622 1HA GLY 114 2HA GLY 114 -6.985 1.338 -10.287 623 2HA GLY 114 1HA GLY 114 -6.952 0.943 -12.000 624 H SER 115 H SER 115 -5.189 -1.422 -11.405 625 HA SER 115 HA SER 115 -7.256 -3.174 -10.251 626 1HB SER 115 2HB SER 115 -5.396 -4.352 -12.232 627 2HB SER 115 1HB SER 115 -7.122 -4.631 -11.995 628 HG SER 115 HG SER 115 -6.001 -3.169 -13.851 629 H MET 116 H MET 116 -6.572 -4.947 -9.060 630 HA MET 116 HA MET 116 -4.289 -4.585 -7.464 631 1HB MET 116 2HB MET 116 -6.574 -6.106 -7.320 632 2HB MET 116 1HB MET 116 -5.331 -7.324 -7.569 633 1HG MET 116 2HG MET 116 -4.431 -7.020 -5.533 634 2HG MET 116 1HG MET 116 -4.720 -5.281 -5.545 635 1HE MET 116 1HE MET 116 -7.816 -4.461 -4.415 636 2HE MET 116 2HE MET 116 -6.082 -4.157 -4.507 637 3HE MET 116 3HE MET 116 -6.790 -4.781 -3.017 638 H ASP 117 H ASP 117 -4.798 -6.262 -10.455 639 HA ASP 117 HA ASP 117 -2.708 -8.095 -10.390 640 1HB ASP 117 2HB ASP 117 -4.525 -6.952 -12.344 641 2HB ASP 117 1HB ASP 117 -2.948 -7.282 -13.032 642 H GLU 118 H GLU 118 -2.614 -4.671 -10.585 643 HA GLU 118 HA GLU 118 -0.020 -4.603 -11.886 644 1HB GLU 118 2HB GLU 118 -1.756 -2.426 -10.721 645 2HB GLU 118 1HB GLU 118 -0.200 -2.135 -11.486 646 1HG GLU 118 2HG GLU 118 -2.505 -3.477 -12.870 647 2HG GLU 118 1HG GLU 118 -2.200 -1.743 -12.933 648 H LEU 119 H LEU 119 -1.229 -4.895 -8.710 649 HA LEU 119 HA LEU 119 1.036 -3.673 -7.405 650 1HB LEU 119 2HB LEU 119 -0.795 -5.533 -5.969 651 2HB LEU 119 1HB LEU 119 -0.052 -4.047 -5.412 652 HG LEU 119 HG LEU 119 -2.393 -4.248 -7.305 653 1HD1 LEU 119 1HD1 LEU 119 -2.369 -3.106 -4.529 654 2HD1 LEU 119 2HD1 LEU 119 -2.743 -4.800 -4.850 655 3HD1 LEU 119 3HD1 LEU 119 -3.755 -3.528 -5.535 656 1HD2 LEU 119 1HD2 LEU 119 -0.820 -2.320 -7.681 657 2HD2 LEU 119 2HD2 LEU 119 -1.234 -1.768 -6.058 658 3HD2 LEU 119 3HD2 LEU 119 -2.484 -1.882 -7.296 659 H GLU 120 H GLU 120 2.956 -4.636 -7.380 660 HA GLU 120 HA GLU 120 3.102 -7.559 -7.445 661 1HB GLU 120 2HB GLU 120 5.404 -5.635 -7.717 662 2HB GLU 120 1HB GLU 120 5.329 -7.313 -8.215 663 1HG GLU 120 2HG GLU 120 3.714 -6.741 -9.949 664 2HG GLU 120 1HG GLU 120 3.779 -5.052 -9.446 665 H GLU 121 H GLU 121 4.581 -8.672 -6.003 666 HA GLU 121 HA GLU 121 4.255 -8.028 -3.323 667 1HB GLU 121 2HB GLU 121 6.282 -9.786 -4.687 668 2HB GLU 121 1HB GLU 121 6.191 -9.629 -2.936 669 1HG GLU 121 2HG GLU 121 4.710 -11.274 -2.954 670 2HG GLU 121 1HG GLU 121 3.582 -10.162 -3.728 671 H GLY 122 H GLY 122 5.868 -7.517 -1.700 672 1HA GLY 122 2HA GLY 122 7.180 -5.839 -0.828 673 2HA GLY 122 1HA GLY 122 8.374 -6.577 -1.873 674 H GLU 123 H GLU 123 5.496 -4.658 -2.665 675 HA GLU 123 HA GLU 123 7.218 -2.915 -4.282 676 1HB GLU 123 2HB GLU 123 4.341 -3.681 -4.391 677 2HB GLU 123 1HB GLU 123 4.818 -2.124 -5.053 678 1HG GLU 123 2HG GLU 123 6.053 -4.745 -5.856 679 2HG GLU 123 1HG GLU 123 4.723 -3.968 -6.713 680 H SER 124 H SER 124 6.704 -0.623 -4.405 681 HA SER 124 HA SER 124 5.804 0.466 -1.817 682 1HB SER 124 2HB SER 124 7.933 1.540 -3.688 683 2HB SER 124 1HB SER 124 7.357 2.366 -2.241 684 HG SER 124 HG SER 124 8.768 -0.081 -2.417 685 H TYR 125 H TYR 125 4.018 1.672 -1.948 686 HA TYR 125 HA TYR 125 3.403 2.952 -4.523 687 1HB TYR 125 2HB TYR 125 1.615 1.383 -2.734 688 2HB TYR 125 1HB TYR 125 0.952 2.613 -3.785 689 HD1 TYR 125 1HD TYR 125 1.439 2.470 -6.243 690 HD2 TYR 125 2HD TYR 125 2.123 -0.769 -3.587 691 HE1 TYR 125 1HE TYR 125 1.485 0.950 -8.141 692 HE2 TYR 125 2HE TYR 125 2.161 -2.327 -5.487 693 HH TYR 125 HH TYR 125 0.960 -1.776 -8.344 694 H VAL 126 H VAL 126 1.975 4.723 -4.460 695 HA VAL 126 HA VAL 126 2.199 6.268 -1.946 696 HB VAL 126 HB VAL 126 2.603 7.168 -4.780 697 1HG1 VAL 126 1HG1 VAL 126 1.390 8.734 -2.569 698 2HG1 VAL 126 2HG1 VAL 126 1.180 8.888 -4.314 699 3HG1 VAL 126 3HG1 VAL 126 2.629 9.533 -3.538 700 1HG2 VAL 126 1HG2 VAL 126 4.649 7.911 -4.048 701 2HG2 VAL 126 2HG2 VAL 126 4.408 6.512 -3.002 702 3HG2 VAL 126 3HG2 VAL 126 4.092 8.137 -2.391 703 H CYS 127 H CYS 127 0.447 7.339 -1.196 704 HA CYS 127 HA CYS 127 -2.097 6.724 -2.492 705 1HB CYS 127 2HB CYS 127 -1.342 7.648 0.269 706 2HB CYS 127 1HB CYS 127 -3.007 7.723 -0.294 707 HG CYS 127 HG CYS 127 -1.714 4.951 -0.477 708 H SER 128 H SER 128 -3.317 8.199 -3.487 709 HA SER 128 HA SER 128 -2.702 11.046 -3.104 710 1HB SER 128 2HB SER 128 -3.162 9.699 -5.781 711 2HB SER 128 1HB SER 128 -2.924 11.431 -5.519 712 HG SER 128 HG SER 128 -0.913 10.850 -5.897 713 H SER 129 H SER 129 -4.435 12.479 -3.886 714 HA SER 129 HA SER 129 -7.057 11.315 -4.259 715 1HB SER 129 2HB SER 129 -7.029 13.292 -2.055 716 2HB SER 129 1HB SER 129 -8.011 11.842 -2.259 717 HG SER 129 HG SER 129 -6.708 11.070 -0.797 718 H ASP 130 H ASP 130 -5.287 14.305 -3.516 719 HA ASP 130 HA ASP 130 -6.420 15.564 -5.873 720 1HB ASP 130 2HB ASP 130 -7.739 15.957 -3.508 721 2HB ASP 130 1HB ASP 130 -6.621 17.317 -3.517 722 H ASN 131 H ASN 131 -3.774 14.704 -4.917 723 HA ASN 131 HA ASN 131 -2.391 17.277 -4.646 724 1HB ASN 131 2HB ASN 131 -1.170 14.534 -4.350 725 2HB ASN 131 1HB ASN 131 -0.520 16.071 -3.789 726 1HD2 ASN 131 1HD2 ASN 131 -2.671 13.469 -3.142 727 2HD2 ASN 131 2HD2 ASN 131 -3.140 13.963 -1.555 728 H PHE 132 H PHE 132 0.132 16.375 -5.613 729 HA PHE 132 HA PHE 132 -0.279 15.580 -8.375 730 1HB PHE 132 2HB PHE 132 0.948 17.568 -9.238 731 2HB PHE 132 1HB PHE 132 -0.617 17.966 -8.538 732 HD1 PHE 132 1HD PHE 132 -0.615 18.750 -6.080 733 HD2 PHE 132 2HD PHE 132 2.843 18.708 -8.560 734 HE1 PHE 132 1HE PHE 132 0.462 20.394 -4.599 735 HE2 PHE 132 2HE PHE 132 3.925 20.352 -7.083 736 HZ PHE 132 HZ PHE 132 2.735 21.198 -5.100 737 H PHE 133 H PHE 133 1.054 14.405 -6.121 738 HA PHE 133 HA PHE 133 2.960 13.290 -5.612 739 1HB PHE 133 2HB PHE 133 2.726 12.811 -8.109 740 2HB PHE 133 1HB PHE 133 3.961 14.038 -8.345 741 HD1 PHE 133 1HD PHE 133 3.427 11.103 -6.103 742 HD2 PHE 133 2HD PHE 133 6.075 13.218 -8.676 743 HE1 PHE 133 1HE PHE 133 5.162 9.405 -5.705 744 HE2 PHE 133 2HE PHE 133 7.816 11.526 -8.282 745 HZ PHE 133 HZ PHE 133 7.362 9.616 -6.796 746 H LYS 134 H LYS 134 4.753 13.787 -4.468 747 HA LYS 134 HA LYS 134 5.814 16.508 -4.783 748 1HB LYS 134 2HB LYS 134 6.142 14.722 -2.378 749 2HB LYS 134 1HB LYS 134 6.440 16.452 -2.479 750 1HG LYS 134 2HG LYS 134 3.720 15.812 -3.210 751 2HG LYS 134 1HG LYS 134 4.123 15.198 -1.605 752 1HD LYS 134 2HD LYS 134 4.987 17.463 -1.028 753 2HD LYS 134 1HD LYS 134 4.392 18.038 -2.587 754 1HE LYS 134 2HE LYS 134 2.116 17.252 -1.917 755 2HE LYS 134 1HE LYS 134 2.767 16.904 -0.315 756 1HZ LYS 134 1HZ LYS 134 1.888 19.010 -0.081 757 2HZ LYS 134 2HZ LYS 134 2.369 19.516 -1.622 758 3HZ LYS 134 3HZ LYS 134 3.516 19.348 -0.391 759 H LYS 135 H LYS 135 6.592 13.513 -5.748 760 HA LYS 135 HA LYS 135 8.513 12.372 -6.239 761 1HB LYS 135 2HB LYS 135 9.899 15.002 -6.561 762 2HB LYS 135 1HB LYS 135 9.986 13.568 -7.572 763 1HG LYS 135 2HG LYS 135 8.585 14.567 -8.965 764 