NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
629471 | 5y7l | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLN 45 1HT GLN 45 6.263 20.487 -6.963 2 H2 GLN 45 2HT GLN 45 6.304 19.904 -5.369 3 H3 GLN 45 3HT GLN 45 5.138 21.052 -5.828 4 HA GLN 45 HA GLN 45 3.932 19.529 -7.087 5 HB2 GLN 45 2HB GLN 45 6.365 17.740 -6.819 6 HB3 GLN 45 1HB GLN 45 4.846 17.258 -7.572 7 HG2 GLN 45 2HG GLN 45 5.076 19.050 -9.235 8 HG3 GLN 45 1HG GLN 45 6.574 19.583 -8.468 9 HE21 GLN 45 1HE2 GLN 45 6.570 18.737 -11.192 10 HE22 GLN 45 2HE2 GLN 45 7.432 17.280 -11.310 11 H ASP 46 H ASP 46 5.910 17.483 -4.961 12 HA ASP 46 HA ASP 46 3.729 16.296 -3.614 13 HB2 ASP 46 2HB ASP 46 6.580 16.773 -2.711 14 HB3 ASP 46 1HB ASP 46 5.429 15.788 -1.811 15 H LEU 47 H LEU 47 5.589 19.208 -2.829 16 HA LEU 47 HA LEU 47 4.443 19.752 -0.290 17 HB2 LEU 47 2HB LEU 47 5.283 21.760 -2.404 18 HB3 LEU 47 1HB LEU 47 5.125 22.071 -0.675 19 HG LEU 47 HG LEU 47 7.061 20.124 -1.962 20 HD11 LEU 47 1HD1 LEU 47 8.769 21.692 -1.077 21 HD12 LEU 47 2HD1 LEU 47 7.479 22.765 -0.531 22 HD13 LEU 47 3HD1 LEU 47 7.713 22.471 -2.253 23 HD21 LEU 47 1HD2 LEU 47 6.250 20.688 0.872 24 HD22 LEU 47 2HD2 LEU 47 7.926 20.259 0.537 25 HD23 LEU 47 3HD2 LEU 47 6.629 19.144 0.107 26 H GLN 48 H GLN 48 3.254 20.285 -3.552 27 HA GLN 48 HA GLN 48 0.775 21.517 -2.429 28 HB2 GLN 48 2HB GLN 48 1.828 21.476 -5.273 29 HB3 GLN 48 1HB GLN 48 0.340 22.263 -4.748 30 HG2 GLN 48 2HG GLN 48 1.684 23.671 -3.185 31 HG3 GLN 48 1HG GLN 48 3.151 22.945 -3.845 32 HE21 GLN 48 1HE2 GLN 48 1.019 23.022 -6.389 33 HE22 GLN 48 2HE2 GLN 48 1.447 24.518 -7.071 34 H ALA 49 H ALA 49 -1.279 20.745 -3.348 35 HA ALA 49 HA ALA 49 -1.479 17.896 -3.397 36 HB1 ALA 49 1HB ALA 49 -3.802 18.493 -4.438 37 HB2 ALA 49 2HB ALA 49 -3.319 20.155 -4.102 38 HB3 ALA 49 3HB ALA 49 -3.451 18.999 -2.787 39 H THR 50 H THR 50 -1.568 16.456 -5.117 40 HA THR 50 HA THR 50 -1.832 17.232 -7.873 41 HB THR 50 HB THR 50 0.953 16.432 -7.002 42 HG1 THR 50 1HG THR 50 -0.169 18.929 -7.706 43 HG21 THR 50 1HG2 THR 50 -0.196 16.006 -9.415 44 HG22 THR 50 2HG2 THR 50 1.517 16.375 -9.218 45 HG23 THR 50 3HG2 THR 50 0.383 17.656 -9.646 46 H GLU 51 H GLU 51 0.384 14.813 -6.521 47 HA GLU 51 HA GLU 51 -1.378 12.721 -7.700 48 HB2 GLU 51 2HB GLU 51 1.579 12.615 -7.065 49 HB3 GLU 51 1HB GLU 51 0.644 11.343 -7.854 50 HG2 GLU 51 2HG GLU 51 0.087 12.939 -9.689 51 HG3 GLU 51 1HG GLU 51 1.118 14.144 -8.918 52 H ALA 52 H ALA 52 -2.161 11.127 -6.442 53 HA ALA 52 HA ALA 52 -0.976 10.515 -3.818 54 HB1 ALA 52 1HB ALA 52 -3.933 11.087 -3.920 55 HB2 ALA 52 2HB ALA 52 -2.796 12.401 -3.615 56 HB3 ALA 52 3HB ALA 52 -2.870 11.025 -2.513 57 H ASN 53 H ASN 53 -0.762 8.300 -4.179 58 HA ASN 53 HA ASN 53 -2.950 6.983 -5.676 59 HB2 ASN 53 2HB ASN 53 -0.172 6.006 -5.046 60 HB3 ASN 53 1HB ASN 53 -1.377 5.089 -5.942 61 HD21 ASN 53 1HD2 ASN 53 -2.517 7.288 -7.439 62 HD22 ASN 53 2HD2 ASN 53 -1.342 7.834 -8.535 63 H CYS 54 H CYS 54 -4.177 5.357 -4.862 64 HA CYS 54 HA CYS 54 -3.646 4.519 -2.042 65 HB2 CYS 54 2HB CYS 54 -6.276 4.484 -1.987 66 HB3 CYS 54 1HB CYS 54 -5.443 6.017 -1.748 67 H THR 55 H THR 55 -2.922 2.421 -2.663 68 HA THR 55 HA THR 55 -4.949 0.883 -4.216 69 HB THR 55 HB THR 55 -3.417 0.410 -5.783 70 HG1 THR 55 1HG THR 55 -1.271 -0.212 -4.242 71 HG21 THR 55 1HG2 THR 55 -1.424 1.951 -4.100 72 HG22 THR 55 2HG2 THR 55 -2.594 2.710 -5.175 73 HG23 THR 55 3HG2 THR 55 -1.340 1.662 -5.836 74 H VAL 56 H VAL 56 -5.358 -1.196 -3.663 75 HA VAL 56 HA VAL 56 -4.363 -2.057 -1.006 76 HB VAL 56 HB VAL 56 -6.644 -2.910 -2.798 77 HG11 VAL 56 1HG1 VAL 56 -6.040 -5.032 -2.127 78 HG12 VAL 56 2HG1 VAL 56 -6.972 -4.549 -0.709 79 HG13 VAL 56 3HG1 VAL 56 -5.211 -4.453 -0.682 80 HG21 VAL 56 1HG2 VAL 56 -7.148 -2.606 0.048 81 HG22 VAL 56 2HG2 VAL 56 -7.901 -1.772 -1.311 82 HG23 VAL 56 3HG2 VAL 56 -6.403 -1.154 -0.620 83 H LEU 57 H LEU 57 -2.445 -3.110 -1.219 84 HA LEU 57 HA LEU 57 -1.300 -4.202 -3.476 85 HB2 LEU 57 2HB LEU 57 -0.341 -4.039 -1.100 86 HB3 LEU 57 1HB LEU 57 -1.119 -5.592 -0.803 87 HG LEU 57 HG LEU 57 0.087 -6.485 -2.839 88 HD11 LEU 57 1HD1 LEU 57 0.858 -3.689 -2.985 89 HD12 LEU 57 2HD1 LEU 57 1.083 -4.970 -4.176 90 HD13 LEU 57 3HD1 LEU 57 2.279 -4.729 -2.903 91 HD21 LEU 57 1HD2 LEU 57 1.292 -7.288 -1.099 92 HD22 LEU 57 2HD2 LEU 57 1.196 -5.760 -0.226 93 HD23 LEU 57 3HD2 LEU 57 2.439 -5.997 -1.456 94 H SER 58 H SER 58 -1.153 -6.414 -4.279 95 HA SER 58 HA SER 58 -3.757 -7.807 -4.082 96 HB2 SER 58 2HB SER 58 -3.092 -8.972 -6.087 97 HB3 SER 58 1HB SER 58 -2.677 -7.277 -6.325 98 HG SER 58 HG SER 58 -0.612 -7.765 -6.235 99 H VAL 59 H VAL 59 -3.663 -10.231 -3.746 100 HA VAL 59 HA VAL 59 -1.558 -10.806 -1.743 101 HB VAL 59 HB VAL 59 -3.891 -12.586 -2.460 102 HG11 VAL 59 1HG1 VAL 59 -3.009 -12.327 0.324 103 HG12 VAL 59 2HG1 VAL 59 -1.734 -12.903 -0.748 104 HG13 VAL 59 3HG1 VAL 59 -3.259 -13.781 -0.641 105 HG21 VAL 59 1HG2 VAL 59 -4.541 -11.144 -0.145 106 HG22 VAL 59 2HG2 VAL 59 -5.272 -10.943 -1.737 107 HG23 VAL 59 3HG2 VAL 59 -3.910 -9.929 -1.258 108 H GLN 60 H GLN 60 0.259 -11.664 -2.545 109 HA GLN 60 HA GLN 60 0.065 -14.001 -4.351 110 HB2 GLN 60 2HB GLN 60 1.851 -11.606 -4.888 111 HB3 GLN 60 1HB GLN 60 1.837 -13.105 -5.816 112 HG2 GLN 60 2HG GLN 60 -0.511 -11.211 -5.497 113 HG3 GLN 60 1HG GLN 60 0.489 -11.374 -6.939 114 HE21 GLN 60 1HE2 GLN 60 -2.491 -12.119 -6.191 115 HE22 GLN 60 2HE2 GLN 60 -2.647 -13.686 -6.826 116 H GLN 61 H GLN 61 2.040 -15.325 -4.259 117 HA GLN 61 HA GLN 61 3.235 -15.248 -1.601 118 HB2 GLN 61 2HB GLN 61 3.967 -17.011 -3.947 119 HB3 GLN 61 1HB GLN 61 4.332 -17.313 -2.251 120 HG2 GLN 61 2HG GLN 61 1.589 -17.223 -3.534 121 HG3 GLN 61 1HG GLN 61 2.400 -18.644 -2.874 122 HE21 GLN 61 1HE2 GLN 61 0.088 -16.369 -2.115 123 HE22 GLN 61 2HE2 GLN 61 0.203 -16.418 -0.426 124 H ILE 62 H ILE 62 5.049 -15.737 -4.618 125 HA ILE 62 HA ILE 62 6.815 -13.453 -3.866 126 HB ILE 62 HB ILE 62 7.790 -16.233 -4.607 127 HG12 ILE 62 2HG1 ILE 62 7.967 -14.744 -1.966 128 HG13 ILE 62 1HG1 ILE 62 6.809 -16.030 -2.305 129 HG21 ILE 62 1HG2 ILE 62 9.981 -15.067 -3.716 130 HG22 ILE 62 2HG2 ILE 62 9.129 -13.583 -4.135 131 HG23 ILE 62 3HG2 ILE 62 9.462 -14.792 -5.378 132 HD11 ILE 62 1HD1 ILE 62 8.816 -17.492 -2.903 133 HD12 ILE 62 2HD1 ILE 62 8.634 -17.091 -1.196 134 HD13 ILE 62 3HD1 ILE 62 9.821 -16.235 -2.181 135 H GLY 63 H GLY 63 8.532 -13.247 -5.811 136 HA2 GLY 63 2HA GLY 63 8.899 -13.339 -8.197 137 HA3 GLY 63 1HA GLY 63 7.227 -13.857 -8.406 138 H GLU 64 H GLU 64 7.349 -11.354 -6.180 139 HA GLU 64 HA GLU 64 6.894 -9.307 -8.302 140 HB2 GLU 64 2HB GLU 64 5.340 -9.709 -5.733 141 HB3 GLU 64 1HB GLU 64 5.174 -8.302 -6.786 142 HG2 GLU 64 2HG GLU 64 4.579 -9.823 -8.666 143 HG3 GLU 64 1HG GLU 64 4.642 -11.186 -7.549 144 H VAL 65 H VAL 65 7.752 -7.271 -7.888 145 HA VAL 65 HA VAL 65 9.293 -6.981 -5.345 146 HB VAL 65 HB VAL 65 10.992 -5.737 -6.615 147 HG11 VAL 65 1HG1 VAL 65 11.431 -8.084 -6.441 148 HG12 VAL 65 2HG1 VAL 65 11.747 -7.652 -8.120 149 HG13 VAL 65 3HG1 VAL 65 10.244 -8.467 -7.688 150 HG21 VAL 65 1HG2 VAL 65 10.242 -4.735 -8.506 151 HG22 VAL 65 2HG2 VAL 65 8.886 -5.853 -8.653 152 HG23 VAL 65 3HG2 VAL 65 10.472 -6.301 -9.281 153 H PHE 66 H PHE 66 9.189 -4.932 -4.374 154 HA PHE 66 HA PHE 66 7.377 -2.958 -5.688 155 HB2 PHE 66 2HB PHE 66 7.464 -3.795 -2.784 156 HB3 PHE 66 1HB PHE 66 6.548 -2.412 -3.389 157 HD1 PHE 66 1HD PHE 66 6.789 -6.082 -3.301 158 HD2 PHE 66 2HD PHE 66 4.619 -2.720 -4.858 159 HE1 PHE 66 1HE PHE 66 4.936 -7.585 -3.971 160 HE2 PHE 66 2HE PHE 66 2.768 -4.219 -5.526 161 HZ PHE 66 HZ PHE 66 2.924 -6.656 -5.084 162 H GLU 67 H GLU 67 7.720 -0.730 -4.994 163 HA GLU 67 HA GLU 67 10.502 -0.263 -4.008 164 HB2 GLU 67 2HB GLU 67 10.668 1.634 -5.469 165 HB3 GLU 67 1HB GLU 67 10.053 0.303 -6.448 166 HG2 GLU 67 2HG GLU 67 7.722 1.150 -6.011 167 HG3 GLU 67 1HG GLU 67 8.438 2.561 -5.229 168 H CYS 68 H CYS 68 10.785 1.464 -2.544 169 HA CYS 68 HA CYS 68 8.255 2.430 -1.284 170 HB2 CYS 68 2HB CYS 68 10.550 1.239 -0.173 171 HB3 CYS 68 1HB CYS 68 10.667 2.948 0.250 172 H THR 69 H THR 69 8.290 4.733 -0.559 173 HA THR 69 HA THR 69 10.138 6.385 -2.230 174 HB THR 69 HB THR 69 8.282 7.032 -3.340 175 HG1 THR 69 1HG THR 69 8.590 8.625 -1.481 176 HG21 THR 69 1HG2 THR 69 6.698 5.844 -1.043 177 HG22 THR 69 2HG2 THR 69 7.083 5.047 -2.569 178 HG23 THR 69 3HG2 THR 69 5.997 6.437 -2.549 179 H PHE 70 H PHE 70 10.782 8.383 -1.361 180 HA PHE 70 HA PHE 70 9.980 8.969 1.445 