2HG LYS 135 1HG LYS 135 7.332 14.390 -7.737 765 1HD LYS 135 2HD LYS 135 7.380 16.574 -7.195 766 2HD LYS 135 1HD LYS 135 9.138 16.669 -7.326 767 1HE LYS 135 2HE LYS 135 8.161 16.263 -9.935 768 2HE LYS 135 1HE LYS 135 7.128 17.488 -9.202 769 1HZ LYS 135 1HZ LYS 135 9.528 18.355 -8.458 770 2HZ LYS 135 2HZ LYS 135 8.765 18.847 -9.883 771 3HZ LYS 135 3HZ LYS 135 9.933 17.625 -9.929 772 H VAL 136 H VAL 136 8.948 11.494 -4.175 773 HA VAL 136 HA VAL 136 11.245 12.756 -2.828 774 HB VAL 136 HB VAL 136 10.095 11.268 -0.825 775 1HG1 VAL 136 1HG1 VAL 136 9.323 13.564 0.001 776 2HG1 VAL 136 2HG1 VAL 136 10.026 14.182 -1.494 777 3HG1 VAL 136 3HG1 VAL 136 11.040 13.326 -0.333 778 1HG2 VAL 136 1HG2 VAL 136 7.850 12.742 -2.196 779 2HG2 VAL 136 2HG2 VAL 136 7.762 11.827 -0.691 780 3HG2 VAL 136 3HG2 VAL 136 8.056 10.990 -2.214 781 H GLU 137 H GLU 137 12.484 11.193 -1.459 782 HA GLU 137 HA GLU 137 13.036 8.848 -3.027 783 1HB GLU 137 2HB GLU 137 14.297 10.123 -0.622 784 2HB GLU 137 1HB GLU 137 14.713 8.468 -1.047 785 1HG GLU 137 2HG GLU 137 16.333 9.990 -1.969 786 2HG GLU 137 1HG GLU 137 15.417 9.230 -3.269 787 H TYR 138 H TYR 138 10.849 8.102 -2.675 788 HA TYR 138 HA TYR 138 9.818 7.180 -0.267 789 1HB TYR 138 2HB TYR 138 9.421 6.492 -3.145 790 2HB TYR 138 1HB TYR 138 8.573 5.569 -1.899 791 HD1 TYR 138 1HD TYR 138 7.980 7.955 -4.175 792 HD2 TYR 138 2HD TYR 138 7.728 7.472 0.044 793 HE1 TYR 138 1HE TYR 138 6.263 9.713 -4.083 794 HE2 TYR 138 2HE TYR 138 6.010 9.228 0.149 795 HH TYR 138 HH TYR 138 5.490 11.408 -1.734 796 H THR 139 H THR 139 12.513 5.982 -1.947 797 HA THR 139 HA THR 139 12.511 3.587 -0.276 798 HB THR 139 HB THR 139 13.132 2.130 -2.098 799 HG1 THR 139 1HG THR 139 12.810 4.346 -3.831 800 1HG2 THR 139 1HG2 THR 139 11.065 1.762 -2.820 801 2HG2 THR 139 2HG2 THR 139 10.940 3.362 -3.551 802 3HG2 THR 139 3HG2 THR 139 10.606 3.149 -1.834 803 H LYS 140 H LYS 140 14.279 5.949 -2.169 804 HA LYS 140 HA LYS 140 16.862 4.849 -1.692 805 1HB LYS 140 2HB LYS 140 15.758 7.030 -3.153 806 2HB LYS 140 1HB LYS 140 17.019 7.670 -2.108 807 1HG LYS 140 2HG LYS 140 18.671 6.646 -3.243 808 2HG LYS 140 1HG LYS 140 17.697 5.214 -3.583 809 1HD LYS 140 2HD LYS 140 16.442 7.210 -5.026 810 2HD LYS 140 1HD LYS 140 18.157 7.588 -5.204 811 1HE LYS 140 2HE LYS 140 18.582 5.719 -6.411 812 2HE LYS 140 1HE LYS 140 17.400 4.752 -5.529 813 1HZ LYS 140 1HZ LYS 140 17.042 5.556 -8.026 814 2HZ LYS 140 2HZ LYS 140 16.332 6.864 -7.221 815 3HZ LYS 140 3HZ LYS 140 15.759 5.295 -6.954 816 H ASN 141 H ASN 141 16.230 4.465 0.616 817 HA ASN 141 HA ASN 141 17.831 5.593 2.398 818 1HB ASN 141 2HB ASN 141 16.343 7.250 3.661 819 2HB ASN 141 1HB ASN 141 17.065 7.823 2.162 820 1HD2 ASN 141 1HD2 ASN 141 15.709 9.057 1.100 821 2HD2 ASN 141 2HD2 ASN 141 14.008 8.801 0.935 822 H VAL 142 H VAL 142 14.737 4.279 1.711 823 HA VAL 142 HA VAL 142 14.181 3.485 4.441 824 HB VAL 142 HB VAL 142 12.730 2.566 1.964 825 1HG1 VAL 142 1HG1 VAL 142 10.827 2.637 3.746 826 2HG1 VAL 142 2HG1 VAL 142 12.163 2.568 4.895 827 3HG1 VAL 142 3HG1 VAL 142 11.951 1.279 3.710 828 1HG2 VAL 142 1HG2 VAL 142 11.147 4.528 2.896 829 2HG2 VAL 142 2HG2 VAL 142 12.346 4.769 1.624 830 3HG2 VAL 142 3HG2 VAL 142 12.728 5.203 3.291 831 H ASN 143 H ASN 143 14.195 1.389 5.228 832 HA ASN 143 HA ASN 143 16.144 -0.362 4.062 833 1HB ASN 143 2HB ASN 143 15.262 0.082 6.618 834 2HB ASN 143 1HB ASN 143 14.487 -1.451 6.232 835 1HD2 ASN 143 1HD2 ASN 143 15.935 -2.121 8.020 836 2HD2 ASN 143 2HD2 ASN 143 17.534 -2.632 7.610 837 HA PRO 144 HA PRO 144 12.967 -2.528 1.728 838 1HB PRO 144 2HB PRO 144 14.599 -3.895 0.107 839 2HB PRO 144 1HB PRO 144 14.367 -2.152 -0.080 840 1HG PRO 144 2HG PRO 144 16.624 -3.638 1.203 841 2HG PRO 144 1HG PRO 144 16.676 -2.217 0.143 842 1HD PRO 144 2HD PRO 144 16.853 -2.117 2.895 843 2HD PRO 144 1HD PRO 144 16.309 -0.769 1.877 844 H ASN 145 H ASN 145 12.712 -3.607 3.971 845 HA ASN 145 HA ASN 145 13.102 -6.461 3.583 846 1HB ASN 145 2HB ASN 145 14.131 -5.027 6.038 847 2HB ASN 145 1HB ASN 145 14.023 -6.775 5.863 848 1HD2 ASN 145 1HD2 ASN 145 15.511 -7.850 4.637 849 2HD2 ASN 145 2HD2 ASN 145 16.923 -7.100 3.986 850 H TRP 146 H TRP 146 10.935 -4.294 3.907 851 HA TRP 146 HA TRP 146 9.523 -5.088 6.280 852 1HB TRP 146 2HB TRP 146 7.609 -3.812 4.915 853 2HB TRP 146 1HB TRP 146 8.859 -2.961 5.812 854 HD1 TRP 146 HD TRP 146 10.683 -1.628 4.421 855 HE1 TRP 146 1HE TRP 146 10.775 -0.862 1.966 856 HE3 TRP 146 3HE TRP 146 6.935 -4.542 2.511 857 HZ2 TRP 146 2HZ TRP 146 9.435 -1.413 -0.454 858 HZ3 TRP 146 3HZ TRP 146 6.401 -4.354 0.122 859 HH2 TRP 146 HH TRP 146 7.627 -2.825 -1.329 860 H SER 147 H SER 147 9.520 -6.000 2.913 861 HA SER 147 HA SER 147 7.083 -7.542 3.141 862 1HB SER 147 2HB SER 147 7.875 -8.304 0.773 863 2HB SER 147 1HB SER 147 7.307 -6.651 1.001 864 HG SER 147 HG SER 147 10.038 -7.361 1.209 865 H VAL 148 H VAL 148 8.910 -8.413 5.032 866 HA VAL 148 HA VAL 148 10.130 -10.837 3.966 867 HB VAL 148 HB VAL 148 10.893 -11.107 6.400 868 1HG1 VAL 148 1HG1 VAL 148 12.593 -9.159 6.049 869 2HG1 VAL 148 2HG1 VAL 148 11.802 -9.010 4.480 870 3HG1 VAL 148 3HG1 VAL 148 12.577 -10.527 4.935 871 1HG2 VAL 148 1HG2 VAL 148 10.154 -8.189 6.527 872 2HG2 VAL 148 2HG2 VAL 148 10.890 -9.163 7.797 873 3HG2 VAL 148 3HG2 VAL 148 9.228 -9.476 7.299 874 H ASN 149 H ASN 149 7.197 -9.894 5.324 875 HA ASN 149 HA ASN 149 6.686 -12.453 6.621 876 1HB ASN 149 2HB ASN 149 5.386 -9.785 6.595 877 2HB ASN 149 1HB ASN 149 4.321 -11.173 6.794 878 1HD2 ASN 149 1HD2 ASN 149 7.583 -10.390 7.952 879 2HD2 ASN 149 2HD2 ASN 149 7.238 -10.661 9.623 880 H VAL 150 H VAL 150 7.073 -13.325 4.302 881 HA VAL 150 HA VAL 150 4.425 -13.711 3.101 882 HB VAL 150 HB VAL 150 5.599 -13.770 0.831 883 1HG1 VAL 150 1HG1 VAL 150 4.797 -11.701 0.432 884 2HG1 VAL 150 2HG1 VAL 150 5.715 -10.975 1.751 885 3HG1 VAL 150 3HG1 VAL 150 4.210 -11.831 2.089 886 1HG2 VAL 150 1HG2 VAL 150 7.566 -11.812 1.786 887 2HG2 VAL 150 2HG2 VAL 150 7.725 -13.087 0.577 888 3HG2 VAL 150 3HG2 VAL 150 7.872 -13.474 2.291 Start of MODEL 20 1 1H GLY 38 1HT GLY 38 -0.185 -6.390 33.754 2 2H GLY 38 2HT GLY 38 0.557 -5.082 32.978 3 3H GLY 38 3HT GLY 38 1.167 -6.646 32.769 4 1HA GLY 38 1HA GLY 38 -1.479 -5.670 31.840 5 2HA GLY 38 2HA GLY 38 -0.075 -5.950 30.820 6 H ALA 39 H ALA 39 -2.013 -7.260 29.859 7 HA ALA 39 HA ALA 39 -1.809 -10.003 30.920 8 1HB ALA 39 1HB ALA 39 -4.179 -8.467 29.988 9 2HB ALA 39 2HB ALA 39 -4.022 -9.604 31.327 10 3HB ALA 39 3HB ALA 39 -4.126 -10.201 29.671 11 H MET 40 H MET 40 -2.596 -11.600 29.096 12 HA MET 40 HA MET 40 -1.726 -10.789 26.445 13 1HB MET 40 2HB MET 40 0.361 -11.474 27.544 14 2HB MET 40 1HB MET 40 -0.359 -13.024 27.957 15 1HG MET 40 2HG MET 40 0.560 -13.773 26.080 16 2HG MET 40 1HG MET 40 -0.725 -12.902 25.245 17 1HE MET 40 1HE MET 40 2.347 -13.926 25.138 18 2HE MET 40 2HE MET 40 3.557 -12.653 25.292 19 3HE MET 40 3HE MET 40 2.848 -13.009 23.718 20 H ASP 41 H ASP 41 -4.041 -11.197 26.181 21 HA ASP 41 HA ASP 41 -4.983 -13.914 26.413 22 1HB ASP 41 2HB ASP 41 -6.179 -11.302 25.586 23 2HB ASP 41 1HB ASP 41 -6.981 -12.791 25.095 24 HA PRO 42 HA PRO 42 -4.059 -15.386 22.365 25 1HB PRO 42 2HB PRO 42 -6.307 -16.782 21.719 26 2HB PRO 42 1HB PRO 42 -5.112 -17.356 22.888 27 1HG PRO 42 2HG PRO 42 -7.729 -15.983 23.371 28 2HG PRO 42 1HG PRO 42 -7.024 -17.377 24.213 29 1HD PRO 42 2HD PRO 42 -6.935 -14.883 25.243 30 2HD PRO 42 1HD PRO 42 -5.625 -16.055 25.494 31 H GLU 43 H GLU 43 -4.322 -14.917 20.206 32 HA GLU 43 HA GLU 43 -6.689 -13.653 19.190 33 1HB GLU 43 2HB GLU 43 -4.968 -11.929 20.419 34 2HB GLU 43 1HB GLU 43 -4.372 -11.882 18.765 35 1HG GLU 43 2HG GLU 43 -6.464 -11.142 17.938 36 2HG GLU 43 1HG GLU 43 -7.260 -11.461 19.479 37 H PHE 44 H PHE 44 -6.600 -15.358 17.719 38 HA PHE 44 HA PHE 44 -6.147 -16.310 15.704 39 1HB PHE 44 2HB PHE 44 -4.303 -13.956 15.249 40 2HB PHE 44 1HB PHE 44 -4.933 -15.046 14.020 41 HD1 PHE 44 1HD PHE 44 -5.541 -12.098 15.984 42 HD2 PHE 44 2HD PHE 44 -7.385 -15.046 13.532 43 HE1 PHE 44 1HE PHE 44 -7.486 -10.622 15.679 44 HE2 PHE 44 2HE PHE 44 -9.334 -13.575 13.222 45 HZ PHE 44 HZ PHE 44 -9.384 -11.359 14.296 46 H ALA 45 H ALA 45 -4.220 -16.371 18.196 47 HA ALA 45 HA ALA 45 -2.168 -17.240 18.742 48 1HB ALA 45 1HB ALA 45 -3.273 -19.255 18.677 49 2HB ALA 45 2HB ALA 45 -1.895 -19.547 17.617 50 3HB ALA 45 3HB ALA 45 -3.480 -19.197 16.927 51 H LEU 46 H LEU 46 -1.796 -18.745 15.703 52 HA LEU 46 HA LEU 46 -0.045 -16.750 14.593 53 1HB LEU 46 2HB LEU 46 1.403 -17.840 16.264 54 2HB LEU 46 1HB LEU 46 1.100 -19.391 15.504 55 HG LEU 46 HG LEU 46 2.221 -17.242 13.787 56 1HD1 LEU 46 1HD1 LEU 46 4.279 -17.144 14.703 57 2HD1 LEU 46 2HD1 LEU 46 4.208 -18.798 15.310 58 3HD1 LEU 46 3HD1 LEU 46 3.396 -17.501 16.187 59 1HD2 LEU 46 1HD2 LEU 46 3.630 -19.459 13.279 60 2HD2 LEU 46 2HD2 LEU 46 2.064 -19.123 12.541 61 3HD2 LEU 46 3HD2 LEU 46 2.169 -20.192 13.940 62 H SER 47 H SER 47 -1.459 -16.900 12.832 63 HA SER 47 HA SER 47 -1.878 -19.414 11.491 64 1HB SER 47 2HB SER 47 -3.106 -16.853 11.477 65 2HB SER 47 1HB SER 47 -2.574 -17.185 9.829 66 HG SER 47 HG SER 47 -4.346 -18.319 9.759 67 H ASN 48 H ASN 48 -1.717 -18.682 8.812 68 HA ASN 48 HA ASN 48 0.929 -17.705 8.229 69 1HB ASN 48 2HB ASN 48 1.221 -20.134 8.942 70 2HB ASN 48 1HB ASN 48 0.332 -20.568 7.485 71 1HD2 ASN 48 1HD2 ASN 48 1.926 -21.545 6.372 72 2HD2 ASN 48 2HD2 ASN 48 3.368 -20.757 5.839 73 H GLU 49 H GLU 49 -1.700 -19.701 6.888 74 HA GLU 49 HA GLU 49 -2.678 -19.726 4.823 75 1HB GLU 49 2HB GLU 49 -3.758 -17.667 4.233 76 2HB GLU 49 1HB GLU 49 -3.731 -17.786 5.985 77 1HG GLU 49 2HG GLU 49 -1.516 -16.315 4.675 78 2HG GLU 49 1HG GLU 49 -3.108 -15.560 4.701 79 H LYS 50 H LYS 50 -2.651 -18.024 2.658 80 HA LYS 50 HA LYS 50 0.113 -17.596 1.869 81 1HB LYS 50 2HB LYS 50 -1.669 -19.490 0.328 82 2HB LYS 50 1HB LYS 50 -0.037 -19.009 -0.114 83 1HG LYS 50 2HG LYS 50 0.851 -20.121 1.848 84 2HG LYS 50 1HG LYS 50 -0.781 -20.552 2.363 85 1HD LYS 50 2HD LYS 50 -0.878 -22.296 0.959 86 2HD LYS 50 1HD LYS 50 -0.183 -21.372 -0.374 87 1HE LYS 50 2HE LYS 50 2.035 -21.630 0.955 88 2HE LYS 50 1HE LYS 50 1.194 -22.955 1.759 89 1HZ LYS 50 1HZ LYS 50 0.683 -23.540 -0.773 90 2HZ LYS 50 2HZ LYS 50 2.051 -24.110 0.042 91 3HZ LYS 50 3HZ LYS 50 2.173 -22.762 -0.973 92 H LYS 51 H LYS 51 -0.085 -17.125 -0.743 93 HA LYS 51 HA LYS 51 -0.786 -15.662 -2.337 94 1HB LYS 51 2HB LYS 51 -3.425 -15.535 -0.881 95 2HB LYS 51 1HB LYS 51 -3.116 -15.166 -2.572 96 1HG LYS 51 2HG LYS 51 -2.525 -17.545 -2.934 97 2HG LYS 51 1HG LYS 51 -2.990 -17.873 -1.262 98 1HD LYS 51 2HD LYS 51 -5.256 -17.153 -1.713 99 2HD LYS 51 1HD LYS 51 -4.811 -16.689 -3.357 100 1HE LYS 51 2HE LYS 51 -4.039 -19.190 -3.516 101 2HE LYS 51 1HE LYS 51 -5.163 -19.405 -2.174 102 1HZ LYS 51 1HZ LYS 51 -6.920 -18.468 -3.531 103 2HZ LYS 51 2HZ LYS 51 -6.225 -19.796 -4.313 104 3HZ LYS 51 3HZ LYS 51 -5.844 -18.227 -4.815 105 H ALA 52 H ALA 52 -2.141 -13.391 -2.412 106 HA ALA 52 HA ALA 52 -2.255 -11.212 -1.748 107 1HB ALA 52 1HB ALA 52 -2.565 -10.762 0.428 108 2HB ALA 52 2HB ALA 52 -1.067 -11.559 0.911 109 3HB ALA 52 3HB ALA 52 -2.518 -12.516 0.613 110 H LYS 53 H LYS 53 -0.897 -9.616 -2.257 111 HA LYS 53 HA LYS 53 1.969 -10.204 -2.255 112 1HB LYS 53 2HB LYS 53 0.418 -7.997 -3.624 113 2HB LYS 53 1HB LYS 53 2.146 -8.276 -3.788 114 1HG LYS 53 2HG LYS 53 1.719 -9.603 -5.504 115 2HG LYS 53 1HG LYS 53 0.917 -10.719 -4.397 116 1HD LYS 53 2HD LYS 53 -1.177 -9.383 -4.699 117 2HD LYS 53 1HD LYS 53 -0.342 -8.464 -5.953 118 1HE LYS 53 2HE LYS 53 -0.721 -11.455 -5.985 119 2HE LYS 53 1HE LYS 53 -1.757 -10.308 -6.833 120 1HZ LYS 53 1HZ LYS 53 0.347 -11.468 -7.950 121 2HZ LYS 53 2HZ LYS 53 1.098 -10.081 -7.339 122 3HZ LYS 53 3HZ LYS 53 -0.206 -9.935 -8.406 123 H LYS 54 H LYS 54 3.449 -8.986 -1.149 124 HA LYS 54 HA LYS 54 2.387 -7.226 0.891 125 1HB LYS 54 2HB LYS 54 4.531 -9.094 0.771 126 2HB LYS 54 1HB LYS 54 5.223 -7.508 1.076 127 1HG LYS 54 2HG LYS 54 4.835 -8.164 3.211 128 2HG LYS 54 1HG LYS 54 3.288 -7.390 2.865 129 1HD LYS 54 2HD LYS 54 3.271 -10.154 2.029 130 2HD LYS 54 1HD LYS 54 3.715 -10.013 3.731 131 1HE LYS 54 2HE LYS 54 1.615 -8.247 3.475 132 2HE LYS 54 1HE LYS 54 1.148 -9.582 2.424 133 1HZ LYS 54 1HZ LYS 54 0.888 -10.970 4.157 134 2HZ LYS 54 2HZ LYS 54 0.689 -9.541 5.039 135 3HZ LYS 54 3HZ LYS 54 2.187 -10.327 5.031 136 H VAL 55 H VAL 55 2.422 -5.149 0.681 137 HA VAL 55 HA VAL 55 4.500 -3.894 -0.981 138 HB VAL 55 HB VAL 55 2.854 -2.188 -1.707 139 1HG1 VAL 55 1HG1 VAL 55 1.682 -4.728 -2.656 140 2HG1 VAL 55 2HG1 VAL 55 3.414 -4.493 -2.892 141 3HG1 VAL 55 3HG1 VAL 55 2.266 -3.329 -3.558 142 1HG2 VAL 55 1HG2 VAL 55 0.420 -2.928 -1.565 143 2HG2 VAL 55 2HG2 VAL 55 1.161 -2.259 -0.108 144 3HG2 VAL 55 3HG2 VAL 55 0.952 -4.004 -0.275 145 H ARG 56 H ARG 56 5.054 -1.776 -0.431 146 HA ARG 56 HA ARG 56 4.375 -1.039 2.330 147 1HB ARG 56 2HB ARG 56 6.802 -1.391 1.796 148 2HB ARG 56 1HB ARG 56 6.694 -0.079 0.631 149 1HG ARG 56 2HG ARG 56 7.578 0.974 2.475 150 2HG ARG 56 1HG ARG 56 5.854 1.312 2.648 151 1HD ARG 56 2HD ARG 56 5.601 -0.340 4.317 152 2HD ARG 56 1HD ARG 56 7.177 -1.046 3.964 153 HE ARG 56 HE ARG 56 7.294 1.690 4.847 154 1HH1 ARG 56 1HH1 ARG 56 7.214 -1.648 5.861 155 2HH1 ARG 56 2HH1 ARG 56 7.972 -1.334 7.385 156 1HH2 ARG 56 1HH2 ARG 56 8.290 2.105 6.851 157 2HH2 ARG 56 2HH2 ARG 56 8.582 0.797 7.949 158 H PHE 57 H PHE 57 2.667 0.296 2.255 159 HA PHE 57 HA PHE 57 2.359 2.075 -0.011 160 1HB PHE 57 2HB PHE 57 0.593 1.307 2.295 161 2HB PHE 57 1HB PHE 57 0.189 2.666 1.254 162 HD1 PHE 57 1HD PHE 57 1.722 0.696 -1.031 163 HD2 PHE 57 2HD PHE 57 -1.745 0.626 1.448 164 HE1 PHE 57 1HE PHE 57 0.624 -0.815 -2.610 165 HE2 PHE 57 2HE PHE 57 -2.837 -0.906 -0.138 166 HZ PHE 57 HZ PHE 57 -1.655 -1.624 -2.169 167 H TYR 58 H TYR 58 2.796 4.093 -0.068 168 HA TYR 58 HA TYR 58 3.506 5.525 2.396 169 1HB TYR 58 2HB TYR 58 4.449 6.171 -0.385 170 2HB TYR 58 1HB TYR 58 5.017 6.869 1.113 171 HD1 TYR 58 1HD TYR 58 6.346 5.457 2.702 172 HD2 TYR 58 2HD TYR 58 5.398 4.150 -1.236 173 HE1 TYR 58 1HE TYR 58 8.131 3.771 2.838 174 HE2 TYR 58 2HE TYR 58 7.176 2.460 -1.107 175 HH TYR 58 HH TYR 58 9.583 2.491 1.198 176 H ARG 59 H ARG 59 2.780 7.615 2.645 177 HA ARG 59 HA ARG 59 0.419 8.258 1.036 178 1HB ARG 59 2HB ARG 59 0.062 8.221 3.437 179 2HB ARG 59 1HB ARG 59 1.403 9.328 3.691 180 1HG ARG 59 2HG ARG 59 -0.217 10.733 1.979 181 2HG ARG 59 1HG ARG 59 -1.372 9.872 3.000 182 1HD ARG 59 2HD ARG 59 0.788 11.788 3.827 183 2HD ARG 59 1HD ARG 59 -0.950 11.921 4.092 184 HE ARG 59 HE ARG 59 -0.501 9.775 5.503 185 1HH1 ARG 59 1HH1 ARG 59 1.542 12.602 5.286 186 2HH1 ARG 59 2HH1 ARG 59 2.185 12.408 6.879 187 1HH2 ARG 59 1HH2 ARG 59 0.348 9.526 7.596 188 2HH2 ARG 59 2HH2 ARG 59 1.512 10.664 8.189 189 H ASN 60 H ASN 60 0.682 9.587 -0.593 190 HA ASN 60 HA ASN 60 2.914 10.896 -1.386 191 1HB ASN 60 2HB ASN 60 0.932 10.639 -2.791 192 2HB ASN 60 1HB ASN 60 0.074 11.824 -1.817 193 1HD2 ASN 60 1HD2 ASN 60 -0.187 13.547 -3.042 194 2HD2 ASN 60 2HD2 ASN 60 1.049 14.336 -3.956 195 H GLY 61 H GLY 61 4.075 12.572 -0.780 196 1HA GLY 61 2HA GLY 61 4.683 14.564 0.200 197 2HA GLY 61 1HA GLY 61 2.974 14.945 0.345 198 H ASP 62 H ASP 62 5.458 12.848 1.805 199 HA ASP 62 HA ASP 62 4.509 13.666 4.440 200 1HB ASP 62 2HB ASP 62 4.511 11.305 5.243 201 2HB ASP 62 1HB ASP 62 3.243 11.644 4.071 202 H ARG 63 H ARG 63 6.837 11.586 2.724 203 HA ARG 63 HA ARG 63 9.078 11.309 2.943 204 1HB ARG 63 2HB ARG 63 8.853 13.975 4.343 205 2HB ARG 63 1HB ARG 63 10.381 13.197 3.960 206 1HG ARG 63 2HG ARG 63 10.273 13.759 1.790 207 2HG ARG 63 1HG ARG 63 8.533 13.479 1.697 208 1HD ARG 63 2HD ARG 63 8.393 15.713 1.561 209 2HD ARG 63 1HD ARG 63 8.643 15.670 3.306 210 HE ARG 63 HE ARG 63 11.126 15.703 1.947 211 1HH1 ARG 63 1HH1 ARG 63 8.440 17.763 2.797 212 2HH1 ARG 63 2HH1 ARG 63 9.387 19.212 2.791 213 1HH2 ARG 63 1HH2 ARG 63 12.374 17.610 1.939 214 2HH2 ARG 63 2HH2 ARG 63 11.620 19.126 2.303 215 H TYR 64 H TYR 64 8.390 12.943 6.032 216 HA TYR 64 HA TYR 64 9.991 11.354 7.625 217 1HB TYR 64 2HB TYR 64 7.432 12.801 8.325 218 2HB TYR 64 1HB TYR 64 8.518 12.097 9.518 219 HD1 TYR 64 1HD TYR 64 8.198 14.716 6.935 220 HD2 TYR 64 2HD TYR 64 10.532 13.201 10.153 221 HE1 TYR 64 1HE TYR 64 9.517 16.790 6.946 222 HE2 TYR 64 2HE TYR 64 11.858 15.272 10.174 223 HH TYR 64 HH TYR 64 11.652 17.612 7.668 224 H PHE 65 H PHE 65 6.630 10.854 6.678 225 HA PHE 65 HA PHE 65 6.296 8.522 8.311 226 1HB PHE 65 2HB PHE 65 4.431 10.068 7.558 227 2HB PHE 65 1HB PHE 65 4.587 9.344 5.961 228 HD1 PHE 65 1HD PHE 65 4.311 8.190 9.504 229 HD2 PHE 65 2HD PHE 65 3.081 7.699 5.459 230 HE1 PHE 65 1HE PHE 65 2.805 6.368 10.187 231 HE2 PHE 65 2HE PHE 65 1.573 5.877 6.135 232 HZ PHE 65 HZ PHE 65 1.433 5.207 8.501 233 H LYS 66 H LYS 66 7.120 6.608 7.880 234 HA LYS 66 HA LYS 66 8.296 6.007 5.342 235 1HB LYS 66 2HB LYS 66 7.842 3.964 7.489 236 2HB LYS 66 1HB LYS 66 9.186 4.109 6.363 237 1HG LYS 66 2HG LYS 66 9.312 6.455 7.808 238 2HG LYS 66 1HG LYS 66 8.839 5.252 9.010 239 1HD LYS 66 2HD LYS 66 11.110 5.021 9.117 240 2HD LYS 66 1HD LYS 66 10.759 3.853 7.841 241 1HE LYS 66 2HE LYS 66 12.541 5.097 6.992 242 2HE LYS 66 1HE LYS 66 11.122 5.806 6.222 243 1HZ LYS 66 1HZ LYS 66 11.214 7.410 8.232 244 2HZ LYS 66 2HZ LYS 66 12.265 7.651 6.929 245 3HZ LYS 66 3HZ LYS 66 12.828 6.915 8.344 246 H GLY 67 H GLY 67 5.140 5.843 6.429 247 1HA GLY 67 2HA GLY 67 3.330 5.129 5.118 248 2HA GLY 67 1HA GLY 67 4.430 4.134 4.181 249 H ILE 68 H ILE 68 2.220 2.906 4.699 250 HA ILE 68 HA ILE 68 2.817 1.130 6.971 251 HB ILE 68 HB ILE 68 0.837 2.406 7.511 252 1HG1 ILE 68 2HG1 ILE 68 -0.140 -0.310 6.642 253 2HG1 ILE 68 1HG1 ILE 68 0.976 -0.097 7.989 254 1HG2 ILE 68 1HG2 ILE 68 -0.783 2.991 6.085 255 2HG2 ILE 68 2HG2 ILE 68 -0.899 1.364 5.407 256 3HG2 ILE 68 3HG2 ILE 68 0.341 2.474 4.825 257 1HD1 ILE 68 1HD1 ILE 68 -1.360 1.625 8.163 258 2HD1 ILE 68 2HD1 ILE 68 -0.651 0.544 9.363 259 3HD1 ILE 68 3HD1 ILE 68 -1.755 -0.094 8.146 260 H VAL 69 H VAL 69 2.761 -1.047 6.588 261 HA VAL 69 HA VAL 69 2.741 -1.864 3.807 262 HB VAL 69 HB VAL 69 3.226 -3.610 6.220 263 1HG1 VAL 69 1HG1 VAL 69 2.742 -4.753 4.078 264 2HG1 VAL 69 2HG1 VAL 69 4.374 -5.064 4.673 265 3HG1 VAL 69 3HG1 VAL 69 4.119 -3.922 3.356 266 1HG2 VAL 69 1HG2 VAL 69 5.370 -2.303 4.571 267 2HG2 VAL 69 2HG2 VAL 69 5.518 -3.112 6.132 268 3HG2 VAL 69 3HG2 VAL 69 4.716 -1.544 6.023 269 H TYR 70 H TYR 70 1.231 -3.051 2.800 270 HA TYR 70 HA TYR 70 -0.906 -4.257 4.377 271 1HB TYR 70 2HB TYR 70 -1.141 -2.051 2.494 272 2HB TYR 70 1HB TYR 70 -2.153 -3.415 2.035 273 HD1 TYR 70 1HD TYR 70 -1.241 -1.835 5.305 274 HD2 TYR 70 2HD TYR 70 -4.330 -3.105 2.669 275 HE1 TYR 70 1HE TYR 70 -2.923 -1.165 6.966 276 HE2 TYR 70 2HE TYR 70 -6.023 -2.432 4.323 277 HH TYR 70 HH TYR 70 -5.300 -1.763 7.526 278 H ALA 71 H ALA 71 -1.876 -6.018 3.482 279 HA ALA 71 HA ALA 71 -0.384 -7.327 1.320 280 1HB ALA 71 1HB ALA 71 -1.111 -9.415 2.172 281 2HB ALA 71 2HB ALA 71 -2.295 -8.651 3.231 282 3HB ALA 71 3HB ALA 71 -0.572 -8.470 3.560 283 H VAL 72 H VAL 72 -1.308 -7.193 -0.592 284 HA VAL 72 HA VAL 72 -4.167 -6.743 -0.795 285 HB VAL 72 HB VAL 72 -2.398 -6.735 -3.193 286 1HG1 VAL 72 1HG1 VAL 72 -4.569 -6.274 -3.793 287 2HG1 VAL 72 2HG1 VAL 72 -3.951 -4.646 -3.518 288 3HG1 VAL 72 3HG1 VAL 72 -4.923 -5.439 -2.280 289 1HG2 VAL 72 1HG2 VAL 72 -0.989 -5.417 -1.924 290 2HG2 VAL 72 2HG2 VAL 72 -2.305 -4.772 -0.944 291 3HG2 VAL 72 3HG2 VAL 72 -2.085 -4.212 -2.603 292 H SER 73 H SER 73 -5.480 -8.258 -1.268 293 HA SER 73 HA SER 73 -4.833 -10.372 -3.132 294 1HB SER 73 2HB SER 73 -4.092 -11.128 -0.793 295 2HB SER 73 1HB SER 73 -5.810 -11.198 -0.402 296 HG SER 73 HG SER 73 -5.743 -13.098 -1.279 297 H SER 74 H SER 74 -6.679 -11.511 -3.890 298 HA SER 74 HA SER 74 -8.995 -9.933 -4.123 299 1HB SER 74 2HB SER 74 -9.971 -11.995 -5.209 300 2HB SER 74 1HB SER 74 -8.449 -11.437 -5.901 301 HG SER 74 HG SER 74 -8.677 -13.491 -3.956 302 H ASP 75 H ASP 75 -8.036 -12.077 -1.651 303 HA ASP 75 HA ASP 75 -10.689 -12.817 -0.830 304 1HB ASP 75 2HB ASP 75 -7.949 -13.520 -0.155 305 2HB ASP 75 1HB ASP 75 -8.951 -13.330 1.272 306 H ARG 76 H ARG 76 -8.324 -10.365 -0.044 307 HA ARG 76 HA ARG 76 -9.901 -9.450 2.237 308 1HB ARG 76 2HB ARG 76 -7.168 -8.802 1.184 309 2HB ARG 76 1HB ARG 76 -7.964 -7.708 2.306 310 1HG ARG 76 2HG ARG 76 -7.797 -9.152 4.058 311 2HG ARG 76 1HG ARG 76 -7.835 -10.582 3.027 312 1HD ARG 76 2HD ARG 76 -5.597 -10.554 2.673 313 2HD ARG 76 1HD ARG 76 -5.504 -8.793 2.716 314 HE ARG 76 HE ARG 76 -6.028 -9.416 5.282 315 1HH1 ARG 76 1HH1 ARG 76 -3.646 -10.592 3.017 316 2HH1 ARG 76 2HH1 ARG 76 -2.475 -10.945 4.242 317 1HH2 ARG 76 1HH2 ARG 76 -4.487 -9.881 6.893 318 2HH2 ARG 76 2HH2 ARG 76 -2.951 -10.542 6.441 319 H PHE 77 H PHE 77 -8.717 -8.252 -0.887 320 HA PHE 77 HA PHE 77 -10.800 -6.173 -0.780 321 1HB PHE 77 2HB PHE 77 -8.218 -5.893 -2.308 322 2HB PHE 77 1HB PHE 77 -9.374 -4.635 -1.879 323 HD1 PHE 77 1HD PHE 77 -9.733 -4.301 0.701 324 HD2 PHE 77 2HD PHE 77 -6.306 -6.116 -1.050 325 HE1 PHE 77 1HE PHE 77 -8.435 -3.802 2.730 326 HE2 PHE 77 2HE PHE 77 -5.002 -5.616 0.975 327 HZ PHE 77 HZ PHE 77 -6.066 -4.459 2.869 328 H ARG 78 H ARG 78 -12.349 -6.551 -2.192 329 HA ARG 78 HA ARG 78 -12.197 -8.465 -4.236 330 1HB ARG 78 2HB ARG 78 -14.145 -6.616 -3.122 331 2HB ARG 78 1HB ARG 78 -14.319 -6.792 -4.855 332 1HG ARG 78 2HG ARG 78 -14.870 -9.022 -4.715 333 2HG ARG 78 1HG ARG 78 -14.058 -9.224 -3.162 334 1HD ARG 78 2HD ARG 78 -15.807 -7.810 -2.120 335 2HD ARG 78 1HD ARG 78 -16.643 -7.760 -3.672 336 HE ARG 78 HE ARG 78 -17.476 -9.832 -3.221 337 1HH1 ARG 78 1HH1 ARG 78 -14.631 -9.348 -1.257 338 2HH1 ARG 78 2HH1 ARG 78 -14.814 -10.844 -0.404 339 1HH2 ARG 78 1HH2 ARG 78 -17.717 -11.798 -2.100 340 2HH2 ARG 78 2HH2 ARG 78 -16.564 -12.236 -0.883 341 H SER 79 H SER 79 -11.518 -5.050 -4.144 342 HA SER 79 HA SER 79 -10.324 -5.154 -6.743 343 1HB SER 79 2HB SER 79 -12.961 -4.757 -6.944 344 2HB SER 79 1HB SER 79 -12.464 -3.090 -6.656 345 HG SER 79 HG SER 79 -11.280 -4.741 -8.630 346 H PHE 80 H PHE 80 -9.955 -2.673 -7.449 347 HA PHE 80 HA PHE 80 -8.092 -1.628 -5.645 348 1HB PHE 80 2HB PHE 80 -8.284 -1.242 -8.158 349 2HB PHE 80 1HB PHE 80 -9.499 -0.033 -7.781 350 HD1 PHE 80 1HD PHE 80 -5.987 -0.951 -6.902 351 HD2 PHE 80 2HD PHE 80 -8.858 2.141 -7.465 352 HE1 PHE 80 1HE PHE 80 -4.234 0.736 -6.559 353 HE2 PHE 80 2HE PHE 80 -7.108 3.832 -7.127 354 HZ PHE 80 HZ PHE 80 -4.795 3.133 -6.674 355 H ASP 81 H ASP 81 -11.428 -0.720 -6.315 356 HA ASP 81 HA ASP 81 -11.532 1.593 -4.731 357 1HB ASP 81 2HB ASP 81 -13.252 0.605 -6.442 358 2HB ASP 81 1HB ASP 81 -13.920 -0.197 -5.024 359 H ALA 82 H ALA 82 -12.125 -1.794 -3.958 360 HA ALA 82 HA ALA 82 -13.001 -1.349 -1.294 361 1HB ALA 82 1HB ALA 82 -11.923 -3.896 -1.373 362 2HB ALA 82 2HB ALA 82 -12.478 -3.597 -3.021 363 3HB ALA 82 3HB ALA 82 -13.602 -3.448 -1.669 364 H LEU 83 H LEU 83 -9.868 -2.001 -2.771 365 HA LEU 83 HA LEU 83 -8.405 -2.393 -0.383 366 1HB LEU 83 2HB LEU 83 -7.516 -2.990 -2.580 367 2HB LEU 83 1HB LEU 83 -7.538 -1.313 -3.071 368 HG LEU 83 HG LEU 83 -5.877 -0.854 -1.225 369 1HD1 LEU 83 1HD1 LEU 83 -6.438 -3.056 -0.062 370 2HD1 LEU 83 2HD1 LEU 83 -4.738 -2.595 -0.164 371 3HD1 LEU 83 3HD1 LEU 83 -5.389 -3.811 -1.262 372 1HD2 LEU 83 1HD2 LEU 83 -4.575 -2.799 -3.021 373 2HD2 LEU 83 2HD2 LEU 83 -4.181 -1.112 -2.692 374 3HD2 LEU 83 3HD2 LEU 83 -5.496 -1.511 -3.797 375 H LEU 84 H LEU 84 -8.964 0.391 -2.449 376 HA LEU 84 HA LEU 84 -7.579 2.301 -0.953 377 1HB LEU 84 2HB LEU 84 -9.931 2.497 -2.819 378 2HB LEU 84 1HB LEU 84 -9.183 3.911 -2.100 379 HG LEU 84 HG LEU 84 -7.804 1.914 -3.892 380 1HD1 LEU 84 1HD1 LEU 84 -9.192 4.473 -4.375 381 2HD1 LEU 84 2HD1 LEU 84 -8.983 3.072 -5.426 382 3HD1 LEU 84 3HD1 LEU 84 -7.663 4.224 -5.216 383 1HD2 LEU 84 1HD2 LEU 84 -6.746 3.734 -1.994 384 2HD2 LEU 84 2HD2 LEU 84 -6.388 4.361 -3.604 385 3HD2 LEU 84 3HD2 LEU 84 -5.881 2.732 -3.158 386 H ALA 85 H ALA 85 -10.835 0.991 -0.658 387 HA ALA 85 HA ALA 85 -11.862 2.898 1.155 388 1HB ALA 85 1HB ALA 85 -13.190 1.171 -0.068 389 2HB ALA 85 2HB ALA 85 -13.558 1.280 1.654 390 3HB ALA 85 3HB ALA 85 -12.546 -0.032 1.049 391 H ASP 86 H ASP 86 -10.163 -0.163 1.653 392 HA ASP 86 HA ASP 86 -10.186 -0.001 4.502 393 1HB ASP 86 2HB ASP 86 -8.934 -1.759 2.456 394 2HB ASP 86 1HB ASP 86 -8.159 -1.701 4.036 395 H LEU 87 H LEU 87 -8.042 1.000 1.938 396 HA LEU 87 HA LEU 87 -5.753 1.574 3.469 397 1HB LEU 87 2HB LEU 87 -6.808 2.615 0.855 398 2HB LEU 87 1HB LEU 87 -5.356 3.295 1.556 399 HG LEU 87 HG LEU 87 -5.797 0.565 0.410 400 1HD1 LEU 87 1HD1 LEU 87 -4.916 2.303 -1.031 401 2HD1 LEU 87 2HD1 LEU 87 -3.682 1.085 -0.712 402 3HD1 LEU 87 3HD1 LEU 87 -3.627 2.636 0.125 403 1HD2 LEU 87 1HD2 LEU 87 -3.597 -0.098 1.374 404 2HD2 LEU 87 2HD2 LEU 87 -4.881 0.055 2.569 405 3HD2 LEU 87 3HD2 LEU 87 -3.670 1.326 2.409 406 H THR 88 H THR 88 -8.626 3.464 2.750 407 HA THR 88 HA THR 88 -7.756 5.931 3.753 408 HB THR 88 HB THR 88 -10.568 5.377 4.309 409 HG1 THR 88 1HG THR 88 -11.159 4.903 2.199 410 1HG2 THR 88 1HG2 THR 88 -9.227 7.188 2.320 411 2HG2 THR 88 2HG2 THR 88 -9.780 7.626 3.937 412 3HG2 THR 88 3HG2 THR 88 -10.950 7.173 2.697 413 H ARG 89 H ARG 89 -9.173 3.114 5.299 414 HA ARG 89 HA ARG 89 -9.483 4.263 7.870 415 1HB ARG 89 2HB ARG 89 -9.534 1.495 6.758 416 2HB ARG 89 1HB ARG 89 -9.419 1.702 8.500 417 1HG ARG 89 2HG ARG 89 -11.634 1.836 8.513 418 2HG ARG 89 1HG ARG 89 -11.454 3.425 7.766 419 1HD ARG 89 2HD ARG 89 -11.678 2.491 5.573 420 2HD ARG 89 1HD ARG 89 -11.620 0.848 6.213 421 HE ARG 89 HE ARG 89 -13.903 2.559 6.075 422 1HH1 ARG 89 1HH1 ARG 89 -12.438 -0.037 7.891 423 2HH1 ARG 89 2HH1 ARG 89 -13.948 -0.634 8.494 424 1HH2 ARG 89 1HH2 ARG 89 -15.889 1.774 6.865 425 2HH2 ARG 89 2HH2 ARG 89 -15.907 0.393 7.911 426 H SER 90 H SER 90 -6.924 2.208 6.449 427 HA SER 90 HA SER 90 -5.408 2.154 8.877 428 1HB SER 90 2HB SER 90 -5.346 0.802 6.404 429 2HB SER 90 1HB SER 90 -3.780 1.597 6.572 430 HG SER 90 HG SER 90 -4.995 -0.057 8.534 431 H LEU 91 H LEU 91 -5.245 4.078 5.912 432 HA LEU 91 HA LEU 91 -2.917 5.482 6.924 433 1HB LEU 91 2HB LEU 91 -4.140 4.979 4.329 434 2HB LEU 91 1HB LEU 91 -3.642 6.638 4.530 435 HG LEU 91 HG LEU 91 -1.955 4.162 4.509 436 1HD1 LEU 91 1HD1 LEU 91 -1.082 4.991 2.617 437 2HD1 LEU 91 2HD1 LEU 91 -1.117 6.654 3.202 438 3HD1 LEU 91 3HD1 LEU 91 -2.584 5.913 2.564 439 1HD2 LEU 91 1HD2 LEU 91 -1.423 6.704 5.949 440 2HD2 LEU 91 2HD2 LEU 91 -0.093 5.960 5.061 441 3HD2 LEU 91 3HD2 LEU 91 -0.921 5.057 6.331 442 H SER 92 H SER 92 -6.164 5.717 7.343 443 HA SER 92 HA SER 92 -7.190 8.110 6.839 444 1HB SER 92 2HB SER 92 -8.035 8.078 9.327 445 2HB SER 92 1HB SER 92 -8.547 6.824 8.199 446 HG SER 92 HG SER 92 -7.672 6.201 10.379 447 H ASP 93 H ASP 93 -6.690 10.153 7.019 448 HA ASP 93 HA ASP 93 -5.279 11.205 9.308 449 1HB ASP 93 2HB ASP 93 -3.921 10.658 6.782 450 2HB ASP 93 1HB ASP 93 -3.798 12.350 7.247 451 H ASN 94 H ASN 94 -4.603 13.703 8.187 452 HA ASN 94 HA ASN 94 -6.802 14.779 6.715 453 1HB ASN 94 2HB ASN 94 -7.611 16.293 8.521 454 2HB ASN 94 1HB ASN 94 -7.962 14.594 8.823 455 1HD2 ASN 94 1HD2 ASN 94 -8.206 15.770 10.999 456 2HD2 ASN 94 2HD2 ASN 94 -6.814 15.733 12.022 457 H ILE 95 H ILE 95 -3.872 14.732 6.703 458 HA ILE 95 HA ILE 95 -3.333 17.616 6.885 459 HB ILE 95 HB ILE 95 -1.516 15.238 7.245 460 1HG1 ILE 95 2HG1 ILE 95 -0.969 17.029 9.232 461 2HG1 ILE 95 1HG1 ILE 95 -2.683 17.330 8.960 462 1HG2 ILE 95 1HG2 ILE 95 -0.731 18.108 6.791 463 2HG2 ILE 95 2HG2 ILE 95 -0.336 