181 HB2 PHE 70 2HB PHE 70 12.833 8.859 0.412 182 HB3 PHE 70 1HB PHE 70 12.358 9.492 1.989 183 HD1 PHE 70 1HD PHE 70 13.569 6.658 0.363 184 HD2 PHE 70 2HD PHE 70 10.681 7.828 3.316 185 HE1 PHE 70 1HE PHE 70 13.592 4.363 1.289 186 HE2 PHE 70 2HE PHE 70 10.705 5.528 4.247 187 HZ PHE 70 HZ PHE 70 12.161 3.794 3.233 188 H THR 71 H THR 71 10.280 11.253 1.979 189 HA THR 71 HA THR 71 10.768 12.989 -0.396 190 HB THR 71 HB THR 71 8.577 13.391 1.657 191 HG1 THR 71 1HG THR 71 8.547 11.676 -0.173 192 HG21 THR 71 1HG2 THR 71 8.467 15.482 0.845 193 HG22 THR 71 2HG2 THR 71 8.224 14.842 -0.781 194 HG23 THR 71 3HG2 THR 71 9.857 15.152 -0.190 195 H CYS 72 H CYS 72 12.036 14.736 0.012 196 HA CYS 72 HA CYS 72 12.461 15.595 2.820 197 HB2 CYS 72 2HB CYS 72 14.610 14.906 2.931 198 HB3 CYS 72 1HB CYS 72 14.289 13.945 1.489 199 H GLY 73 H GLY 73 13.806 17.723 2.778 200 HA2 GLY 73 2HA GLY 73 12.592 19.442 0.730 201 HA3 GLY 73 1HA GLY 73 13.549 19.992 2.109 202 H ALA 74 H ALA 74 14.219 21.265 -0.110 203 HA ALA 74 HA ALA 74 16.146 21.781 -1.367 204 HB1 ALA 74 1HB ALA 74 17.184 20.334 0.651 205 HB2 ALA 74 2HB ALA 74 18.151 20.852 -0.729 206 HB3 ALA 74 3HB ALA 74 17.493 19.216 -0.678 207 H ASP 75 H ASP 75 13.866 19.927 -2.165 208 HA ASP 75 HA ASP 75 13.262 18.646 -4.029 209 HB2 ASP 75 2HB ASP 75 15.791 19.927 -5.112 210 HB3 ASP 75 1HB ASP 75 14.613 19.053 -6.090 211 H CYS 76 H CYS 76 14.533 17.175 -2.057 212 HA CYS 76 HA CYS 76 16.187 15.275 -3.675 213 HB2 CYS 76 2HB CYS 76 17.799 15.273 -2.095 214 HB3 CYS 76 1HB CYS 76 17.003 16.684 -1.398 215 H ARG 77 H ARG 77 15.329 13.264 -3.790 216 HA ARG 77 HA ARG 77 13.401 12.412 -1.674 217 HB2 ARG 77 2HB ARG 77 13.078 12.126 -4.677 218 HB3 ARG 77 1HB ARG 77 12.042 11.342 -3.486 219 HG2 ARG 77 2HG ARG 77 10.779 13.226 -3.643 220 HG3 ARG 77 1HG ARG 77 12.014 13.947 -2.613 221 HD2 ARG 77 2HD ARG 77 11.931 15.450 -4.407 222 HD3 ARG 77 1HD ARG 77 13.269 14.396 -4.866 223 HE ARG 77 HE ARG 77 11.972 13.705 -6.701 224 HH11 ARG 77 1HH1 ARG 77 10.050 13.513 -7.876 225 HH12 ARG 77 2HH1 ARG 77 8.553 13.993 -7.148 226 HH21 ARG 77 1HH2 ARG 77 10.011 14.948 -4.151 227 HH22 ARG 77 2HH2 ARG 77 8.532 14.805 -5.040 228 H GLY 78 H GLY 78 13.304 10.066 -1.405 229 HA2 GLY 78 2HA GLY 78 15.523 8.589 -2.744 230 HA3 GLY 78 1HA GLY 78 15.377 8.542 -0.988 231 H THR 79 H THR 79 15.152 6.354 -3.000 232 HA THR 79 HA THR 79 12.482 5.353 -2.138 233 HB THR 79 HB THR 79 12.052 4.412 -4.297 234 HG1 THR 79 1HG THR 79 13.885 3.695 -5.105 235 HG21 THR 79 1HG2 THR 79 11.871 6.985 -3.944 236 HG22 THR 79 2HG2 THR 79 11.759 6.351 -5.585 237 HG23 THR 79 3HG2 THR 79 13.267 7.068 -5.019 238 H SER 80 H SER 80 12.395 2.973 -2.023 239 HA SER 80 HA SER 80 15.091 1.688 -1.879 240 HB2 SER 80 2HB SER 80 12.830 1.441 0.125 241 HB3 SER 80 1HB SER 80 14.275 0.435 0.128 242 HG SER 80 HG SER 80 14.578 3.212 0.025 243 H GLN 81 H GLN 81 15.087 -0.574 -2.385 244 HA GLN 81 HA GLN 81 12.587 -1.496 -3.734 245 HB2 GLN 81 2HB GLN 81 15.500 -2.012 -4.351 246 HB3 GLN 81 1HB GLN 81 14.200 -2.979 -5.047 247 HG2 GLN 81 2HG GLN 81 14.050 0.013 -5.218 248 HG3 GLN 81 1HG GLN 81 15.092 -0.864 -6.340 249 HE21 GLN 81 1HE2 GLN 81 11.701 -0.871 -5.116 250 HE22 GLN 81 2HE2 GLN 81 11.024 -1.440 -6.563 251 H TYR 82 H TYR 82 11.711 -3.406 -3.057 252 HA TYR 82 HA TYR 82 13.366 -5.306 -1.519 253 HB2 TYR 82 2HB TYR 82 11.511 -5.417 0.245 254 HB3 TYR 82 1HB TYR 82 12.537 -3.985 0.293 255 HD1 TYR 82 1HD TYR 82 11.723 -1.932 -1.099 256 HD2 TYR 82 2HD TYR 82 9.189 -5.174 0.117 257 HE1 TYR 82 1HE TYR 82 9.731 -0.490 -1.409 258 HE2 TYR 82 2HE TYR 82 7.194 -3.732 -0.193 259 HH TYR 82 HH TYR 82 6.952 -0.894 -0.129 260 HA PRO 83 HA PRO 83 11.015 -8.273 -3.795 261 HB2 PRO 83 2HB PRO 83 10.621 -10.195 -1.787 262 HB3 PRO 83 1HB PRO 83 12.024 -10.084 -2.862 263 HG2 PRO 83 2HG PRO 83 11.717 -9.196 -0.058 264 HG3 PRO 83 1HG PRO 83 13.145 -9.807 -0.908 265 HD2 PRO 83 2HD PRO 83 12.821 -7.173 -0.324 266 HD3 PRO 83 1HD PRO 83 13.694 -7.727 -1.771 267 H CYS 84 H CYS 84 9.042 -10.037 -2.777 268 HA CYS 84 HA CYS 84 6.738 -8.303 -2.760 269 HB2 CYS 84 2HB CYS 84 5.718 -10.222 -3.332 270 HB3 CYS 84 1HB CYS 84 7.251 -11.068 -3.111 271 H VAL 85 H VAL 85 5.266 -7.915 -1.046 272 HA VAL 85 HA VAL 85 6.277 -8.566 1.692 273 HB VAL 85 HB VAL 85 5.096 -6.280 2.258 274 HG11 VAL 85 1HG1 VAL 85 7.812 -6.743 1.043 275 HG12 VAL 85 2HG1 VAL 85 7.387 -6.488 2.736 276 HG13 VAL 85 3HG1 VAL 85 7.340 -5.138 1.601 277 HG21 VAL 85 1HG2 VAL 85 5.050 -4.685 0.506 278 HG22 VAL 85 2HG2 VAL 85 4.359 -6.134 -0.220 279 HG23 VAL 85 3HG2 VAL 85 6.034 -5.694 -0.553 280 H GLN 86 H GLN 86 4.382 -8.103 3.326 281 HA GLN 86 HA GLN 86 2.299 -9.926 2.790 282 HB2 GLN 86 2HB GLN 86 2.147 -7.570 4.684 283 HB3 GLN 86 1HB GLN 86 1.220 -9.066 4.769 284 HG2 GLN 86 2HG GLN 86 4.231 -8.832 5.030 285 HG3 GLN 86 1HG GLN 86 3.101 -9.148 6.346 286 HE21 GLN 86 1HE2 GLN 86 5.292 -10.796 4.649 287 HE22 GLN 86 2HE2 GLN 86 4.517 -12.295 4.472 288 H VAL 87 H VAL 87 -0.091 -8.547 3.472 289 HA VAL 87 HA VAL 87 -0.520 -6.923 0.991 290 HB VAL 87 HB VAL 87 -2.450 -8.800 2.377 291 HG11 VAL 87 1HG1 VAL 87 -3.866 -8.332 0.373 292 HG12 VAL 87 2HG1 VAL 87 -2.701 -7.106 -0.126 293 HG13 VAL 87 3HG1 VAL 87 -3.609 -6.901 1.372 294 HG21 VAL 87 1HG2 VAL 87 -1.097 -9.005 -0.330 295 HG22 VAL 87 2HG2 VAL 87 -2.176 -10.194 0.396 296 HG23 VAL 87 3HG2 VAL 87 -0.590 -9.895 1.104 297 H TYR 88 H TYR 88 -1.689 -5.047 1.163 298 HA TYR 88 HA TYR 88 -3.449 -4.355 3.265 299 HB2 TYR 88 2HB TYR 88 -1.217 -4.335 4.518 300 HB3 TYR 88 1HB TYR 88 -0.829 -2.905 3.576 301 HD1 TYR 88 1HD TYR 88 -3.812 -4.247 5.456 302 HD2 TYR 88 2HD TYR 88 -1.275 -0.891 4.615 303 HE1 TYR 88 1HE TYR 88 -5.141 -2.857 7.005 304 HE2 TYR 88 2HE TYR 88 -2.603 0.503 6.172 305 HH TYR 88 HH TYR 88 -4.254 -0.303 8.406 306 H VAL 89 H VAL 89 -1.955 -1.502 3.060 307 HA VAL 89 HA VAL 89 -2.901 -0.939 0.302 308 HB VAL 89 HB VAL 89 -4.731 -0.416 1.927 309 HG11 VAL 89 1HG1 VAL 89 -3.379 2.019 2.872 310 HG12 VAL 89 2HG1 VAL 89 -2.683 0.531 3.506 311 HG13 VAL 89 3HG1 VAL 89 -4.391 0.880 3.757 312 HG21 VAL 89 1HG2 VAL 89 -5.259 1.050 0.296 313 HG22 VAL 89 2HG2 VAL 89 -3.555 1.287 -0.091 314 HG23 VAL 89 3HG2 VAL 89 -4.323 2.274 1.154 315 H ASN 90 H ASN 90 -1.673 0.515 -0.795 316 HA ASN 90 HA ASN 90 0.731 1.540 0.583 317 HB2 ASN 90 2HB ASN 90 0.006 1.853 -2.336 318 HB3 ASN 90 1HB ASN 90 1.604 1.911 -1.603 319 HD21 ASN 90 1HD2 ASN 90 0.877 -0.463 0.169 320 HD22 ASN 90 2HD2 ASN 90 0.992 -1.811 -0.856 321 H ASN 91 H ASN 91 0.712 3.608 1.361 322 HA ASN 91 HA ASN 91 -1.392 5.449 0.350 323 HB2 ASN 91 2HB ASN 91 0.330 5.556 2.845 324 HB3 ASN 91 1HB ASN 91 -0.861 6.779 2.397 325 HD21 ASN 91 1HD2 ASN 91 -1.123 5.264 4.819 326 HD22 ASN 91 2HD2 ASN 91 -2.483 4.257 4.675 327 H SER 92 H SER 92 -0.248 6.036 -1.592 328 HA SER 92 HA SER 92 2.393 7.307 -1.259 329 HB2 SER 92 2HB SER 92 1.063 7.479 -3.883 330 HB3 SER 92 1HB SER 92 2.694 6.954 -3.481 331 HG SER 92 HG SER 92 1.402 5.082 -2.487 332 H GLU 93 H GLU 93 0.222 8.586 0.071 333 HA GLU 93 HA GLU 93 -0.856 10.773 -1.460 334 HB2 GLU 93 2HB GLU 93 -0.242 10.693 1.514 335 HB3 GLU 93 1HB GLU 93 -1.395 11.756 0.706 336 HG2 GLU 93 2HG GLU 93 -2.673 9.745 -0.033 337 HG3 GLU 93 1HG GLU 93 -1.560 8.736 0.893 338 H SER 94 H SER 94 2.218 9.980 -0.364 339 HA SER 94 HA SER 94 3.440 12.354 -1.441 340 HB2 SER 94 2HB SER 94 4.269 13.377 0.551 341 HB3 SER 94 1HB SER 94 2.553 13.114 0.852 342 HG SER 94 HG SER 94 4.020 12.414 2.557 343 H ASN 95 H ASN 95 3.960 9.852 1.071 344 HA ASN 95 HA ASN 95 5.814 8.350 -0.512 345 HB2 ASN 95 2HB ASN 95 7.916 8.951 0.434 346 HB3 ASN 95 1HB ASN 95 7.153 10.477 0.004 347 HD21 ASN 95 1HD2 ASN 95 9.131 10.456 2.021 348 HD22 ASN 95 2HD2 ASN 95 8.400 10.755 3.524 349 H SER 96 H SER 96 3.610 7.670 1.153 350 HA SER 96 HA SER 96 5.002 6.293 3.427 351 HB2 SER 96 2HB SER 96 2.788 6.301 4.564 352 HB3 SER 96 1HB SER 96 3.404 7.924 4.261 353 HG SER 96 HG SER 96 1.656 8.243 3.156 354 H ARG 97 H ARG 97 4.648 4.116 3.705 355 HA ARG 97 HA ARG 97 2.777 2.756 1.826 356 HB2 ARG 97 2HB ARG 97 5.195 2.584 1.078 357 HB3 ARG 97 1HB ARG 97 5.523 1.714 2.577 358 HG2 ARG 97 2HG ARG 97 5.078 -0.069 1.167 359 HG3 ARG 97 1HG ARG 97 3.456 0.249 1.782 360 HD2 ARG 97 2HD ARG 97 2.946 0.294 -0.452 361 HD3 ARG 97 1HD ARG 97 3.481 1.968 -0.300 362 HE ARG 97 HE ARG 97 5.821 0.665 -0.877 363 HH11 ARG 97 1HH1 ARG 97 6.539 0.201 -2.968 364 HH12 ARG 97 2HH1 ARG 97 