16.718 5.782 464 3HG2 ILE 95 3HG2 ILE 95 0.354 16.857 7.398 465 1HD1 ILE 95 1HD1 ILE 95 -3.181 14.997 9.364 466 2HD1 ILE 95 2HD1 ILE 95 -2.287 15.682 10.722 467 3HD1 ILE 95 3HD1 ILE 95 -1.464 14.646 9.557 468 H ASN 96 H ASN 96 -1.883 14.831 5.198 469 HA ASN 96 HA ASN 96 -1.677 16.436 2.774 470 1HB ASN 96 2HB ASN 96 -0.583 13.667 3.289 471 2HB ASN 96 1HB ASN 96 -0.130 14.770 1.997 472 1HD2 ASN 96 1HD2 ASN 96 0.144 14.052 5.379 473 2HD2 ASN 96 2HD2 ASN 96 1.454 15.129 5.711 474 H LEU 97 H LEU 97 -3.548 13.879 4.120 475 HA LEU 97 HA LEU 97 -4.666 13.229 1.477 476 1HB LEU 97 2HB LEU 97 -4.392 11.701 4.023 477 2HB LEU 97 1HB LEU 97 -5.770 11.352 2.998 478 HG LEU 97 HG LEU 97 -2.879 11.161 2.142 479 1HD1 LEU 97 1HD1 LEU 97 -3.271 9.411 3.681 480 2HD1 LEU 97 2HD1 LEU 97 -3.426 8.699 2.075 481 3HD1 LEU 97 3HD1 LEU 97 -4.870 9.083 3.013 482 1HD2 LEU 97 1HD2 LEU 97 -5.034 11.576 0.533 483 2HD2 LEU 97 2HD2 LEU 97 -4.960 9.816 0.583 484 3HD2 LEU 97 3HD2 LEU 97 -3.557 10.742 0.049 485 HA PRO 98 HA PRO 98 -7.718 16.332 3.129 486 1HB PRO 98 2HB PRO 98 -8.673 15.419 0.432 487 2HB PRO 98 1HB PRO 98 -8.746 17.024 1.156 488 1HG PRO 98 2HG PRO 98 -6.850 16.412 -0.614 489 2HG PRO 98 1HG PRO 98 -6.496 17.442 0.784 490 1HD PRO 98 2HD PRO 98 -5.676 14.653 0.247 491 2HD PRO 98 1HD PRO 98 -4.928 15.869 1.299 492 H GLN 99 H GLN 99 -9.010 13.767 1.040 493 HA GLN 99 HA GLN 99 -11.028 13.189 3.079 494 1HB GLN 99 2HB GLN 99 -10.852 12.424 0.160 495 2HB GLN 99 1HB GLN 99 -12.149 11.923 1.235 496 1HG GLN 99 2HG GLN 99 -12.887 14.170 1.514 497 2HG GLN 99 1HG GLN 99 -11.469 14.797 0.673 498 1HE2 GLN 99 1HE2 GLN 99 -11.264 13.372 -1.541 499 2HE2 GLN 99 2HE2 GLN 99 -12.679 13.505 -2.525 500 H GLY 100 H GLY 100 -8.390 11.722 1.302 501 1HA GLY 100 2HA GLY 100 -7.400 9.957 2.935 502 2HA GLY 100 1HA GLY 100 -8.903 9.137 2.533 503 H VAL 101 H VAL 101 -7.284 7.536 1.812 504 HA VAL 101 HA VAL 101 -5.743 8.007 -0.537 505 HB VAL 101 HB VAL 101 -6.665 5.330 0.516 506 1HG1 VAL 101 1HG1 VAL 101 -4.820 4.410 -0.665 507 2HG1 VAL 101 2HG1 VAL 101 -4.184 6.010 -1.045 508 3HG1 VAL 101 3HG1 VAL 101 -5.682 5.460 -1.790 509 1HG2 VAL 101 1HG2 VAL 101 -5.550 5.948 2.375 510 2HG2 VAL 101 2HG2 VAL 101 -4.668 7.234 1.547 511 3HG2 VAL 101 3HG2 VAL 101 -4.128 5.561 1.405 512 H ARG 102 H ARG 102 -6.830 8.625 -2.322 513 HA ARG 102 HA ARG 102 -9.218 7.114 -3.096 514 1HB ARG 102 2HB ARG 102 -8.427 9.883 -3.373 515 2HB ARG 102 1HB ARG 102 -8.906 9.196 -4.918 516 1HG ARG 102 2HG ARG 102 -10.537 9.183 -2.394 517 2HG ARG 102 1HG ARG 102 -10.788 10.227 -3.796 518 1HD ARG 102 2HD ARG 102 -11.364 7.335 -3.444 519 2HD ARG 102 1HD ARG 102 -12.298 8.580 -4.264 520 HE ARG 102 HE ARG 102 -9.802 7.581 -5.491 521 1HH1 ARG 102 1HH1 ARG 102 -13.288 7.941 -5.581 522 2HH1 ARG 102 2HH1 ARG 102 -13.414 7.430 -7.229 523 1HH2 ARG 102 1HH2 ARG 102 -9.988 6.899 -7.643 524 2HH2 ARG 102 2HH2 ARG 102 -11.545 6.840 -8.398 525 H TYR 103 H TYR 103 -5.980 7.920 -4.156 526 HA TYR 103 HA TYR 103 -6.289 5.871 -6.220 527 1HB TYR 103 2HB TYR 103 -4.854 8.459 -6.813 528 2HB TYR 103 1HB TYR 103 -5.253 7.161 -7.913 529 HD1 TYR 103 1HD TYR 103 -7.266 7.110 -9.090 530 HD2 TYR 103 2HD TYR 103 -6.767 9.879 -5.900 531 HE1 TYR 103 1HE TYR 103 -9.332 8.250 -9.767 532 HE2 TYR 103 2HE TYR 103 -8.838 11.024 -6.565 533 HH TYR 103 HH TYR 103 -10.362 10.494 -9.531 534 H ILE 104 H ILE 104 -4.259 5.001 -6.991 535 HA ILE 104 HA ILE 104 -2.089 5.286 -5.018 536 HB ILE 104 HB ILE 104 -2.958 2.761 -6.434 537 1HG1 ILE 104 2HG1 ILE 104 -3.260 3.724 -3.589 538 2HG1 ILE 104 1HG1 ILE 104 -4.534 3.262 -4.714 539 1HG2 ILE 104 1HG2 ILE 104 -0.882 2.994 -4.274 540 2HG2 ILE 104 2HG2 ILE 104 -0.482 3.034 -5.991 541 3HG2 ILE 104 3HG2 ILE 104 -1.249 1.605 -5.297 542 1HD1 ILE 104 1HD1 ILE 104 -2.573 1.477 -3.307 543 2HD1 ILE 104 2HD1 ILE 104 -3.578 0.932 -4.649 544 3HD1 ILE 104 3HD1 ILE 104 -4.331 1.501 -3.159 545 H TYR 105 H TYR 105 -0.244 5.968 -5.872 546 HA TYR 105 HA TYR 105 0.159 5.679 -8.751 547 1HB TYR 105 2HB TYR 105 0.606 7.844 -6.877 548 2HB TYR 105 1HB TYR 105 2.041 7.496 -7.844 549 HD1 TYR 105 1HD TYR 105 -1.156 9.061 -7.792 550 HD2 TYR 105 2HD TYR 105 1.750 7.323 -10.349 551 HE1 TYR 105 1HE TYR 105 -2.167 10.203 -9.700 552 HE2 TYR 105 2HE TYR 105 0.764 8.457 -12.268 553 HH TYR 105 HH TYR 105 -2.270 10.171 -12.044 554 H THR 106 H THR 106 2.318 5.390 -9.560 555 HA THR 106 HA THR 106 3.625 3.219 -8.243 556 HB THR 106 HB THR 106 5.374 3.644 -10.098 557 HG1 THR 106 1HG THR 106 4.588 4.957 -11.782 558 1HG2 THR 106 1HG2 THR 106 3.916 1.872 -10.507 559 2HG2 THR 106 2HG2 THR 106 3.751 2.918 -11.917 560 3HG2 THR 106 3HG2 THR 106 2.518 2.937 -10.656 561 H ILE 107 H ILE 107 5.873 3.161 -7.599 562 HA ILE 107 HA ILE 107 6.574 4.905 -5.633 563 HB ILE 107 HB ILE 107 7.679 2.723 -6.105 564 1HG1 ILE 107 2HG1 ILE 107 9.947 3.467 -5.350 565 2HG1 ILE 107 1HG1 ILE 107 9.457 5.130 -5.663 566 1HG2 ILE 107 1HG2 ILE 107 9.402 4.261 -8.035 567 2HG2 ILE 107 2HG2 ILE 107 8.066 3.222 -8.533 568 3HG2 ILE 107 3HG2 ILE 107 9.448 2.533 -7.679 569 1HD1 ILE 107 1HD1 ILE 107 7.468 3.980 -4.032 570 2HD1 ILE 107 2HD1 ILE 107 8.635 5.236 -3.617 571 3HD1 ILE 107 3HD1 ILE 107 9.030 3.540 -3.344 572 H ASP 108 H ASP 108 6.991 5.363 -9.057 573 HA ASP 108 HA ASP 108 8.668 7.719 -8.643 574 1HB ASP 108 2HB ASP 108 8.920 5.867 -10.517 575 2HB ASP 108 1HB ASP 108 7.731 6.866 -11.349 576 H GLY 109 H GLY 109 5.413 6.805 -9.447 577 1HA GLY 109 2HA GLY 109 3.539 8.199 -9.256 578 2HA GLY 109 1HA GLY 109 4.603 9.596 -9.268 579 H SER 110 H SER 110 5.298 7.378 -11.744 580 HA SER 110 HA SER 110 4.633 9.224 -13.780 581 1HB SER 110 2HB SER 110 5.753 6.488 -13.646 582 2HB SER 110 1HB SER 110 4.954 6.916 -15.158 583 HG SER 110 HG SER 110 6.910 7.698 -15.511 584 H ARG 111 H ARG 111 3.081 6.238 -12.656 585 HA ARG 111 HA ARG 111 0.591 7.132 -13.857 586 1HB ARG 111 2HB ARG 111 0.230 4.723 -14.669 587 2HB ARG 111 1HB ARG 111 1.292 5.754 -15.619 588 1HG ARG 111 2HG ARG 111 3.061 4.444 -15.272 589 2HG ARG 111 1HG ARG 111 2.699 4.256 -13.555 590 1HD ARG 111 2HD ARG 111 1.016 2.570 -14.089 591 2HD ARG 111 1HD ARG 111 1.351 2.770 -15.808 592 HE ARG 111 HE ARG 111 2.888 1.268 -13.908 593 1HH1 ARG 111 1HH1 ARG 111 3.016 3.010 -16.929 594 2HH1 ARG 111 2HH1 ARG 111 4.399 2.147 -17.511 595 1HH2 ARG 111 1HH2 ARG 111 4.707 0.132 -14.673 596 2HH2 ARG 111 2HH2 ARG 111 5.359 0.513 -16.231 597 H LYS 112 H LYS 112 -1.217 6.408 -12.821 598 HA LYS 112 HA LYS 112 -0.756 5.208 -10.209 599 1HB LYS 112 2HB LYS 112 -2.352 6.566 -9.436 600 2HB LYS 112 1HB LYS 112 -2.319 7.351 -11.002 601 1HG LYS 112 2HG LYS 112 -4.064 5.514 -11.642 602 2HG LYS 112 1HG LYS 112 -4.283 5.403 -9.894 603 1HD LYS 112 2HD LYS 112 -5.884 6.960 -10.869 604 2HD LYS 112 1HD LYS 112 -4.758 7.803 -9.802 605 1HE LYS 112 2HE LYS 112 -5.255 8.955 -11.983 606 2HE LYS 112 1HE LYS 