5.385 0.027 -4.248 365 HH21 ARG 97 1HH2 ARG 97 2.644 0.623 -2.212 366 HH22 ARG 97 2HH2 ARG 97 3.179 0.267 -3.819 367 H ALA 98 H ALA 98 1.342 1.554 3.019 368 HA ALA 98 HA ALA 98 2.169 0.754 5.770 369 HB1 ALA 98 1HB ALA 98 -0.330 0.510 6.134 370 HB2 ALA 98 2HB ALA 98 -0.549 1.255 4.550 371 HB3 ALA 98 3HB ALA 98 0.235 2.154 5.847 372 H LEU 99 H LEU 99 2.398 -1.367 6.225 373 HA LEU 99 HA LEU 99 1.284 -3.367 4.292 374 HB2 LEU 99 2HB LEU 99 3.253 -4.777 4.858 375 HB3 LEU 99 1HB LEU 99 3.720 -3.248 4.112 376 HG LEU 99 HG LEU 99 3.644 -2.556 6.764 377 HD11 LEU 99 1HD1 LEU 99 4.472 -4.268 8.126 378 HD12 LEU 99 2HD1 LEU 99 5.033 -5.222 6.753 379 HD13 LEU 99 3HD1 LEU 99 3.310 -5.127 7.117 380 HD21 LEU 99 1HD2 LEU 99 6.198 -2.998 6.600 381 HD22 LEU 99 2HD2 LEU 99 5.472 -1.881 5.445 382 HD23 LEU 99 3HD2 LEU 99 5.848 -3.535 4.958 383 H LEU 100 H LEU 100 0.143 -5.063 5.180 384 HA LEU 100 HA LEU 100 0.141 -5.318 8.160 385 HB2 LEU 100 2HB LEU 100 -1.924 -4.181 7.270 386 HB3 LEU 100 1HB LEU 100 -2.264 -5.644 6.348 387 HG LEU 100 HG LEU 100 -2.187 -6.929 8.524 388 HD11 LEU 100 1HD1 LEU 100 -2.829 -4.880 10.331 389 HD12 LEU 100 2HD1 LEU 100 -1.411 -4.289 9.470 390 HD13 LEU 100 3HD1 LEU 100 -1.350 -5.837 10.312 391 HD21 LEU 100 1HD2 LEU 100 -4.409 -6.715 8.157 392 HD22 LEU 100 2HD2 LEU 100 -4.213 -5.071 7.548 393 HD23 LEU 100 3HD2 LEU 100 -4.371 -5.354 9.281 394 H HIS 101 H HIS 101 -0.089 -7.499 8.921 395 HA HIS 101 HA HIS 101 0.667 -9.510 6.891 396 HB2 HIS 101 2HB HIS 101 0.415 -9.731 9.903 397 HB3 HIS 101 1HB HIS 101 1.057 -10.981 8.837 398 HD1 HIS 101 1HD HIS 101 1.918 -7.557 7.820 399 HD2 HIS 101 2HD HIS 101 3.609 -10.500 10.244 400 HE1 HIS 101 1HE HIS 101 4.331 -6.882 8.187 401 HE2 HIS 101 2HE HIS 101 5.370 -8.664 9.666 402 H SER 102 H SER 102 -0.913 -10.632 5.888 403 HA SER 102 HA SER 102 -3.658 -10.583 6.711 404 HB2 SER 102 2HB SER 102 -2.296 -12.594 4.897 405 HB3 SER 102 1HB SER 102 -4.020 -12.242 4.961 406 HG SER 102 HG SER 102 -2.055 -10.968 3.629 407 H ASP 103 H ASP 103 -1.049 -12.942 7.160 408 HA ASP 103 HA ASP 103 -2.237 -13.965 9.578 409 HB2 ASP 103 2HB ASP 103 -3.692 -14.978 7.701 410 HB3 ASP 103 1HB ASP 103 -2.272 -15.944 7.301 411 H GLU 104 H GLU 104 -0.870 -15.614 10.553 412 HA GLU 104 HA GLU 104 1.917 -15.261 9.963 413 HB2 GLU 104 2HB GLU 104 1.007 -15.864 12.218 414 HB3 GLU 104 1HB GLU 104 0.626 -17.469 11.593 415 HG2 GLU 104 2HG GLU 104 3.031 -17.773 11.006 416 HG3 GLU 104 1HG GLU 104 3.380 -16.211 11.748 417 H HIS 105 H HIS 105 -0.454 -17.701 9.028 418 HA HIS 105 HA HIS 105 1.312 -19.708 8.099 419 HB2 HIS 105 2HB HIS 105 -1.100 -20.075 8.268 420 HB3 HIS 105 1HB HIS 105 -1.393 -18.864 7.019 421 HD1 HIS 105 1HD HIS 105 0.363 -22.221 7.449 422 HD2 HIS 105 2HD HIS 105 -1.269 -19.842 4.442 423 HE1 HIS 105 1HE HIS 105 0.446 -23.600 5.323 424 HE2 HIS 105 2HE HIS 105 -0.549 -22.161 3.484 425 H GLN 106 H GLN 106 0.100 -16.781 6.489 426 HA GLN 106 HA GLN 106 1.233 -17.316 3.922 427 HB2 GLN 106 2HB GLN 106 -0.424 -15.487 4.443 428 HB3 GLN 106 1HB GLN 106 0.889 -14.594 5.212 429 HG2 GLN 106 2HG GLN 106 2.154 -14.609 3.102 430 HG3 GLN 106 1HG GLN 106 0.862 -15.527 2.326 431 HE21 GLN 106 1HE2 GLN 106 1.407 -13.118 1.134 432 HE22 GLN 106 2HE2 GLN 106 0.216 -11.967 1.507 433 H LEU 107 H LEU 107 2.537 -15.744 6.813 434 HA LEU 107 HA LEU 107 5.024 -14.907 5.696 435 HB2 LEU 107 2HB LEU 107 4.139 -14.201 7.938 436 HB3 LEU 107 1HB LEU 107 4.490 -15.820 8.541 437 HG LEU 107 HG LEU 107 6.893 -15.455 7.774 438 HD11 LEU 107 1HD1 LEU 107 5.694 -13.025 6.795 439 HD12 LEU 107 2HD1 LEU 107 7.349 -13.595 6.591 440 HD13 LEU 107 3HD1 LEU 107 6.919 -12.623 7.997 441 HD21 LEU 107 1HD2 LEU 107 6.877 -13.432 9.731 442 HD22 LEU 107 2HD2 LEU 107 7.065 -15.164 10.004 443 HD23 LEU 107 3HD2 LEU 107 5.463 -14.428 10.080 444 H LEU 108 H LEU 108 4.064 -17.937 7.311 445 HA LEU 108 HA LEU 108 6.624 -19.202 7.162 446 HB2 LEU 108 2HB LEU 108 4.644 -20.011 8.517 447 HB3 LEU 108 1HB LEU 108 3.908 -20.545 7.007 448 HG LEU 108 HG LEU 108 5.972 -21.921 6.571 449 HD11 LEU 108 1HD1 LEU 108 6.788 -20.532 9.008 450 HD12 LEU 108 2HD1 LEU 108 7.771 -21.420 7.844 451 HD13 LEU 108 3HD1 LEU 108 6.961 -22.281 9.153 452 HD21 LEU 108 1HD2 LEU 108 3.795 -22.717 7.713 453 HD22 LEU 108 2HD2 LEU 108 4.715 -22.658 9.217 454 HD23 LEU 108 3HD2 LEU 108 5.225 -23.730 7.912 455 H THR 109 H THR 109 3.954 -18.857 4.913 456 HA THR 109 HA THR 109 4.969 -20.689 2.929 457 HB THR 109 HB THR 109 3.001 -18.393 2.727 458 HG1 THR 109 1HG THR 109 1.758 -19.735 3.716 459 HG21 THR 109 1HG2 THR 109 3.870 -18.983 0.545 460 HG22 THR 109 2HG2 THR 109 2.227 -19.603 0.702 461 HG23 THR 109 3HG2 THR 109 3.601 -20.694 0.866 462 H ASN 110 H ASN 110 5.179 -17.184 3.441 463 HA ASN 110 HA ASN 110 7.352 -17.101 1.393 464 HB2 ASN 110 2HB ASN 110 6.540 -14.903 0.659 465 HB3 ASN 110 1HB ASN 110 5.272 -16.114 0.461 466 HD21 ASN 110 1HD2 ASN 110 4.044 -13.826 0.575 467 HD22 ASN 110 2HD2 ASN 110 3.492 -13.394 2.121 468 HA PRO 111 HA PRO 111 8.509 -15.262 5.539 469 HB2 PRO 111 2HB PRO 111 10.726 -16.816 5.948 470 HB3 PRO 111 1HB PRO 111 9.101 -17.258 6.497 471 HG2 PRO 111 2HG PRO 111 10.645 -18.238 4.166 472 HG3 PRO 111 1HG PRO 111 9.496 -19.094 5.206 473 HD2 PRO 111 2HD PRO 111 8.899 -18.142 2.676 474 HD3 PRO 111 1HD PRO 111 7.690 -18.464 3.934 475 H LYS 112 H LYS 112 10.185 -15.863 2.550 476 HA LYS 112 HA LYS 112 12.354 -13.978 3.247 477 HB2 LYS 112 2HB LYS 112 11.847 -15.613 0.742 478 HB3 LYS 112 1HB LYS 112 13.263 -14.596 1.016 479 HG2 LYS 112 2HG LYS 112 13.779 -15.939 3.059 480 HG3 LYS 112 1HG LYS 112 12.429 -17.003 2.661 481 HD2 LYS 112 2HD LYS 112 13.503 -17.466 0.452 482 HD3 LYS 112 1HD LYS 112 14.891 -16.505 0.963 483 HE2 LYS 112 2HE LYS 112 15.499 -18.740 1.475 484 HE3 LYS 112 1HE LYS 112 14.986 -18.057 3.017 485 HZ1 LYS 112 1HZ LYS 112 12.686 -19.000 1.894 486 HZ2 LYS 112 2HZ LYS 112 13.580 -19.756 3.126 487 HZ3 LYS 112 3HZ LYS 112 13.832 -20.187 1.502 488 H CYS 113 H CYS 113 9.324 -13.422 2.586 489 HA CYS 113 HA CYS 113 9.620 -11.643 0.258 490 HB2 CYS 113 2HB CYS 113 7.413 -12.832 1.772 491 HB3 CYS 113 1HB CYS 113 7.125 -11.147 1.353 492 H SER 114 H SER 114 8.285 -11.080 3.544 493 HA SER 114 HA SER 114 9.076 -8.244 3.315 494 HB2 SER 114 2HB SER 114 7.535 -9.753 5.440 495 HB3 SER 114 1HB SER 114 7.859 -8.023 5.491 496 HG SER 114 HG SER 114 6.650 -9.281 3.264 497 H TYR 115 H TYR 115 10.813 -10.870 4.118 498 HA TYR 115 HA TYR 115 11.875 -10.275 6.700 499 HB2 TYR 115 2HB TYR 115 13.474 -11.896 6.260 500 HB3 TYR 115 1HB TYR 115 12.234 -12.342 5.092 501 HD1 TYR 115 1HD TYR 115 12.404 -11.246 2.730 502 HD2 TYR 115 2HD TYR 115 15.653 -11.440 5.530 503 HE1 TYR 115 1HE TYR 115 14.018 -10.921 0.879 504 HE2 TYR 115 2HE TYR 115 17.269 -11.108 3.678 505 HH TYR 115 HH TYR 115 16.386 -10.025 0.642 506 H ILE 116 H ILE 116 12.643 -9.002 3.502 507 HA ILE 116 HA ILE 116 15.058 -7.655 4.298 508 HB ILE 116 HB ILE 116 13.409 -7.886 1.923 509 HG12 ILE 116 2HG1 ILE 116 16.206 -6.769 2.070 510 HG13 ILE 116 1HG1 ILE 116 15.896 -8.474 2.390 511 HG21 ILE 116 1HG2 ILE 116 14.488 -5.120 2.558 512 HG22 ILE 116 2HG2 ILE 116 12.798 -5.554 2.285 513 HG23 ILE 116 3HG2 ILE 116 13.957 -5.648 0.964 514 HD11 ILE 116 1HD1 ILE 116 16.457 -8.111 0.016 515 HD12 ILE 116 2HD1 ILE 116 15.103 -6.991 -0.130 516 HD13 ILE 116 3HD1 ILE 116 14.804 -8.699 0.198 517 HA PRO 117 HA PRO 117 13.765 -4.249 6.821 518 HB2 PRO 117 2HB PRO 117 15.099 -2.576 4.724 519 HB3 PRO 117 1HB PRO 117 15.257 -2.507 6.490 520 HG2 PRO 117 2HG PRO 117 17.094 -3.674 4.906 521 HG3 PRO 117 1HG PRO 117 16.758 -4.215 6.558 522 HD2 PRO 117 2HD PRO 117 16.175 -5.576 4.021 523 HD3 PRO 117 1HD PRO 117 16.174 -6.231 5.672 524 HA PRO 118 HA PRO 118 10.304 -3.027 4.057 525 HB2 PRO 118 2HB PRO 118 8.302 -3.390 5.831 526 HB3 PRO 118 1HB PRO 118 9.058 -4.753 4.982 527 HG2 PRO 118 2HG PRO 118 9.393 -3.848 7.783 528 HG3 PRO 118 1HG PRO 118 9.451 -5.483 7.105 529 HD2 PRO 118 2HD PRO 118 11.682 -3.882 7.764 530 HD3 PRO 118 1HD PRO 118 11.710 -5.368 6.794 531 H CYS 119 H CYS 119 9.163 -1.017 3.962 532 HA CYS 119 HA CYS 119 9.890 0.899 6.118 533 HB2 CYS 119 2HB CYS 119 8.719 2.364 4.075 534 HB3 CYS 119 1HB CYS 119 10.452 2.138 4.310 535 H LYS 120 H LYS 120 8.312 1.022 7.650 536 HA LYS 120 HA LYS 120 5.512 1.424 6.706 537 HB2 LYS 120 2HB LYS 120 4.655 -0.029 8.458 538 HB3 LYS 120 1HB LYS 120 5.822 -0.937 7.499 539 HG2 LYS 120 2HG LYS 120 7.579 -0.367 9.197 540 HG3 LYS 120 1HG LYS 120 6.320 0.377 10.185 541 HD2 LYS 120 2HD LYS 120 5.087 -1.844 10.081 542 HD3 LYS 120 1HD LYS 120 6.553 -2.529 9.378 543 HE2 LYS 120 2HE LYS 120 6.412 -1.101 12.050 544 HE3 LYS 120 1HE LYS 120 6.473 -2.851 11.840 545 HZ1 LYS 120 1HZ LYS 120 8.598 -1.002 11.837 546 HZ2 LYS 120 2HZ LYS 120 8.535 -1.775 10.324 547 HZ3 LYS 120 3HZ LYS 120 8.664 -2.695 11.748 548 H ARG 121 H ARG 121 4.435 3.046 7.835 549 HA ARG 121 HA ARG 121 5.965 4.847 9.455 550 HB2 ARG 121 2HB ARG 121 2.970 4.562 9.081 551 HB3 ARG 121 1HB ARG 121 3.742 5.906 9.918 552 HG2 ARG 121 2HG ARG 121 5.063 6.375 7.844 553 HG3 ARG 121 1HG ARG 121 4.138 5.120 7.019 554 HD2 ARG 121 2HD ARG 121 2.996 7.620 8.303 555 HD3 ARG 121 1HD ARG 121 3.147 7.320 6.573 556 HE ARG 121 HE ARG 121 1.636 5.208 7.811 557 HH11 ARG 121 1HH1 ARG 121 -0.600 5.203 7.481 558 HH12 ARG 121 2HH1 ARG 121 -1.385 6.650 6.945 559 HH21 ARG 121 1HH2 ARG 121 1.536 8.514 6.838 560 HH22 ARG 121 2HH2 ARG 121 -0.176 8.524 6.581 561 H GLU 122 H GLU 122 3.656 2.276 10.249 562 HA GLU 122 HA GLU 122 4.741 2.222 12.992 563 HB2 GLU 122 2HB GLU 122 2.793 3.781 13.070 564 HB3 GLU 122 1HB GLU 122 1.768 2.485 12.456 565 HG2 GLU 122 2HG GLU 122 2.413 1.088 14.419 566 HG3 GLU 122 1HG GLU 122 3.336 2.452 15.050 567 H ASN 123 H ASN 123 4.377 0.178 14.030 568 HA ASN 123 HA ASN 123 4.371 -2.093 12.338 569 HB2 ASN 123 2HB ASN 123 3.478 -2.038 15.231 570 HB3 ASN 123 1HB ASN 123 4.170 -3.406 14.357 571 HD21 ASN 123 1HD2 ASN 123 4.929 -0.260 15.804 572 HD22 ASN 123 2HD2 ASN 123 6.615 -0.463 15.787 573 H GLN 124 H GLN 124 1.725 -0.507 14.073 574 HA GLN 124 HA GLN 124 -0.600 -0.780 13.904 575 HB2 GLN 124 2HB GLN 124 0.187 -1.792 11.154 576 HB3 GLN 124 1HB GLN 124 -1.450 -1.359 11.644 577 HG2 GLN 124 2HG GLN 124 -0.724 0.941 12.111 578 HG3 GLN 124 1HG GLN 124 0.929 0.519 11.665 579 HE21 GLN 124 1HE2 GLN 124 -0.466 2.557 10.241 580 HE22 GLN 124 2HE2 GLN 124 -0.779 2.005 8.667 581 H LYS 125 H LYS 125 0.437 -2.777 15.402 582 HA LYS 125 HA LYS 125 0.128 -5.435 14.463 583 HB2 LYS 125 2HB LYS 125 1.142 -4.792 16.665 584 HB3 LYS 125 1HB LYS 125 -0.481 -4.442 17.262 585 HG2 LYS 125 2HG LYS 125 -1.123 -6.812 16.632 586 HG3 LYS 125 1HG LYS 125 0.588 -7.116 16.321 587 HD2 LYS 125 2HD LYS 125 -0.517 -6.100 18.956 588 HD3 LYS 125 1HD LYS 125 -0.120 -7.787 18.626 589 HE2 LYS 125 2HE LYS 125 1.873 -7.089 19.578 590 HE3 LYS 125 1HE LYS 125 2.207 -6.733 17.883 591 HZ1 LYS 125 1HZ LYS 125 2.304 -4.576 18.320 592 HZ2 LYS 125 2HZ LYS 125 2.251 -4.956 19.975 593 HZ3 LYS 125 3HZ LYS 125 0.818 -4.593 19.137 594 H ASN 126 H ASN 126 -1.652 -6.545 13.866 595 HA ASN 126 HA ASN 126 -4.287 -5.748 14.999 596 HB2 ASN 126 2HB ASN 126 -3.642 -6.128 12.062 597 HB3 ASN 126 1HB ASN 126 -5.278 -5.999 12.707 598 HD21 ASN 126 1HD2 ASN 126 -4.331 -4.054 10.863 599 HD22 ASN 126 2HD2 ASN 126 -4.138 -2.575 11.673 600 H LEU 127 H LEU 127 -5.402 -7.535 15.670 601 HA LEU 127 HA LEU 127 -4.376 -10.192 14.807 602 HB2 LEU 127 2HB LEU 127 -5.834 -9.203 17.243 603 HB3 LEU 127 1HB LEU 127 -5.918 -10.909 16.808 604 HG LEU 127 HG LEU 127 -4.042 -10.300 18.406 605 HD11 LEU 127 1HD1 LEU 127 -4.053 -12.017 16.139 606 HD12 LEU 127 2HD1 LEU 127 -3.101 -12.182 17.614 607 HD13 LEU 127 3HD1 LEU 127 -2.445 -11.300 16.235 608 HD21 LEU 127 1HD2 LEU 127 -2.691 -9.164 15.958 609 HD22 LEU 127 2HD2 LEU 127 -2.192 -9.039 17.644 610 HD23 LEU 127 3HD2 LEU 127 -3.588 -8.130 17.069 611 H GLU 128 H GLU 128 -7.511 -10.098 16.195 612 HA GLU 128 HA GLU 128 -8.759 -11.386 13.986 613 HB2 GLU 128 2HB GLU 128 -9.634 -11.377 16.338 614 HB3 GLU 128 1HB GLU 128 -10.113 -9.694 16.109 615 HG2 GLU 128 2HG GLU 128 -11.513 -10.395 14.168 616 HG3 GLU 128 1HG GLU 128 -11.097 -12.075 14.510 617 H SER 129 H SER 129 -8.212 -8.017 14.718 618 HA SER 129 HA SER 129 -10.157 -6.823 13.034 619 HB2 SER 129 2HB SER 129 -7.346 -5.856 13.615 620 HB3 SER 129 1HB SER 129 -8.661 -4.869 12.987 621 HG SER 129 HG SER 129 -9.158 -4.587 15.006 622 H VAL 130 H VAL 130 -7.041 -8.294 12.278 623 HA VAL 130 HA VAL 130 -6.735 -7.302 9.631 624 HB VAL 130 HB VAL 130 -5.941 -9.975 10.819 625 HG11 VAL 130 1HG1 VAL 130 -5.553 -10.569 8.668 626 HG12 VAL 130 2HG1 VAL 130 -4.228 -9.407 8.717 627 HG13 VAL 130 3HG1 VAL 130 -5.802 -8.922 8.086 628 HG21 VAL 130 1HG2 VAL 130 -3.684 -8.869 10.843 629 HG22 VAL 130 2HG2 VAL 130 -4.858 -8.088 11.903 630 HG23 VAL 130 3HG2 VAL 130 -4.465 -7.370 10.342 631 H MET 131 H MET 131 -8.526 -10.151 10.838 632 HA MET 131 HA MET 131 -9.290 -11.177 8.300 633 HB2 MET 131 2HB MET 131 -9.727 -12.023 10.807 634 HB3 MET 131 1HB MET 131 -11.284 -11.243 10.523 635 HG2 MET 131 2HG MET 131 -10.011 -13.432 8.858 636 HG3 MET 131 1HG MET 131 -11.478 -13.554 9.831 637 HE1 MET 131 1HE MET 131 -14.131 -11.611 8.089 638 HE2 MET 131 2HE MET 131 -13.040 -10.727 9.152 639 HE3 MET 131 3HE MET 131 -13.503 -12.379 9.554 640 H ASN 132 H ASN 132 -10.776 -8.703 10.363 641 HA ASN 132 HA ASN 132 -13.066 -8.219 8.723 642 HB2 ASN 132 2HB ASN 132 -12.639 -7.360 11.093 643 HB3 ASN 132 1HB ASN 132 -11.623 -6.119 10.356 644 HD21 ASN 132 1HD2 ASN 132 -13.348 -4.600 11.282 645 HD22 ASN 132 2HD2 ASN 132 -14.750 -4.333 10.363 646 H TRP 133 H TRP 133 -9.757 -6.955 8.623 647 HA TRP 133 HA TRP 133 -10.158 -4.890 6.717 648 HB2 TRP 133 2HB TRP 133 -7.986 -4.734 7.378 649 HB3 TRP 133 1HB TRP 133 -7.879 -6.461 7.725 650 HD1 TRP 133 HD TRP 133 -7.328 -8.102 5.669 651 HE1 TRP 133 1HE TRP 133 -6.129 -7.669 3.429 652 HE3 TRP 133 3HE TRP 133 -7.527 -3.001 5.531 653 HZ2 TRP 133 2HZ TRP 133 -5.353 -5.454 1.796 654 HZ3 TRP 133 3HZ TRP 133 -6.547 -1.758 3.627 655 HH2 TRP 133 HH TRP 133 -5.463 -2.975 1.761 656 H GLN 134 H GLN 134 -9.291 -8.310 6.202 657 HA GLN 134 HA GLN 134 -9.296 -8.184 3.345 658 HB2 GLN 134 2HB GLN 134 -8.348 -10.057 4.736 659 HB3 GLN 134 1HB GLN 134 -9.999 -10.568 5.084 660 HG2 GLN 134 2HG GLN 134 -10.206 -10.452 2.426 661 HG3 GLN 134 1HG GLN 134 -8.466 -10.719 2.524 662 HE21 GLN 134 1HE2 GLN 134 -11.534 -12.037 3.877 663 HE22 GLN 134 2HE2 GLN 134 -10.988 -13.644 3.939 664 H GLN 135 H GLN 135 -11.832 -8.940 5.713 665 HA GLN 135 HA GLN 135 -13.870 -9.653 3.855 666 HB2 GLN 135 2HB GLN 135 -13.932 -9.967 6.366 667 HB3 GLN 135 1HB GLN 135 -14.277 -8.242 6.505 668 HG2 GLN 135 2HG GLN 135 -16.291 -8.521 5.118 669 HG3 GLN 135 1HG GLN 135 -15.945 -10.244 4.954 670 HE21 GLN 135 1HE2 GLN 135 -18.375 -9.685 6.093 671 HE22 GLN 135 2HE2 GLN 135 -18.341 -9.948 7.768 672 H TYR 136 H TYR 136 -12.876 -6.505 5.153 673 HA TYR 136 HA TYR 136 -15.021 -4.990 4.014 674 HB2 TYR 136 2HB TYR 136 -13.608 -4.042 5.753 675 HB3 TYR 136 1HB TYR 136 -12.188 -4.174 4.714 676 HD1 TYR 136 1HD TYR 136 -11.887 -2.710 2.782 677 HD2 TYR 136 2HD TYR 136 -15.315 -2.338 5.344 678 HE1 TYR 136 1HE TYR 136 -12.390 -0.498 1.782 679 HE2 TYR 136 2HE TYR 136 -15.821 -0.125 4.344 680 HH TYR 136 HH TYR 136 -14.498 0.948 1.493 681 H TRP 137 H TRP 137 -11.670 -5.473 2.813 682 HA TRP 137 HA TRP 137 -12.266 -4.133 0.320 683 HB2 TRP 137 2HB TRP 137 -9.948 -5.845 1.229 684 HB3 TRP 137 1HB TRP 137 -10.022 -5.101 -0.364 685 HD1 TRP 137 HD TRP 137 -8.682 -4.445 2.910 686 HE1 TRP 137 1HE TRP 137 -8.271 -1.935 3.310 687 HE3 TRP 137 3HE TRP 137 -11.374 -2.482 -0.950 688 HZ2 TRP 137 2HZ TRP 137 -8.985 0.574 2.145 689 HZ3 TRP 137 3HZ TRP 137 -11.493 -0.032 -1.287 690 HH2 TRP 137 HH TRP 137 -10.302 1.500 0.257 691 H LYS 138 H LYS 138 -11.993 -7.542 1.290 692 HA LYS 138 HA LYS 138 -12.260 -8.675 -1.294 693 HB2 LYS 138 2HB LYS 138 -11.689 -9.954 0.772 694 HB3 LYS 138 1HB LYS 138 -13.364 -9.790 1.298 695 HG2 LYS 138 2HG LYS 138 -14.104 -10.936 -0.779 696 HG3 LYS 138 1HG LYS 138 -12.415 -11.154 -1.240 697 HD2 LYS 138 2HD LYS 138 -12.055 -12.389 0.920 698 HD3 LYS 138 1HD LYS 138 -13.792 -12.298 1.205 699 HE2 LYS 138 2HE LYS 138 -13.524 -14.399 0.175 700 HE3 LYS 138 1HE LYS 138 -14.019 -13.353 -1.156 701 HZ1 LYS 138 1HZ LYS 138 -11.406 -14.536 -0.590 702 HZ2 LYS 138 2HZ LYS 138 -11.434 -12.999 -1.316 703 HZ3 LYS 138 3HZ LYS 138 -12.196 -14.314 -2.076 704 H ASP 139 H ASP 139 -14.716 -7.579 1.003 705 HA ASP 139 HA ASP 139 -16.962 -8.522 -0.543 706 HB2 ASP 139 2HB ASP 139 -16.750 -6.405 1.612 707 HB3 ASP 139 1HB ASP 139 -18.276 -6.970 0.929 708 H GLU 140 H GLU 140 -15.053 -5.557 -0.633 709 HA GLU 140 HA GLU 140 -17.025 -4.371 -2.507 710 HB2 GLU 140 2HB GLU 140 -14.612 -3.120 -1.171 711 HB3 GLU 140 1HB GLU 140 -15.801 -2.272 -2.158 712 HG2 GLU 140 2HG GLU 140 -17.580 -2.953 -0.556 713 HG3 GLU 140 1HG GLU 140 -16.349 -3.712 0.454 714 H ILE 141 H ILE 141 -13.478 -4.079 -2.367 715 HA ILE 141 HA ILE 141 -13.359 -3.998 -5.253 716 HB ILE 141 HB ILE 141 -10.975 -3.708 -4.983 717 HG12 ILE 141 2HG1 ILE 141 -11.397 -4.467 -2.073 718 HG13 ILE 141 1HG1 ILE 141 -10.656 -5.517 -3.277 719 HG21 ILE 141 1HG2 ILE 141 -12.637 -2.352 -2.847 720 HG22 ILE 141 2HG2 ILE 141 -12.268 -1.748 -4.461 721 HG23 ILE 141 3HG2 ILE 141 -10.992 -1.859 -3.249 722 HD11 ILE 141 1HD1 ILE 141 -8.678 -4.546 -2.845 723 HD12 ILE 141 2HD1 ILE 141 -9.446 -3.390 -1.758 724 HD13 ILE 141 3HD1 ILE 141 -9.325 -3.033 -3.479 725 H GLY 142 H GLY 142 -13.132 -6.558 -2.928 726 HA2 GLY 142 2HA GLY 142 -13.069 -8.887 -3.393 727 HA3 GLY 142 1HA GLY 142 -12.909 -8.500 -5.105 728 H SER 143 H SER 143 -10.676 -7.000 -5.260 729 HA SER 143 HA SER 143 -8.398 -7.470 -3.799 730 HB2 SER 143 2HB SER 143 -9.241 -9.918 -5.283 731 HB3 SER 143 1HB SER 143 -7.525 -9.522 -5.300 732 HG SER 143 HG SER 143 -7.975 -10.781 -3.500 733 H GLN 144 H GLN 144 -8.836 -5.406 -5.289 734 HA GLN 144 HA GLN 144 -7.005 -5.716 -7.602 735 HB2 GLN 144 2HB GLN 144 -9.036 -3.848 -8.336 736 HB3 GLN 144 1HB GLN 144 -8.621 -5.374 -9.117 737 HG2 GLN 144 2HG GLN 144 -10.080 -6.597 -7.582 738 HG3 GLN 144 1HG GLN 144 -10.449 -5.107 -6.714 739 HE21 GLN 144 1HE2 GLN 144 -10.735 -3.361 -8.992 740 HE22 GLN 144 2HE2 GLN 144 -12.119 -3.843 -9.850 741 HA PRO 145 HA PRO 145 -5.435 -2.160 -5.160 742 HB2 PRO 145 2HB PRO 145 -3.647 -2.003 -7.541 743 HB3 PRO 145 1HB PRO 145 -3.237 -2.004 -5.817 744 HG2 PRO 145 2HG PRO 145 -2.853 -4.140 -7.389 745 HG3 PRO 145 1HG PRO 145 -3.264 -4.279 -5.674 746 HD2 PRO 145 2HD PRO 145 -4.954 -4.817 -8.054 747 HD3 PRO 145 1HD PRO 145 -5.066 -5.488 -6.412 748 H PHE 146 H PHE 146 -5.335 0.200 -5.629 749 HA PHE 146 HA PHE 146 -6.420 1.022 -8.236 750 HB2 PHE 146 2HB PHE 146 -8.109 2.491 -7.153 751 HB3 PHE 146 1HB PHE 146 -8.429 0.779 -6.898 752 HD1 PHE 146 1HD PHE 146 -8.291 3.907 -5.367 753 HD2 PHE 146 2HD PHE 146 -7.230 -0.198 -4.666 754 HE1 PHE 146 1HE PHE 146 -8.334 4.315 -2.925 755 HE2 PHE 146 2HE PHE 146 -7.262 0.216 -2.225 756 HZ PHE 146 HZ PHE 146 -7.816 2.469 -1.351 757 H THR 147 H THR 147 -6.117 3.305 -8.676 758 HA THR 147 HA THR 147 -4.032 4.545 -6.932 759 HB THR 147 HB THR 147 -3.003 5.473 -8.924 760 HG1 THR 147 1HG THR 147 -4.299 4.083 -10.801 761 HG21 THR 147 1HG2 THR 147 -2.852 3.029 -10.172 762 HG22 THR 147 2HG2 THR 147 -3.373 2.589 -8.545 763 HG23 THR 147 3HG2 THR 147 -1.890 3.514 -8.775 764 H CYS 148 H CYS 148 -4.055 6.861 -6.907 765 HA CYS 148 HA CYS 148 -6.543 8.125 -7.883 766 HB2 CYS 148 2HB CYS 148 -6.220 9.398 -5.494 767 HB3 CYS 148 1HB CYS 148 -7.297 8.021 -5.721 768 H TYR 149 H TYR 149 -6.329 10.481 -8.029 769 HA TYR 149 HA TYR 149 -3.619 11.625 -7.709 770 HB2 TYR 149 2HB TYR 149 -5.021 11.478 -10.404 771 HB3 TYR 149 1HB TYR 149 -3.568 12.418 -10.069 772 HD1 TYR 149 1HD TYR 149 -1.447 11.271 -9.453 773 HD2 TYR 149 2HD TYR 149 -4.931 9.093 -10.698 774 HE1 TYR 149 1HE TYR 149 -0.045 9.265 -9.863 775 HE2 TYR 149 2HE TYR 149 -3.532 7.086 -11.109 776 HH TYR 149 HH TYR 149 -0.012 7.221 -10.861 777 H PHE 150 H PHE 150 -3.893 13.786 -7.071 778 HA PHE 150 HA PHE 150 -6.307 15.163 -8.013 779 HB2 PHE 150 2HB PHE 150 -7.424 15.341 -6.023 780 HB3 PHE 150 1HB PHE 150 -6.593 13.823 -5.702 781 HD1 PHE 150 1HD PHE 150 -4.254 13.975 -4.563 782 HD2 PHE 150 2HD PHE 150 -7.097 17.190 -4.657 783 HE1 PHE 150 1HE PHE 150 -3.142 15.015 -2.606 784 HE2 PHE 150 2HE PHE 150 -5.995 18.242 -2.702 785 HZ PHE 150 HZ PHE 150 -4.011 17.140 -1.667 786 H ASN 151 H ASN 151 -6.245 17.449 -7.744 787 HA ASN 151 HA ASN 151 -3.682 18.539 -6.712 788 HB2 ASN 151 2HB ASN 151 -3.399 19.899 -8.731 789 HB3 ASN 151 1HB ASN 151 -3.436 18.190 -9.148 790 HD21 ASN 151 1HD2 ASN 151 -4.727 17.788 -10.941 791 HD22 ASN 151 2HD2 ASN 151 -6.120 18.663 -11.359 792 H GLN 152 H GLN 152 -3.893 20.461 -5.707 793 HA GLN 152 HA GLN 152 -6.590 21.647 -5.442 794 HB2 GLN 152 2HB GLN 152 -5.214 21.219 -3.393 795 HB3 GLN 152 1HB GLN 152 -3.990 22.326 -4.016 796 HG2 GLN 152 2HG GLN 152 -5.552 24.183 -3.947 797 HG3 GLN 152 1HG GLN 152 -6.873 23.108 -3.497 798 HE21 GLN 152 1HE2 GLN 152 -6.412 25.166 -1.736 799 HE22 GLN 152 2HE2 GLN 152 -5.630 24.605 -0.336 800 H HIS 153 H HIS 153 -3.849 21.913 -7.318 801 HA HIS 153 HA HIS 153 -3.263 24.603 -7.623 802 HB2 HIS 153 2HB HIS 153 -3.549 22.448 -9.730 803 HB3 HIS 153 1HB HIS 153 -2.824 24.023 -10.038 804 HD1 HIS 153 1HD HIS 153 -0.364 24.100 -9.708 805 HD2 HIS 153 2HD HIS 153 -2.108 21.128 -7.345 806 HE1 HIS 153 1HE HIS 153 1.532 22.932 -8.501 807 HE2 HIS 153 2HE HIS 153 0.482 21.124 -7.065 808 H GLN 154 H GLN 154 -6.135 22.875 -8.764 809 HA GLN 154 HA GLN 154 -7.132 25.059 -10.371 810 HB2 GLN 154 2HB GLN 154 -8.562 22.747 -9.018 811 HB3 GLN 154 1HB GLN 154 -9.312 23.845 -10.174 812 HG2 GLN 154 2HG GLN 154 -7.697 23.179 -11.897 813 HG3 GLN 154 1HG GLN 154 -6.891 22.113 -10.744 814 HE21 GLN 154 1HE2 GLN 154 -8.013 21.050 -13.139 815 HE22 GLN 154 2HE2 GLN 154 -9.349 20.086 -12.733 816 H ARG 155 H ARG 155 -8.471 23.807 -7.308 817 HA ARG 155 HA ARG 155 -8.299 26.350 -5.987 818 HB2 ARG 155 2HB ARG 155 -10.520 25.987 -7.729 819 HB3 ARG 155 1HB ARG 155 -11.127 25.961 -6.070 820 HG2 ARG 155 2HG ARG 155 -10.120 28.095 -5.588 821 HG3 ARG 155 1HG ARG 155 -9.236 28.087 -7.115 822 HD2 ARG 155 2HD ARG 155 -10.974 29.182 -8.035 823 HD3 ARG 155 1HD ARG 155 -11.922 27.709 -7.828 824 HE ARG 155 HE ARG 155 -12.128 28.890 -5.362 825 HH11 ARG 155 1HH1 ARG 155 -13.689 30.434 -4.824 826 HH12 ARG 155 2HH1 ARG 155 -14.376 31.421 -6.069 827 HH21 ARG 155 1HH2 ARG 155 -12.513 29.974 -8.610 828 HH22 ARG 155 2HH2 ARG 155 -13.711 31.160 -8.214 829 HA PRO 156 HA PRO 156 -10.247 23.189 -3.106 830 HB2 PRO 156 2HB PRO 156 -12.022 21.386 -3.941 831 HB3 PRO 156 1HB PRO 156 -12.417 23.114 -3.975 832 HG2 PRO 156 2HG PRO 156 -11.803 21.291 -6.209 833 HG3 PRO 156 1HG PRO 156 -12.756 22.783 -6.198 834 HD2 PRO 156 2HD PRO 156 -9.960 22.447 -6.937 835 HD3 PRO 156 1HD PRO 156 -10.959 23.908 -7.025 836 H ASP 157 H ASP 157 -10.927 20.406 -4.965 837 HA ASP 157 HA ASP 157 -8.247 19.265 -4.900 838 HB2 ASP 157 2HB ASP 157 -8.839 17.479 -3.260 839 HB3 ASP 157 1HB ASP 157 -8.827 19.082 -2.528 840 H ASP 158 H ASP 158 -9.045 19.060 -7.192 841 HA ASP 158 HA ASP 158 -11.268 17.216 -7.708 842 HB2 ASP 158 2HB ASP 158 -10.525 18.990 -9.344 843 HB3 ASP 158 1HB ASP 158 -9.036 18.074 -9.587 844 H VAL 159 H VAL 159 -11.046 15.010 -7.401 845 HA VAL 159 HA VAL 159 -8.269 13.907 -7.560 846 HB VAL 159 HB VAL 159 -9.218 13.968 -5.271 847 HG11 VAL 159 1HG1 VAL 159 -11.130 12.587 -4.713 848 HG12 VAL 159 2HG1 VAL 159 -11.220 11.970 -6.363 849 HG13 VAL 159 3HG1 VAL 159 -11.598 13.661 -6.033 850 HG21 VAL 159 1HG2 VAL 159 -8.131 12.032 -4.800 851 HG22 VAL 159 2HG2 VAL 159 -7.889 11.898 -6.543 852 HG23 VAL 159 3HG2 VAL 159 -9.246 11.075 -5.773 853 H LEU 160 H LEU 160 -7.965 11.818 -8.358 854 HA LEU 160 HA LEU 160 -10.162 10.800 -10.115 855 HB2 LEU 160 2HB LEU 160 -7.290 11.197 -10.486 856 HB3 LEU 160 1HB LEU 160 -7.775 9.542 -10.856 857 HG LEU 160 HG LEU 160 -7.932 11.057 -12.837 858 HD11 LEU 160 1HD1 LEU 160 -9.804 9.195 -11.888 859 HD12 LEU 160 2HD1 LEU 160 -9.629 9.756 -13.550 860 HD13 LEU 160 3HD1 LEU 160 -10.768 10.552 -12.465 861 HD21 LEU 160 1HD2 LEU 160 -9.073 13.030 -12.783 862 HD22 LEU 160 2HD2 LEU 160 -8.886 12.893 -11.035 863 HD23 LEU 160 3HD2 LEU 160 -10.377 12.354 -11.807 864 H LEU 161 H LEU 161 -10.445 8.440 -10.155 865 HA LEU 161 HA LEU 161 -9.134 6.993 -7.903 866 HB2 LEU 161 2HB LEU 161 -11.385 7.896 -7.200 867 HB3 LEU 161 1HB LEU 161 -12.110 6.864 -8.433 868 HG LEU 161 HG LEU 161 -10.578 5.024 -7.226 869 HD11 LEU 161 1HD1 LEU 161 -9.632 6.600 -5.602 870 HD12 LEU 161 2HD1 LEU 161 -10.637 5.409 -4.776 871 HD13 LEU 161 3HD1 LEU 161 -11.251 7.038 -5.060 872 HD21 LEU 161 1HD2 LEU 161 -12.980 4.828 -7.542 873 HD22 LEU 161 2HD2 LEU 161 -13.279 6.030 -6.287 874 HD23 LEU 161 3HD2 LEU 161 -12.600 4.460 -5.860 875 H HIS 162 H HIS 162 -8.107 6.302 -10.166 876 HA HIS 162 HA HIS 162 -9.669 4.456 -11.777 877 HB2 HIS 162 2HB HIS 162 -6.669 4.851 -11.526 878 HB3 HIS 162 1HB HIS 162 -7.442 3.830 -12.736 879 HD1 HIS 162 1HD HIS 162 -5.809 6.239 -13.694 880 HD2 HIS 162 2HD HIS 162 -9.903 6.428 -12.911 881 HE1 HIS 162 1HE HIS 162 -6.702 