112 -3.547 8.696 -11.632 607 1HZ LYS 112 1HZ LYS 112 -4.509 8.126 -13.963 608 2HZ LYS 112 2HZ LYS 112 -5.002 6.693 -13.213 609 3HZ LYS 112 3HZ LYS 112 -3.363 7.105 -13.252 610 H ILE 113 H ILE 113 -1.706 3.355 -9.500 611 HA ILE 113 HA ILE 113 -2.446 1.456 -11.529 612 HB ILE 113 HB ILE 113 -2.369 1.136 -8.529 613 1HG1 ILE 113 2HG1 ILE 113 -0.204 1.806 -9.753 614 2HG1 ILE 113 1HG1 ILE 113 -0.160 0.405 -8.692 615 1HG2 ILE 113 1HG2 ILE 113 -2.901 -0.728 -10.761 616 2HG2 ILE 113 2HG2 ILE 113 -3.534 -0.711 -9.116 617 3HG2 ILE 113 3HG2 ILE 113 -1.909 -1.319 -9.428 618 1HD1 ILE 113 1HD1 ILE 113 0.710 0.528 -11.305 619 2HD1 ILE 113 2HD1 ILE 113 -0.826 -0.337 -11.401 620 3HD1 ILE 113 3HD1 ILE 113 0.457 -0.932 -10.344 621 H GLY 114 H GLY 114 -4.398 0.591 -11.931 622 1HA GLY 114 2HA GLY 114 -6.680 1.624 -10.364 623 2HA GLY 114 1HA GLY 114 -6.745 1.332 -12.097 624 H SER 115 H SER 115 -5.068 -1.174 -11.590 625 HA SER 115 HA SER 115 -7.254 -2.851 -10.554 626 1HB SER 115 2HB SER 115 -6.361 -4.599 -12.203 627 2HB SER 115 1HB SER 115 -7.247 -3.236 -12.889 628 HG SER 115 HG SER 115 -5.311 -2.310 -13.497 629 H MET 116 H MET 116 -6.707 -4.687 -9.406 630 HA MET 116 HA MET 116 -4.434 -4.526 -7.762 631 1HB MET 116 2HB MET 116 -6.828 -5.872 -7.691 632 2HB MET 116 1HB MET 116 -5.676 -7.175 -7.952 633 1HG MET 116 2HG MET 116 -4.796 -6.991 -5.894 634 2HG MET 116 1HG MET 116 -4.945 -5.235 -5.869 635 1HE MET 116 1HE MET 116 -6.051 -4.129 -4.587 636 2HE MET 116 2HE MET 116 -6.695 -4.903 -3.139 637 3HE MET 116 3HE MET 116 -7.794 -4.209 -4.331 638 H ASP 117 H ASP 117 -5.017 -6.116 -10.794 639 HA ASP 117 HA ASP 117 -3.055 -8.089 -10.722 640 1HB ASP 117 2HB ASP 117 -4.776 -6.817 -12.682 641 2HB ASP 117 1HB ASP 117 -3.218 -7.246 -13.360 642 H GLU 118 H GLU 118 -2.729 -4.675 -10.908 643 HA GLU 118 HA GLU 118 -0.114 -4.798 -12.173 644 1HB GLU 118 2HB GLU 118 -1.665 -2.469 -11.038 645 2HB GLU 118 1HB GLU 118 -0.129 -2.337 -11.883 646 1HG GLU 118 2HG GLU 118 -1.758 -3.800 -13.596 647 2HG GLU 118 1HG GLU 118 -2.802 -2.541 -12.937 648 H LEU 119 H LEU 119 -1.364 -5.045 -9.028 649 HA LEU 119 HA LEU 119 0.914 -3.895 -7.680 650 1HB LEU 119 2HB LEU 119 -1.027 -5.706 -6.318 651 2HB LEU 119 1HB LEU 119 -0.205 -4.290 -5.696 652 HG LEU 119 HG LEU 119 -2.511 -4.278 -7.643 653 1HD1 LEU 119 1HD1 LEU 119 -2.416 -3.344 -4.783 654 2HD1 LEU 119 2HD1 LEU 119 -3.056 -4.905 -5.297 655 3HD1 LEU 119 3HD1 LEU 119 -3.823 -3.414 -5.844 656 1HD2 LEU 119 1HD2 LEU 119 -1.151 -1.948 -6.301 657 2HD2 LEU 119 2HD2 LEU 119 -2.471 -1.889 -7.470 658 3HD2 LEU 119 3HD2 LEU 119 -0.872 -2.439 -7.972 659 H GLU 120 H GLU 120 2.807 -4.908 -7.641 660 HA GLU 120 HA GLU 120 2.871 -7.837 -7.686 661 1HB GLU 120 2HB GLU 120 5.132 -5.875 -8.086 662 2HB GLU 120 1HB GLU 120 5.195 -7.607 -8.341 663 1HG GLU 120 2HG GLU 120 3.174 -7.001 -9.985 664 2HG GLU 120 1HG GLU 120 4.072 -5.484 -10.041 665 H GLU 121 H GLU 121 4.453 -8.935 -6.289 666 HA GLU 121 HA GLU 121 4.123 -8.309 -3.595 667 1HB GLU 121 2HB GLU 121 6.111 -10.066 -5.008 668 2HB GLU 121 1HB GLU 121 6.119 -9.877 -3.258 669 1HG GLU 121 2HG GLU 121 3.853 -10.730 -3.132 670 2HG GLU 121 1HG GLU 121 3.786 -10.861 -4.889 671 H GLY 122 H GLY 122 5.755 -7.794 -1.988 672 1HA GLY 122 2HA GLY 122 7.036 -6.081 -1.137 673 2HA GLY 122 1HA GLY 122 8.244 -6.837 -2.148 674 H GLU 123 H GLU 123 5.379 -4.892 -2.927 675 HA GLU 123 HA GLU 123 7.074 -3.231 -4.652 676 1HB GLU 123 2HB GLU 123 4.204 -3.971 -4.622 677 2HB GLU 123 1HB GLU 123 4.598 -2.366 -5.223 678 1HG GLU 123 2HG GLU 123 6.240 -4.555 -6.295 679 2HG GLU 123 1HG GLU 123 4.536 -4.587 -6.742 680 H SER 124 H SER 124 6.528 -0.905 -4.808 681 HA SER 124 HA SER 124 5.864 0.236 -2.172 682 1HB SER 124 2HB SER 124 8.053 0.940 -4.107 683 2HB SER 124 1HB SER 124 7.415 2.163 -3.012 684 HG SER 124 HG SER 124 9.006 1.264 -1.859 685 H TYR 125 H TYR 125 4.132 1.535 -2.203 686 HA TYR 125 HA TYR 125 3.452 2.857 -4.735 687 1HB TYR 125 2HB TYR 125 1.668 1.256 -2.965 688 2HB TYR 125 1HB TYR 125 1.011 2.523 -3.979 689 HD1 TYR 125 1HD TYR 125 1.938 -0.894 -3.875 690 HD2 TYR 125 2HD TYR 125 1.686 2.462 -6.460 691 HE1 TYR 125 1HE TYR 125 1.947 -2.398 -5.814 692 HE2 TYR 125 2HE TYR 125 1.700 0.994 -8.398 693 HH TYR 125 HH TYR 125 2.586 -1.428 -8.883 694 H VAL 126 H VAL 126 2.054 4.636 -4.598 695 HA VAL 126 HA VAL 126 2.316 6.118 -2.052 696 HB VAL 126 HB VAL 126 2.878 6.997 -4.843 697 1HG1 VAL 126 1HG1 VAL 126 1.480 8.674 -2.802 698 2HG1 VAL 126 2HG1 VAL 126 1.250 8.607 -4.549 699 3HG1 VAL 126 3HG1 VAL 126 2.667 9.415 -3.875 700 1HG2 VAL 126 1HG2 VAL 126 4.118 8.297 -2.518 701 2HG2 VAL 126 2HG2 VAL 126 4.853 7.645 -3.984 702 3HG2 VAL 126 3HG2 VAL 126 4.415 6.563 -2.660 703 H CYS 127 H CYS 127 0.562 7.149 -1.264 704 HA CYS 127 HA CYS 127 -1.979 6.620 -2.594 705 1HB CYS 127 2HB CYS 127 -1.320 7.613 0.183 706 2HB CYS 127 1HB CYS 127 -2.957 7.374 -0.417 707 HG CYS 127 HG CYS 127 -2.386 4.796 -0.603 708 H SER 128 H SER 128 -2.858 8.108 -3.856 709 HA SER 128 HA SER 128 -2.460 10.946 -3.185 710 1HB SER 128 2HB SER 128 -2.530 9.789 -5.983 711 2HB SER 128 1HB SER 128 -2.326 11.492 -5.556 712 HG SER 128 HG SER 128 -0.383 10.816 -4.432 713 H SER 129 H SER 129 -4.311 11.975 -2.849 714 HA SER 129 HA SER 129 -6.800 10.727 -3.693 715 1HB SER 129 2HB SER 129 -6.222 11.845 -1.350 716 2HB SER 129 1HB SER 129 -6.766 13.302 -2.182 717 HG SER 129 HG SER 129 -8.199 11.047 -1.411 718 H ASP 130 H ASP 130 -5.317 13.957 -3.846 719 HA ASP 130 HA ASP 130 -6.325 14.315 -6.540 720 1HB ASP 130 2HB ASP 130 -7.921 15.218 -4.503 721 2HB ASP 130 1HB ASP 130 -6.955 16.646 -4.861 722 H ASN 131 H ASN 131 -3.728 14.127 -5.163 723 HA ASN 131 HA ASN 131 -2.647 16.824 -5.533 724 1HB ASN 131 2HB ASN 131 -1.080 14.459 -4.539 725 2HB ASN 131 1HB ASN 131 -0.795 16.170 -4.241 726 1HD2 ASN 131 1HD2 ASN 131 -2.512 13.344 -3.283 727 2HD2 ASN 131 2HD2 ASN 131 -3.242 14.006 -1.863 728 H PHE 132 H PHE 132 -0.463 16.956 -6.574 729 HA PHE 132 HA PHE 132 -0.558 15.546 -9.116 730 1HB PHE 132 2HB PHE 132 1.329 17.145 -9.698 731 2HB PHE 132 1HB PHE 132 -0.231 17.882 -9.346 732 HD1 PHE 132 1HD PHE 132 -0.536 19.291 -7.445 733 HD2 PHE 132 2HD PHE 132 3.170 17.302 -8.089 734 HE1 PHE 132 1HE PHE 132 0.518 20.713 -5.736 735 HE2 PHE 132 2HE PHE 132 4.232 18.720 -6.382 736 HZ PHE 132 HZ PHE 132 2.906 20.428 -5.202 737 H PHE 133 H PHE 133 0.508 14.509 -6.353 738 HA PHE 133 HA PHE 133 2.029 12.956 -5.700 739 1HB PHE 133 2HB PHE 133 1.568 11.920 -7.900 740 2HB PHE 133 1HB PHE 133 2.845 12.900 -8.611 741 HD1 PHE 133 1HD PHE 133 2.045 9.875 -6.891 742 HD2 PHE 133 2HD PHE 133 5.210 12.583 -7.757 743 HE1 PHE 133 1HE PHE 133 3.685 8.133 -6.321 744 HE2 PHE 133 2HE PHE 133 6.857 10.845 -7.189 745 HZ PHE 133 HZ PHE 133 6.095 8.616 -6.472 746 H LYS 134 H LYS 134 3.728 13.463 -4.504 747 HA LYS 134 HA LYS 134 5.617 15.472 -5.511 748 1HB