8.213 -15.009 882 HE2 HIS 162 2HE HIS 162 -9.192 8.336 -14.540 883 H ARG 163 H ARG 163 -9.566 2.142 -11.728 884 HA ARG 163 HA ARG 163 -8.480 1.021 -9.170 885 HB2 ARG 163 2HB ARG 163 -10.898 0.173 -10.784 886 HB3 ARG 163 1HB ARG 163 -10.284 -0.694 -9.377 887 HG2 ARG 163 2HG ARG 163 -10.561 1.395 -8.028 888 HG3 ARG 163 1HG ARG 163 -11.304 2.162 -9.433 889 HD2 ARG 163 2HD ARG 163 -12.318 -0.313 -8.001 890 HD3 ARG 163 1HD ARG 163 -13.047 1.292 -7.951 891 HE ARG 163 HE ARG 163 -13.031 0.758 -10.634 892 HH11 ARG 163 1HH1 ARG 163 -14.650 -0.391 -11.716 893 HH12 ARG 163 2HH1 ARG 163 -15.599 -1.549 -10.847 894 HH21 ARG 163 1HH2 ARG 163 -13.971 -1.016 -7.832 895 HH22 ARG 163 2HH2 ARG 163 -15.215 -1.904 -8.649 896 H THR 164 H THR 164 -7.589 -1.133 -9.266 897 HA THR 164 HA THR 164 -6.187 -1.698 -11.770 898 HB THR 164 HB THR 164 -6.267 -3.247 -9.167 899 HG1 THR 164 1HG THR 164 -5.233 -0.955 -9.649 900 HG21 THR 164 1HG2 THR 164 -4.790 -3.595 -11.750 901 HG22 THR 164 2HG2 THR 164 -5.500 -4.817 -10.696 902 HG23 THR 164 3HG2 THR 164 -3.989 -4.030 -10.240 903 H HIS 165 H HIS 165 -6.656 -3.340 -13.217 904 HA HIS 165 HA HIS 165 -9.092 -4.981 -12.621 905 HB2 HIS 165 2HB HIS 165 -9.440 -3.287 -14.414 906 HB3 HIS 165 1HB HIS 165 -8.114 -4.010 -15.325 907 HD1 HIS 165 1HD HIS 165 -11.361 -5.209 -13.692 908 HD2 HIS 165 2HD HIS 165 -9.008 -5.963 -17.053 909 HE1 HIS 165 1HE HIS 165 -12.587 -6.967 -15.047 910 HE2 HIS 165 2HE HIS 165 -11.162 -7.433 -17.095 911 H ASP 166 H ASP 166 -8.825 -7.169 -12.768 912 HA ASP 166 HA ASP 166 -6.161 -8.238 -13.229 913 HB2 ASP 166 2HB ASP 166 -7.787 -9.215 -11.590 914 HB3 ASP 166 1HB ASP 166 -8.785 -9.734 -12.950 Start of MODEL 2 1 H1 GLN 45 1HT GLN 45 0.030 15.714 -3.917 2 H2 GLN 45 2HT GLN 45 0.045 14.607 -5.205 3 H3 GLN 45 3HT GLN 45 1.061 15.968 -5.239 4 HA GLN 45 HA GLN 45 1.427 13.421 -3.935 5 HB2 GLN 45 2HB GLN 45 3.249 15.699 -4.768 6 HB3 GLN 45 1HB GLN 45 3.808 14.141 -4.158 7 HG2 GLN 45 2HG GLN 45 2.701 12.988 -6.021 8 HG3 GLN 45 1HG GLN 45 2.084 14.529 -6.623 9 HE21 GLN 45 1HE2 GLN 45 3.780 12.926 -8.258 10 HE22 GLN 45 2HE2 GLN 45 5.270 13.720 -8.442 11 H ASP 46 H ASP 46 3.544 15.907 -2.939 12 HA ASP 46 HA ASP 46 2.494 15.663 -0.166 13 HB2 ASP 46 2HB ASP 46 4.866 15.009 -0.571 14 HB3 ASP 46 1HB ASP 46 5.198 16.653 -1.117 15 H LEU 47 H LEU 47 4.627 18.249 -0.554 16 HA LEU 47 HA LEU 47 2.754 20.219 0.255 17 HB2 LEU 47 2HB LEU 47 5.319 20.638 -1.313 18 HB3 LEU 47 1HB LEU 47 4.479 21.853 -0.347 19 HG LEU 47 HG LEU 47 5.696 19.280 0.701 20 HD11 LEU 47 1HD1 LEU 47 6.556 22.153 0.637 21 HD12 LEU 47 2HD1 LEU 47 7.519 20.693 0.404 22 HD13 LEU 47 3HD1 LEU 47 7.002 21.160 2.026 23 HD21 LEU 47 1HD2 LEU 47 3.926 19.643 2.165 24 HD22 LEU 47 2HD2 LEU 47 3.928 21.386 1.897 25 HD23 LEU 47 3HD2 LEU 47 5.166 20.649 2.913 26 H GLN 48 H GLN 48 3.708 19.101 -2.947 27 HA GLN 48 HA GLN 48 2.054 21.189 -4.232 28 HB2 GLN 48 2HB GLN 48 4.275 20.556 -5.196 29 HB3 GLN 48 1HB GLN 48 3.642 18.937 -5.500 30 HG2 GLN 48 2HG GLN 48 3.407 20.219 -7.539 31 HG3 GLN 48 1HG GLN 48 1.796 19.997 -6.852 32 HE21 GLN 48 1HE2 GLN 48 0.618 21.870 -6.320 33 HE22 GLN 48 2HE2 GLN 48 1.253 23.442 -6.382 34 H ALA 49 H ALA 49 -0.041 20.803 -4.708 35 HA ALA 49 HA ALA 49 -1.143 18.101 -4.362 36 HB1 ALA 49 1HB ALA 49 -2.403 19.986 -3.467 37 HB2 ALA 49 2HB ALA 49 -3.320 19.262 -4.787 38 HB3 ALA 49 3HB ALA 49 -2.425 20.759 -5.050 39 H THR 50 H THR 50 -1.404 16.710 -6.049 40 HA THR 50 HA THR 50 -2.293 17.510 -8.657 41 HB THR 50 HB THR 50 0.615 16.661 -8.514 42 HG1 THR 50 1HG THR 50 0.578 18.964 -9.548 43 HG21 THR 50 1HG2 THR 50 -1.129 16.285 -10.559 44 HG22 THR 50 2HG2 THR 50 0.592 16.587 -10.795 45 HG23 THR 50 3HG2 THR 50 -0.561 17.913 -10.929 46 H GLU 51 H GLU 51 0.117 15.053 -7.730 47 HA GLU 51 HA GLU 51 -1.860 12.987 -8.567 48 HB2 GLU 51 2HB GLU 51 1.156 12.827 -8.478 49 HB3 GLU 51 1HB GLU 51 0.070 11.584 -9.098 50 HG2 GLU 51 2HG GLU 51 -0.774 13.219 -10.788 51 HG3 GLU 51 1HG GLU 51 0.415 14.385 -10.207 52 H ALA 52 H ALA 52 -2.399 11.376 -7.206 53 HA ALA 52 HA ALA 52 -0.770 10.735 -4.841 54 HB1 ALA 52 1HB ALA 52 -3.400 12.146 -4.736 55 HB2 ALA 52 2HB ALA 52 -2.056 12.202 -3.594 56 HB3 ALA 52 3HB ALA 52 -3.159 10.824 -3.594 57 H ASN 53 H ASN 53 -0.644 8.497 -5.275 58 HA ASN 53 HA ASN 53 -3.140 7.267 -6.312 59 HB2 ASN 53 2HB ASN 53 -0.311 6.232 -6.362 60 HB3 ASN 53 1HB ASN 53 -1.708 5.309 -6.903 61 HD21 ASN 53 1HD2 ASN 53 -3.185 7.509 -8.093 62 HD22 ASN 53 2HD2 ASN 53 -2.328 8.017 -9.469 63 H CYS 54 H CYS 54 -4.226 5.676 -5.305 64 HA CYS 54 HA CYS 54 -3.177 4.778 -2.657 65 HB2 CYS 54 2HB CYS 54 -6.074 4.985 -2.775 66 HB3 CYS 54 1HB CYS 54 -4.967 5.692 -1.602 67 H THR 55 H THR 55 -2.680 2.672 -3.369 68 HA THR 55 HA THR 55 -4.964 1.216 -4.612 69 HB THR 55 HB THR 55 -3.641 0.588 -6.319 70 HG1 THR 55 1HG THR 55 -1.534 -0.344 -5.784 71 HG21 THR 55 1HG2 THR 55 -1.407 2.176 -5.036 72 HG22 THR 55 2HG2 THR 55 -2.750 2.938 -5.880 73 HG23 THR 55 3HG2 THR 55 -1.658 1.867 -6.752 74 H VAL 56 H VAL 56 -5.277 -0.926 -4.097 75 HA VAL 56 HA VAL 56 -4.109 -1.774 -1.510 76 HB VAL 56 HB VAL 56 -6.528 -2.559 -3.124 77 HG11 VAL 56 1HG1 VAL 56 -5.679 -4.710 -2.674 78 HG12 VAL 56 2HG1 VAL 56 -6.766 -4.407 -1.318 79 HG13 VAL 56 3HG1 VAL 56 -5.025 -4.223 -1.111 80 HG21 VAL 56 1HG2 VAL 56 -6.104 -0.932 -0.909 81 HG22 VAL 56 2HG2 VAL 56 -6.683 -2.441 -0.206 82 HG23 VAL 56 3HG2 VAL 56 -7.655 -1.601 -1.413 83 H LEU 57 H LEU 57 -2.203 -2.811 -1.851 84 HA LEU 57 HA LEU 57 -1.254 -3.908 -4.214 85 HB2 LEU 57 2HB LEU 57 0.011 -3.641 -2.043 86 HB3 LEU 57 1HB LEU 57 -0.757 -5.128 -1.493 87 HG LEU 57 HG LEU 57 0.171 -6.300 -3.497 88 HD11 LEU 57 1HD1 LEU 57 0.993 -3.531 -4.093 89 HD12 LEU 57 2HD1 LEU 57 0.740 -4.889 -5.188 90 HD13 LEU 57 3HD1 LEU 57 2.266 -4.729 -4.319 91 HD21 LEU 57 1HD2 LEU 57 1.562 -5.351 -1.175 92 HD22 LEU 57 2HD2 LEU 57 2.694 -5.410 -2.526 93 HD23 LEU 57 3HD2 LEU 57 1.805 -6.859 -2.056 94 H SER 58 H SER 58 -1.156 -6.116 -5.003 95 HA SER 58 HA SER 58 -3.674 -7.572 -4.469 96 HB2 SER 58 2HB SER 58 -3.221 -8.758 -6.522 97 HB3 SER 58 1HB SER 58 -2.894 -7.055 -6.832 98 HG SER 58 HG SER 58 -1.195 -9.215 -6.766 99 H VAL 59 H VAL 59 -3.509 -9.951 -4.069 100 HA VAL 59 HA VAL 59 -1.126 -10.496 -2.393 101 HB VAL 59 HB VAL 59 -3.566 -12.256 -2.711 102 HG11 VAL 59 1HG1 VAL 59 -2.194 -11.955 -0.117 103 HG12 VAL 59 2HG1 VAL 59 -1.190 -12.653 -1.389 104 HG13 VAL 59 3HG1 VAL 59 -2.717 -13.419 -0.950 105 HG21 VAL 59 1HG2 VAL 59 -4.308 -9.970 -2.135 106 HG22 VAL 59 2HG2 VAL 59 -3.153 -9.926 -0.803 107 HG23 VAL 59 3HG2 VAL 59 -4.507 -11.054 -0.757 108 H GLN 60 H GLN 60 0.529 -11.604 -3.276 109 HA GLN 60 HA GLN 60 -0.059 -13.752 -5.237 110 HB2 GLN 60 2HB GLN 60 1.965 -11.534 -5.665 111 HB3 GLN 60 1HB GLN 60 1.760 -12.940 -6.710 112 HG2 GLN 60 2HG GLN 60 -0.563 -12.272 -7.174 113 HG3 GLN 60 1HG GLN 60 -0.380 -10.876 -6.113 114 HE21 GLN 60 1HE2 GLN 60 -1.055 -10.209 -8.659 115 HE22 GLN 60 2HE2 GLN 60 0.279 -9.619 -9.527 116 H GLN 61 H GLN 61 1.709 -15.299 -5.426 117 HA GLN 61 HA GLN 61 3.069 -15.735 -2.894 118 HB2 GLN 61 2HB GLN 61 3.448 -17.181 -5.526 119 HB3 GLN 61 1HB GLN 61 3.912 -17.771 -3.933 120 HG2 GLN 61 2HG GLN 61 1.095 -17.210 -4.898 121 HG3 GLN 61 1HG GLN 61 1.800 -18.798 -4.589 122 HE21 GLN 61 1HE2 GLN 61 -0.124 -16.444 -3.185 123 HE22 GLN 61 2HE2 GLN 61 0.127 -16.835 -1.557 124 H ILE 62 H ILE 62 5.492 -16.247 -2.925 125 HA ILE 62 HA ILE 62 7.055 -14.009 -3.387 126 HB ILE 62 HB ILE 62 7.983 -16.884 -3.690 127 HG12 ILE 62 2HG1 ILE 62 7.868 -15.149 -1.204 128 HG13 ILE 62 1HG1 ILE 62 6.679 -16.390 -1.594 129 HG21 ILE 62 1HG2 ILE 62 10.081 -15.743 -2.622 130 HG22 ILE 62 2HG2 ILE 62 9.369 -14.250 -3.232 131 HG23 ILE 62 3HG2 ILE 62 9.797 -15.547 -4.351 132 HD11 ILE 62 1HD1 ILE 62 9.032 -16.799 -0.180 133 HD12 ILE 62 2HD1 ILE 62 9.425 -17.374 -1.801 134 HD13 ILE 62 3HD1 ILE 62 8.051 -18.058 -0.931 135 H GLY 63 H GLY 63 8.978 -13.968 -5.065 136 HA2 GLY 63 2HA GLY 63 9.721 -14.320 -7.337 137 HA3 GLY 63 1HA GLY 63 8.112 -14.919 -7.740 138 H GLU 64 H GLU 64 7.615 -12.260 -5.871 139 HA GLU 64 HA GLU 64 7.505 -10.453 -8.247 140 HB2 GLU 64 2HB GLU 64 5.272 -11.176 -7.304 141 HB3 GLU 64 1HB GLU 64 5.709 -10.340 -5.811 142 HG2 GLU 64 2HG GLU 64 4.389 -8.824 -7.173 143 HG3 GLU 64 1HG GLU 64 6.057 -8.248 -7.158 144 H VAL 65 H VAL 65 8.309 -8.341 -7.952 145 HA VAL 65 HA VAL 65 9.655 -7.859 -5.326 146 HB VAL 65 HB VAL 65 10.475 -6.791 -8.038 147 HG11 VAL 65 1HG1 VAL 65 12.234 -5.776 -6.966 148 HG12 VAL 65 2HG1 VAL 65 12.329 -7.020 -5.721 149 HG13 VAL 65 3HG1 VAL 65 11.095 -5.766 -5.621 150 HG21 VAL 65 1HG2 VAL 65 11.422 -8.795 -8.432 151 HG22 VAL 65 2HG2 VAL 65 10.768 -9.412 -6.915 152 HG23 VAL 65 3HG2 VAL 65 12.353 -8.637 -6.943 153 H PHE 66 H PHE 66 9.235 -5.953 -4.291 154 HA PHE 66 HA PHE 66 7.573 -3.928 -5.729 155 HB2 PHE 66 2HB PHE 66 7.438 -4.672 -2.792 156 HB3 PHE 66 1HB PHE 66 6.427 -3.481 -3.610 157 HD1 PHE 66 1HD PHE 66 4.791 -4.212 -5.355 158 HD2 PHE 66 2HD PHE 66 7.014 -7.010 -2.979 159 HE1 PHE 66 1HE PHE 66 3.213 -6.012 -6.001 160 HE2 PHE 66 2HE PHE 66 5.442 -8.812 -3.627 161 HZ PHE 66 HZ PHE 66 3.535 -8.314 -5.132 162 H GLU 67 H GLU 67 7.901 -1.690 -4.915 163 HA GLU 67 HA GLU 67 10.673 -1.344 -3.835 164 HB2 GLU 67 2HB GLU 67 9.009 0.677 -5.362 165 HB3 GLU 67 1HB GLU 67 10.719 0.804 -4.947 166 HG2 GLU 67 2HG GLU 67 11.144 -1.246 -6.321 167 HG3 GLU 67 1HG GLU 67 9.454 -1.195 -6.818 168 H CYS 68 H CYS 68 10.999 0.302 -2.245 169 HA CYS 68 HA CYS 68 8.515 1.011 -0.734 170 HB2 CYS 68 2HB CYS 68 10.263 -0.341 0.490 171 HB3 CYS 68 1HB CYS 68 11.385 1.000 0.262 172 H THR 69 H THR 69 8.095 3.215 -0.469 173 HA THR 69 HA THR 69 10.161 5.080 -1.542 174 HB THR 69 HB THR 69 8.505 6.289 -2.740 175 HG1 THR 69 1HG THR 69 6.248 5.365 -2.485 176 HG21 THR 69 1HG2 THR 69 7.341 3.608 -3.250 177 HG22 THR 69 2HG2 THR 69 9.096 3.710 -3.367 178 HG23 THR 69 3HG2 THR 69 8.084 4.743 -4.374 179 H PHE 70 H PHE 70 10.218 7.160 -0.621 180 HA PHE 70 HA PHE 70 8.460 7.710 1.691 181 HB2 PHE 70 2HB PHE 70 10.323 8.137 3.201 182 HB3 PHE 70 1HB PHE 70 10.429 6.478 2.611 183 HD1 PHE 70 1HD PHE 70 11.969 9.787 2.618 184 HD2 PHE 70 2HD PHE 70 12.079 5.877 0.842 185 HE1 PHE 70 1HE PHE 70 14.237 10.255 1.731 186 HE2 PHE 70 2HE PHE 70 14.348 6.345 -0.046 187 HZ PHE 70 HZ PHE 70 15.427 8.533 0.400 188 H THR 71 H THR 71 9.033 9.994 2.550 189 HA THR 71 HA THR 71 9.994 11.711 0.311 190 HB THR 71 HB THR 71 7.613 12.308 2.087 191 HG1 THR 71 1HG THR 71 6.408 11.475 0.565 192 HG21 THR 71 1HG2 THR 71 7.920 14.400 1.333 193 HG22 THR 71 2HG2 THR 71 7.594 13.807 -0.295 194 HG23 THR 71 3HG2 THR 71 9.253 13.879 0.303 195 H CYS 72 H CYS 72 11.064 13.612 0.959 196 HA CYS 72 HA CYS 72 11.560 13.887 3.891 197 HB2 CYS 72 2HB CYS 72 13.671 13.200 3.416 198 HB3 CYS 72 1HB CYS 72 13.470 13.464 1.689 199 H GLY 73 H GLY 73 12.449 16.155 4.368 200 HA2 GLY 73 2HA GLY 73 10.680 18.082 3.042 201 HA3 GLY 73 1HA GLY 73 11.693 18.407 4.447 202 H ALA 74 H ALA 74 11.270 19.592 1.598 203 HA ALA 74 HA ALA 74 12.765 21.193 0.582 204 HB1 ALA 74 1HB ALA 74 15.113 20.996 0.644 205 HB2 ALA 74 2HB ALA 74 15.052 19.276 1.011 206 HB3 ALA 74 3HB ALA 74 14.599 20.462 2.241 207 H ASP 75 H ASP 75 11.149 19.135 -0.483 208 HA ASP 75 HA ASP 75 10.792 17.965 -2.481 209 HB2 ASP 75 2HB ASP 75 13.076 19.761 -3.358 210 HB3 ASP 75 1HB ASP 75 12.078 18.803 -4.451 211 H CYS 76 H CYS 76 12.263 16.548 -0.625 212 HA CYS 76 HA CYS 76 14.341 15.195 -2.308 213 HB2 CYS 76 2HB CYS 76 14.935 14.383 0.209 214 HB3 CYS 76 1HB CYS 76 15.639 15.826 -0.526 215 H ARG 77 H ARG 77 13.576 13.269 -3.020 216 HA ARG 77 HA ARG 77 11.976 11.615 -1.121 217 HB2 ARG 77 2HB ARG 77 10.807 10.830 -3.368 218 HB3 ARG 77 1HB ARG 77 10.239 12.273 -2.526 219 HG2 ARG 77 2HG ARG 77 12.454 12.680 -4.465 220 HG3 ARG 77 1HG ARG 77 10.884 12.267 -5.154 221 HD2 ARG 77 2HD ARG 77 11.234 14.457 -3.094 222 HD3 ARG 77 1HD ARG 77 11.311 14.758 -4.831 223 HE ARG 77 HE ARG 77 8.912 13.333 -4.311 224 HH11 ARG 77 1HH1 ARG 77 6.965 14.472 -4.170 225 HH12 ARG 77 2HH1 ARG 77 6.995 16.171 -3.827 226 HH21 ARG 77 1HH2 ARG 77 10.453 16.343 -3.638 227 HH22 ARG 77 2HH2 ARG 77 8.969 17.229 -3.526 228 H GLY 78 H GLY 78 12.324 9.315 -1.399 229 HA2 GLY 78 2HA GLY 78 14.321 8.530 -3.448 230 HA3 GLY 78 1HA GLY 78 14.746 8.250 -1.759 231 H THR 79 H THR 79 14.429 6.187 -3.748 232 HA THR 79 HA THR 79 12.160 4.705 -2.515 233 HB THR 79 HB THR 79 11.754 3.618 -4.712 234 HG1 THR 79 1HG THR 79 12.736 4.620 -6.527 235 HG21 THR 79 1HG2 THR 79 11.577 6.636 -4.597 236 HG22 THR 79 2HG2 THR 79 10.339 5.474 -4.122 237 HG23 THR 79 3HG2 THR 79 10.772 5.657 -5.822 238 H SER 80 H SER 80 12.439 2.359 -2.550 239 HA SER 80 HA SER 80 15.262 1.475 -2.927 240 HB2 SER 80 2HB SER 80 13.503 0.787 -0.556 241 HB3 SER 80 1HB SER 80 15.132 0.185 -0.840 242 HG SER 80 HG SER 80 15.661 2.549 -0.944 243 H GLN 81 H GLN 81 15.421 -0.888 -3.258 244 HA GLN 81 HA GLN 81 12.883 -2.010 -4.365 245 HB2 GLN 81 2HB GLN 81 14.718 -1.591 -6.020 246 HB3 GLN 81 1HB GLN 81 15.724 -2.722 -5.122 247 HG2 GLN 81 2HG GLN 81 14.736 -3.964 -6.919 248 HG3 GLN 81 1HG GLN 81 13.895 -4.448 -5.445 249 HE21 GLN 81 1HE2 GLN 81 11.655 -4.105 -5.364 250 HE22 GLN 81 2HE2 GLN 81 10.784 -3.251 -6.539 251 H TYR 82 H TYR 82 12.098 -3.776 -3.328 252 HA TYR 82 HA TYR 82 14.004 -5.506 -1.836 253 HB2 TYR 82 2HB TYR 82 11.424 -4.307 -0.804 254 HB3 TYR 82 1HB TYR 82 12.224 -5.667 -0.021 255 HD1 TYR 82 1HD TYR 82 11.893 -2.210 0.070 256 HD2 TYR 82 2HD TYR 82 14.917 -5.258 0.234 257 HE1 TYR 82 1HE TYR 82 13.417 -0.638 1.234 258 HE2 TYR 82 2HE TYR 82 16.439 -3.685 1.397 259 HH TYR 82 HH TYR 82 16.751 -1.572 2.044 260 HA PRO 83 HA PRO 83 12.049 -9.002 -3.748 261 HB2 PRO 83 2HB PRO 83 11.504 -10.066 -1.019 262 HB3 PRO 83 1HB PRO 83 12.322 -10.836 -2.390 263 HG2 PRO 83 2HG PRO 83 13.647 -9.861 -0.267 264 HG3 PRO 83 1HG PRO 83 14.327 -9.885 -1.899 265 HD2 PRO 83 2HD PRO 83 13.384 -7.581 -0.307 266 HD3 PRO 83 1HD PRO 83 14.515 -7.629 -1.675 267 H CYS 84 H CYS 84 10.011 -10.617 -2.419 268 HA CYS 84 HA CYS 84 7.660 -9.167 -3.243 269 HB2 CYS 84 2HB CYS 84 6.681 -11.202 -3.156 270 HB3 CYS 84 1HB CYS 84 8.292 -11.825 -2.790 271 H VAL 85 H VAL 85 5.936 -8.390 -1.945 272 HA VAL 85 HA VAL 85 6.575 -8.020 0.954 273 HB VAL 85 HB VAL 85 6.916 -5.934 -0.459 274 HG11 VAL 85 1HG1 VAL 85 5.239 -5.081 -1.738 275 HG12 VAL 85 2HG1 VAL 85 4.000 -5.484 -0.550 276 HG13 VAL 85 3HG1 VAL 85 4.584 -6.717 -1.668 277 HG21 VAL 85 1HG2 VAL 85 6.594 -5.521 1.834 278 HG22 VAL 85 2HG2 VAL 85 4.934 -6.115 1.802 279 HG23 VAL 85 3HG2 VAL 85 5.326 -4.553 1.081 280 H GLN 86 H GLN 86 4.730 -8.071 2.349 281 HA GLN 86 HA GLN 86 2.633 -9.810 1.631 282 HB2 GLN 86 2HB GLN 86 2.473 -7.639 3.736 283 HB3 GLN 86 1HB GLN 86 1.560 -9.148 3.687 284 HG2 GLN 86 2HG GLN 86 4.568 -8.893 3.987 285 HG3 GLN 86 1HG GLN 86 3.432 -9.371 5.250 286 HE21 GLN 86 1HE2 GLN 86 5.669 -10.771 3.376 287 HE22 GLN 86 2HE2 GLN 86 4.931 -12.264 3.049 288 H VAL 87 H VAL 87 0.268 -8.435 2.473 289 HA VAL 87 HA VAL 87 -0.158 -6.601 0.142 290 HB VAL 87 HB VAL 87 -1.287 -8.792 -0.120 291 HG11 VAL 87 1HG1 VAL 87 -1.558 -8.994 2.452 292 HG12 VAL 87 2HG1 VAL 87 -2.873 -9.588 1.440 293 HG13 VAL 87 3HG1 VAL 87 -3.011 -8.018 2.231 294 HG21 VAL 87 1HG2 VAL 87 -2.403 -6.216 -0.352 295 HG22 VAL 87 2HG2 VAL 87 -3.668 -7.209 0.366 296 HG23 VAL 87 3HG2 VAL 87 -2.946 -7.678 -1.173 297 H TYR 88 H TYR 88 -1.461 -4.781 0.483 298 HA TYR 88 HA TYR 88 -2.992 -4.288 2.826 299 HB2 TYR 88 2HB TYR 88 -0.766 -4.252 3.896 300 HB3 TYR 88 1HB TYR 88 -0.271 -2.986 2.804 301 HD1 TYR 88 1HD TYR 88 -3.728 -2.455 3.645 302 HD2 TYR 88 2HD TYR 88 0.272 -2.029 5.191 303 HE1 TYR 88 1HE TYR 88 -4.523 -0.777 5.253 304 HE2 TYR 88 2HE TYR 88 -0.548 -0.341 6.800 305 HH TYR 88 HH TYR 88 -3.744 0.992 6.606 306 H VAL 89 H VAL 89 -1.578 -1.389 2.580 307 HA VAL 89 HA VAL 89 -2.993 -0.646 0.065 308 HB VAL 89 HB VAL 89 -4.398 -0.110 2.054 309 HG11 VAL 89 1HG1 VAL 89 -2.243 0.328 3.451 310 HG12 VAL 89 2HG1 VAL 89 -3.655 1.343 3.747 311 HG13 VAL 89 3HG1 VAL 89 -2.322 1.952 2.767 312 HG21 VAL 89 1HG2 VAL 89 -3.720 2.606 1.313 313 HG22 VAL 89 2HG2 VAL 89 -5.136 1.657 0.861 314 HG23 VAL 89 3HG2 VAL 89 -3.663 1.557 -0.104 315 H ASN 90 H ASN 90 -1.835 0.674 -1.235 316 HA ASN 90 HA ASN 90 0.812 1.566 -0.279 317 HB2 ASN 90 2HB ASN 90 -0.467 1.654 -3.028 318 HB3 ASN 90 1HB ASN 90 1.205 2.066 -2.666 319 HD21 ASN 90 1HD2 ASN 90 0.445 -0.397 -0.564 320 HD22 ASN 90 2HD2 ASN 90 0.968 -1.723 -1.484 321 H ASN 91 H ASN 91 0.871 3.586 0.643 322 HA ASN 91 HA ASN 91 -1.199 5.549 -0.138 323 HB2 ASN 91 2HB ASN 91 0.962 5.679 1.988 324 HB3 ASN 91 1HB ASN 91 -0.296 6.891 1.740 325 HD21 ASN 91 1HD2 ASN 91 -2.546 5.247 1.269 326 HD22 ASN 91 2HD2 ASN 91 -2.871 4.333 2.661 327 H SER 92 H SER 92 -0.388 5.978 -2.273 328 HA SER 92 HA SER 92 2.328 7.078 -2.518 329 HB2 SER 92 2HB