LYS 134 2HB LYS 134 4.688 14.678 -2.787 749 2HB LYS 134 1HB LYS 134 6.300 15.358 -2.958 750 1HG LYS 134 2HG LYS 134 5.528 17.428 -3.473 751 2HG LYS 134 1HG LYS 134 4.073 16.812 -4.257 752 1HD LYS 134 2HD LYS 134 4.206 16.259 -1.384 753 2HD LYS 134 1HD LYS 134 4.163 17.977 -1.784 754 1HE LYS 134 2HE LYS 134 2.175 17.539 -3.206 755 2HE LYS 134 1HE LYS 134 2.191 15.867 -2.649 756 1HZ LYS 134 1HZ LYS 134 0.790 17.801 -1.477 757 2HZ LYS 134 2HZ LYS 134 2.212 17.887 -0.565 758 3HZ LYS 134 3HZ LYS 134 1.354 16.432 -0.656 759 H LYS 135 H LYS 135 7.561 14.843 -6.152 760 HA LYS 135 HA LYS 135 8.432 12.128 -5.758 761 1HB LYS 135 2HB LYS 135 9.492 14.495 -7.261 762 2HB LYS 135 1HB LYS 135 10.513 13.087 -7.001 763 1HG LYS 135 2HG LYS 135 9.616 12.533 -9.010 764 2HG LYS 135 1HG LYS 135 8.400 11.821 -7.950 765 1HD LYS 135 2HD LYS 135 6.870 13.523 -8.354 766 2HD LYS 135 1HD LYS 135 8.118 14.647 -8.896 767 1HE LYS 135 2HE LYS 135 8.368 13.509 -10.962 768 2HE LYS 135 1HE LYS 135 7.410 12.140 -10.401 769 1HZ LYS 135 1HZ LYS 135 6.082 14.725 -10.374 770 2HZ LYS 135 2HZ LYS 135 5.486 13.205 -10.815 771 3HZ LYS 135 3HZ LYS 135 6.428 14.092 -11.904 772 H VAL 136 H VAL 136 8.986 11.749 -3.660 773 HA VAL 136 HA VAL 136 11.229 13.340 -2.596 774 HB VAL 136 HB VAL 136 10.114 12.206 -0.351 775 1HG1 VAL 136 1HG1 VAL 136 10.868 14.349 -0.129 776 2HG1 VAL 136 2HG1 VAL 136 9.126 14.621 -0.115 777 3HG1 VAL 136 3HG1 VAL 136 10.052 14.910 -1.587 778 1HG2 VAL 136 1HG2 VAL 136 8.118 11.572 -1.713 779 2HG2 VAL 136 2HG2 VAL 136 7.819 13.290 -1.979 780 3HG2 VAL 136 3HG2 VAL 136 7.759 12.626 -0.346 781 H GLU 137 H GLU 137 12.098 11.925 -0.546 782 HA GLU 137 HA GLU 137 13.234 9.601 -1.802 783 1HB GLU 137 2HB GLU 137 14.373 9.358 0.490 784 2HB GLU 137 1HB GLU 137 14.774 10.779 -0.464 785 1HG GLU 137 2HG GLU 137 13.462 12.185 0.890 786 2HG GLU 137 1HG GLU 137 12.657 10.819 1.660 787 H TYR 138 H TYR 138 10.934 8.853 -1.991 788 HA TYR 138 HA TYR 138 9.381 7.822 0.012 789 1HB TYR 138 2HB TYR 138 9.935 6.998 -2.808 790 2HB TYR 138 1HB TYR 138 8.808 6.063 -1.818 791 HD1 TYR 138 1HD TYR 138 8.787 8.288 -4.322 792 HD2 TYR 138 2HD TYR 138 7.287 7.976 -0.354 793 HE1 TYR 138 1HE TYR 138 7.008 9.897 -4.874 794 HE2 TYR 138 2HE TYR 138 5.505 9.584 -0.892 795 HH TYR 138 HH TYR 138 4.777 10.520 -4.078 796 H THR 139 H THR 139 11.748 5.917 -1.861 797 HA THR 139 HA THR 139 11.805 3.931 0.283 798 HB THR 139 HB THR 139 13.008 2.524 -1.388 799 HG1 THR 139 1HG THR 139 13.823 4.320 -2.623 800 1HG2 THR 139 1HG2 THR 139 10.924 2.857 -3.147 801 2HG2 THR 139 2HG2 THR 139 10.265 3.423 -1.613 802 3HG2 THR 139 3HG2 THR 139 10.943 1.800 -1.737 803 H LYS 140 H LYS 140 13.590 6.592 -0.729 804 HA LYS 140 HA LYS 140 16.225 5.617 -0.249 805 1HB LYS 140 2HB LYS 140 14.983 8.139 -0.968 806 2HB LYS 140 1HB LYS 140 16.268 8.372 0.209 807 1HG LYS 140 2HG LYS 140 17.531 6.728 -1.475 808 2HG LYS 140 1HG LYS 140 16.406 7.486 -2.603 809 1HD LYS 140 2HD LYS 140 17.310 9.591 -2.296 810 2HD LYS 140 1HD LYS 140 17.972 9.187 -0.712 811 1HE LYS 140 2HE LYS 140 19.881 8.370 -1.579 812 2HE LYS 140 1HE LYS 140 19.054 7.606 -2.935 813 1HZ LYS 140 1HZ LYS 140 19.160 10.510 -2.975 814 2HZ LYS 140 2HZ LYS 140 19.347 9.401 -4.239 815 3HZ LYS 140 3HZ LYS 140 20.639 9.716 -3.194 816 H ASN 141 H ASN 141 17.240 5.254 1.541 817 HA ASN 141 HA ASN 141 17.816 5.186 3.717 818 1HB ASN 141 2HB ASN 141 16.584 7.859 3.459 819 2HB ASN 141 1HB ASN 141 16.714 7.231 5.098 820 1HD2 ASN 141 1HD2 ASN 141 18.687 7.432 2.154 821 2HD2 ASN 141 2HD2 ASN 141 20.142 7.897 2.958 822 H VAL 142 H VAL 142 15.066 4.280 2.628 823 HA VAL 142 HA VAL 142 13.535 4.158 5.107 824 HB VAL 142 HB VAL 142 12.845 3.131 2.349 825 1HG1 VAL 142 1HG1 VAL 142 10.477 3.347 3.528 826 2HG1 VAL 142 2HG1 VAL 142 11.447 3.032 4.967 827 3HG1 VAL 142 3HG1 VAL 142 11.444 1.875 3.635 828 1HG2 VAL 142 1HG2 VAL 142 11.146 5.230 3.065 829 2HG2 VAL 142 2HG2 VAL 142 12.426 5.259 1.853 830 3HG2 VAL 142 3HG2 VAL 142 12.766 5.770 3.506 831 H ASN 143 H ASN 143 15.612 2.188 3.162 832 HA ASN 143 HA ASN 143 16.563 0.156 3.616 833 1HB ASN 143 2HB ASN 143 15.604 0.883 6.119 834 2HB ASN 143 1HB ASN 143 14.877 -0.697 5.842 835 1HD2 ASN 143 1HD2 ASN 143 16.077 -1.817 7.297 836 2HD2 ASN 143 2HD2 ASN 143 17.779 -2.069 7.145 837 HA PRO 144 HA PRO 144 12.965 -1.568 1.325 838 1HB PRO 144 2HB PRO 144 15.131 -2.702 -0.323 839 2HB PRO 144 1HB PRO 144 13.742 -1.727 -0.810 840 1HG PRO 144 2HG PRO 144 16.228 -0.725 -0.816 841 2HG PRO 144 1HG PRO 144 14.823 0.269 -0.385 842 1HD PRO 144 2HD PRO 144 16.840 -1.039 1.409 843 2HD PRO 144 1HD PRO 144 16.125 0.584 1.516 844 H ASN 145 H ASN 145 13.125 -2.798 3.514 845 HA ASN 145 HA ASN 145 13.459 -5.605 2.846 846 1HB ASN 145 2HB ASN 145 14.946 -4.281 5.120 847 2HB ASN 145 1HB ASN 145 14.714 -6.022 4.996 848 1HD2 ASN 145 1HD2 ASN 145 16.138 -7.159 3.872 849 2HD2 ASN 145 2HD2 ASN 145 17.348 -6.501 2.828 850 H TRP 146 H TRP 146 11.236 -3.810 3.400 851 HA TRP 146 HA TRP 146 10.257 -4.370 6.030 852 1HB TRP 146 2HB TRP 146 8.007 -3.694 4.619 853 2HB TRP 146 1HB TRP 146 9.080 -2.552 5.415 854 HD1 TRP 146 HD TRP 146 10.720 -1.114 3.856 855 HE1 TRP 146 1HE TRP 146 10.617 -0.527 1.353 856 HE3 TRP 146 3HE TRP 146 7.330 -4.633 2.324 857 HZ2 TRP 146 2HZ TRP 146 9.274 -1.429 -0.959 858 HZ3 TRP 146 3HZ TRP 146 6.687 -4.690 -0.039 859 HH2 TRP 146 HH TRP 146 7.640 -3.129 -1.650 860 H SER 147 H SER 147 10.097 -5.963 2.953 861 HA SER 147 HA SER 147 7.928 -7.710 3.744 862 1HB SER 147 2HB SER 147 9.563 -7.312 1.280 863 2HB SER 147 1HB SER 147 8.781 -8.875 1.511 864 HG SER 147 HG SER 147 7.166 -7.821 0.626 865 H VAL 148 H VAL 148 9.960 -7.898 5.594 866 HA VAL 148 HA VAL 148 10.683 -10.697 5.324 867 HB VAL 148 HB VAL 148 12.827 -8.693 6.020 868 1HG1 VAL 148 1HG1 VAL 148 13.713 -11.249 5.031 869 2HG1 VAL 148 2HG1 VAL 148 12.628 -11.457 6.405 870 3HG1 VAL 148 3HG1 VAL 148 14.070 -10.456 6.565 871 1HG2 VAL 148 1HG2 VAL 148 13.778 -9.195 3.781 872 2HG2 VAL 148 2HG2 VAL 148 12.249 -8.318 3.712 873 3HG2 VAL 148 3HG2 VAL 148 12.290 -10.050 3.379 874 H ASN 149 H ASN 149 8.993 -8.845 7.034 875 HA ASN 149 HA ASN 149 10.225 -9.212 9.654 876 1HB ASN 149 2HB ASN 149 8.052 -7.519 8.558 877 2HB ASN 149 1HB ASN 149 7.853 -8.059 10.221 878 1HD2 ASN 149 1HD2 ASN 149 9.298 -5.819 8.176 879 2HD2 ASN 149 2HD2 ASN 149 10.357 -5.076 9.322 880 H VAL 150 H VAL 150 9.924 -11.630 9.037 881 HA VAL 150 HA VAL 150 7.241 -12.555 9.796 882 HB VAL 150 HB VAL 150 7.953 -14.766 8.966 883 1HG1 VAL 150 1HG1 VAL 150 6.776 -13.357 7.439 884 2HG1 VAL 150 2HG1 VAL 150 8.084 -14.137 6.551 885 3HG1 VAL 150 3HG1 VAL 150 8.241 -12.455 7.056 886 1HG2 VAL 150 1HG2 VAL 150 10.197 -14.157 7.407 887 2HG2 VAL 150 2HG2 VAL 150 10.125 -15.219 8.813 888 3HG2 VAL 150 3HG2 VAL 150 10.547 -13.519 9.013
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