SER 92 0.729 7.474 -4.865 330 HB3 SER 92 1HB SER 92 2.139 6.442 -4.656 331 HG SER 92 HG SER 92 0.714 4.876 -3.731 332 H GLU 93 H GLU 93 -0.104 8.374 -1.065 333 HA GLU 93 HA GLU 93 -0.541 10.833 -2.566 334 HB2 GLU 93 2HB GLU 93 -1.790 11.572 -0.650 335 HB3 GLU 93 1HB GLU 93 -2.131 9.850 -0.818 336 HG2 GLU 93 2HG GLU 93 -0.296 9.399 0.850 337 HG3 GLU 93 1HG GLU 93 -0.178 11.141 1.108 338 H SER 94 H SER 94 1.941 9.528 -0.713 339 HA SER 94 HA SER 94 3.405 12.088 -0.732 340 HB2 SER 94 2HB SER 94 2.561 10.626 1.746 341 HB3 SER 94 1HB SER 94 4.142 11.402 1.723 342 HG SER 94 HG SER 94 3.210 13.322 1.606 343 H ASN 95 H ASN 95 3.551 9.487 -2.119 344 HA ASN 95 HA ASN 95 5.177 7.943 -2.782 345 HB2 ASN 95 2HB ASN 95 7.052 9.805 -1.292 346 HB3 ASN 95 1HB ASN 95 7.514 8.606 -2.497 347 HD21 ASN 95 1HD2 ASN 95 7.514 11.750 -2.420 348 HD22 ASN 95 2HD2 ASN 95 6.816 12.160 -3.911 349 H SER 96 H SER 96 3.756 7.140 -0.555 350 HA SER 96 HA SER 96 5.869 5.713 1.008 351 HB2 SER 96 2HB SER 96 4.662 7.646 2.259 352 HB3 SER 96 1HB SER 96 3.262 6.574 2.256 353 HG SER 96 HG SER 96 5.852 5.973 3.263 354 H ARG 97 H ARG 97 5.324 3.549 1.541 355 HA ARG 97 HA ARG 97 2.708 2.576 0.497 356 HB2 ARG 97 2HB ARG 97 4.401 1.998 -1.163 357 HB3 ARG 97 1HB ARG 97 5.419 1.283 0.087 358 HG2 ARG 97 2HG ARG 97 4.169 -0.620 0.205 359 HG3 ARG 97 1HG ARG 97 2.650 0.246 -0.005 360 HD2 ARG 97 2HD ARG 97 2.981 -1.141 -1.955 361 HD3 ARG 97 1HD ARG 97 3.239 0.532 -2.442 362 HE ARG 97 HE ARG 97 5.728 -0.715 -1.665 363 HH11 ARG 97 1HH1 ARG 97 7.152 -1.265 -3.345 364 HH12 ARG 97 2HH1 ARG 97 6.565 -1.330 -4.973 365 HH21 ARG 97 1HH2 ARG 97 3.318 -0.467 -4.118 366 HH22 ARG 97 2HH2 ARG 97 4.396 -0.880 -5.410 367 H ALA 98 H ALA 98 1.609 1.577 2.085 368 HA ALA 98 HA ALA 98 3.082 0.647 4.482 369 HB1 ALA 98 1HB ALA 98 0.905 2.125 4.445 370 HB2 ALA 98 2HB ALA 98 1.075 0.853 5.655 371 HB3 ALA 98 3HB ALA 98 0.092 0.576 4.217 372 H LEU 99 H LEU 99 3.336 -1.501 4.932 373 HA LEU 99 HA LEU 99 1.898 -3.460 3.184 374 HB2 LEU 99 2HB LEU 99 3.849 -4.922 3.417 375 HB3 LEU 99 1HB LEU 99 4.332 -3.359 2.758 376 HG LEU 99 HG LEU 99 4.543 -2.901 5.450 377 HD11 LEU 99 1HD1 LEU 99 4.092 -5.472 5.619 378 HD12 LEU 99 2HD1 LEU 99 5.401 -4.773 6.572 379 HD13 LEU 99 3HD1 LEU 99 5.760 -5.627 5.071 380 HD21 LEU 99 1HD2 LEU 99 6.209 -2.306 3.758 381 HD22 LEU 99 2HD2 LEU 99 6.633 -4.004 3.545 382 HD23 LEU 99 3HD2 LEU 99 6.991 -3.191 5.068 383 H LEU 100 H LEU 100 0.730 -5.019 4.194 384 HA LEU 100 HA LEU 100 1.085 -5.356 7.144 385 HB2 LEU 100 2HB LEU 100 -0.980 -4.045 6.554 386 HB3 LEU 100 1HB LEU 100 -1.548 -5.447 5.647 387 HG LEU 100 HG LEU 100 -1.368 -6.819 7.721 388 HD11 LEU 100 1HD1 LEU 100 -0.368 -4.200 8.753 389 HD12 LEU 100 2HD1 LEU 100 0.139 -5.837 9.168 390 HD13 LEU 100 3HD1 LEU 100 -1.357 -5.183 9.832 391 HD21 LEU 100 1HD2 LEU 100 -3.170 -4.477 7.379 392 HD22 LEU 100 2HD2 LEU 100 -3.207 -5.271 8.953 393 HD23 LEU 100 3HD2 LEU 100 -3.563 -6.192 7.492 394 H HIS 101 H HIS 101 0.660 -7.502 7.925 395 HA HIS 101 HA HIS 101 1.054 -9.573 5.849 396 HB2 HIS 101 2HB HIS 101 1.001 -9.843 8.870 397 HB3 HIS 101 1HB HIS 101 1.554 -11.061 7.720 398 HD1 HIS 101 1HD HIS 101 2.478 -7.654 6.748 399 HD2 HIS 101 2HD HIS 101 4.168 -10.674 9.077 400 HE1 HIS 101 1HE HIS 101 4.920 -7.048 7.047 401 HE2 HIS 101 2HE HIS 101 5.958 -8.878 8.465 402 H SER 102 H SER 102 -0.699 -10.623 5.043 403 HA SER 102 HA SER 102 -3.354 -10.218 5.951 404 HB2 SER 102 2HB SER 102 -2.686 -11.130 3.698 405 HB3 SER 102 1HB SER 102 -2.320 -12.662 4.485 406 HG SER 102 HG SER 102 -4.425 -12.947 4.932 407 H ASP 103 H ASP 103 -1.011 -12.769 6.711 408 HA ASP 103 HA ASP 103 -2.184 -13.240 9.290 409 HB2 ASP 103 2HB ASP 103 -3.850 -14.358 7.693 410 HB3 ASP 103 1HB ASP 103 -2.569 -15.519 7.340 411 H GLU 104 H GLU 104 -1.042 -15.090 10.401 412 HA GLU 104 HA GLU 104 1.760 -14.992 9.892 413 HB2 GLU 104 2HB GLU 104 0.118 -16.995 11.473 414 HB3 GLU 104 1HB GLU 104 1.874 -16.877 11.528 415 HG2 GLU 104 2HG GLU 104 1.676 -14.517 12.279 416 HG3 GLU 104 1HG GLU 104 -0.079 -14.688 12.286 417 H HIS 105 H HIS 105 -0.751 -17.273 8.871 418 HA HIS 105 HA HIS 105 0.896 -19.363 7.922 419 HB2 HIS 105 2HB HIS 105 -1.679 -18.289 6.729 420 HB3 HIS 105 1HB HIS 105 -0.948 -19.839 6.315 421 HD1 HIS 105 1HD HIS 105 -0.369 -21.303 8.695 422 HD2 HIS 105 2HD HIS 105 -3.566 -18.623 8.708 423 HE1 HIS 105 1HE HIS 105 -1.870 -21.982 10.622 424 HE2 HIS 105 2HE HIS 105 -3.817 -20.357 10.638 425 H GLN 106 H GLN 106 -0.006 -16.294 6.395 426 HA GLN 106 HA GLN 106 1.193 -16.784 3.854 427 HB2 GLN 106 2HB GLN 106 -0.325 -14.849 4.421 428 HB3 GLN 106 1HB GLN 106 1.027 -14.117 5.287 429 HG2 GLN 106 2HG GLN 106 2.368 -14.116 3.230 430 HG3 GLN 106 1HG GLN 106 1.047 -14.888 2.354 431 HE21 GLN 106 1HE2 GLN 106 1.821 -12.477 1.313 432 HE22 GLN 106 2HE2 GLN 106 0.711 -11.254 1.704 433 H LEU 107 H LEU 107 2.496 -15.499 6.885 434 HA LEU 107 HA LEU 107 5.088 -14.803 5.941 435 HB2 LEU 107 2HB LEU 107 4.186 -14.222 8.204 436 HB3 LEU 107 1HB LEU 107 4.349 -15.914 8.668 437 HG LEU 107 HG LEU 107 6.810 -15.728 8.043 438 HD11 LEU 107 1HD1 LEU 107 5.940 -12.856 7.774 439 HD12 LEU 107 2HD1 LEU 107 6.982 -13.801 6.711 440 HD13 LEU 107 3HD1 LEU 107 7.586 -13.245 8.272 441 HD21 LEU 107 1HD2 LEU 107 6.895 -13.875 10.159 442 HD22 LEU 107 2HD2 LEU 107 6.895 -15.633 10.295 443 HD23 LEU 107 3HD2 LEU 107 5.373 -14.744 10.363 444 H LEU 108 H LEU 108 3.801 -17.870 7.213 445 HA LEU 108 HA LEU 108 6.245 -19.347 7.035 446 HB2 LEU 108 2HB LEU 108 4.145 -20.096 8.234 447 HB3 LEU 108 1HB LEU 108 3.429 -20.408 6.655 448 HG LEU 108 HG LEU 108 5.378 -21.924 6.150 449 HD11 LEU 108 1HD1 LEU 108 6.202 -22.626 8.724 450 HD12 LEU 108 2HD1 LEU 108 6.210 -20.864 8.740 451 HD13 LEU 108 3HD1 LEU 108 7.154 -21.740 7.534 452 HD21 LEU 108 1HD2 LEU 108 3.860 -23.476 6.755 453 HD22 LEU 108 2HD2 LEU 108 3.115 -22.343 7.882 454 HD23 LEU 108 3HD2 LEU 108 4.450 -23.367 8.413 455 H THR 109 H THR 109 3.731 -18.519 4.738 456 HA THR 109 HA THR 109 4.658 -20.243 2.615 457 HB THR 109 HB THR 109 2.926 -17.754 2.571 458 HG1 THR 109 1HG THR 109 2.017 -19.396 3.786 459 HG21 THR 109 1HG2 THR 109 3.065 -17.925 0.350 460 HG22 THR 109 2HG2 THR 109 2.270 -19.495 0.476 461 HG23 THR 109 3HG2 THR 109 4.031 -19.393 0.474 462 H ASN 110 H ASN 110 5.148 -16.826 3.460 463 HA ASN 110 HA ASN 110 7.438 -16.775 1.542 464 HB2 ASN 110 2HB ASN 110 6.716 -14.224 1.393 465 HB3 ASN 110 1HB ASN 110 5.970 -15.435 0.351 466 HD21 ASN 110 1HD2 ASN 110 3.823 -16.313 1.080 467 HD22 ASN 110 2HD2 ASN 110 2.828 -15.354 2.065 468 HA PRO 111 HA PRO 111 8.429 -15.397 5.943 469 HB2 PRO 111 2HB PRO 111 10.671 -17.007 6.147 470 HB3 PRO 111 1HB PRO 111 9.063 -17.436 6.748 471 HG2 PRO 111 2HG PRO 111 10.464 -18.304 4.289 472 HG3 PRO 111 1HG PRO 111 9.315 -19.181 5.311 473 HD2 PRO 111 2HD PRO 111 8.646 -18.092 2.889 474 HD3 PRO 111 1HD PRO 111 7.480 -18.332 4.204 475 H LYS 112 H LYS 112 10.322 -15.847 3.022 476 HA LYS 112 HA LYS 112 12.621 -14.326 3.736 477 HB2 LYS 112 2HB LYS 112 11.272 -14.664 1.041 478 HB3 LYS 112 1HB LYS 112 12.884 -13.986 1.277 479 HG2 LYS 112 2HG LYS 112 13.569 -16.110 2.397 480 HG3 LYS 112 1HG LYS 112 11.984 -16.784 2.018 481 HD2 LYS 112 2HD LYS 112 12.425 -16.351 -0.404 482 HD3 LYS 112 1HD LYS 112 14.051 -15.816 0.022 483 HE2 LYS 112 2HE LYS 112 14.249 -18.115 1.224 484 HE3 LYS 112 1HE LYS 112 12.862 -18.575 0.238 485 HZ1 LYS 112 1HZ LYS 112 15.042 -19.090 -0.784 486 HZ2 LYS 112 2HZ LYS 112 15.368 -17.423 -0.856 487 HZ3 LYS 112 3HZ LYS 112 14.070 -18.076 -1.737 488 H CYS 113 H CYS 113 9.402 -13.391 2.701 489 HA CYS 113 HA CYS 113 10.167 -10.562 2.419 490 HB2 CYS 113 2HB CYS 113 7.442 -11.887 2.323 491 HB3 CYS 113 1HB CYS 113 7.802 -10.227 1.856 492 H SER 114 H SER 114 10.719 -9.796 4.457 493 HA SER 114 HA SER 114 8.933 -8.703 6.202 494 HB2 SER 114 2HB SER 114 9.079 -10.621 8.075 495 HB3 SER 114 1HB SER 114 7.756 -10.554 6.913 496 HG SER 114 HG SER 114 10.177 -12.001 6.563 497 H TYR 115 H TYR 115 11.658 -10.990 6.479 498 HA TYR 115 HA TYR 115 12.911 -9.625 8.672 499 HB2 TYR 115 2HB TYR 115 14.148 -11.414 6.558 500 HB3 TYR 115 1HB TYR 115 14.895 -10.973 8.097 501 HD1 TYR 115 1HD TYR 115 13.798 -11.659 10.254 502 HD2 TYR 115 2HD TYR 115 12.479 -13.116 6.436 503 HE1 TYR 115 1HE TYR 115 12.563 -13.490 11.381 504 HE2 TYR 115 2HE TYR 115 11.246 -14.949 7.561 505 HH TYR 115 HH TYR 115 11.735 -16.106 10.260 506 H ILE 116 H ILE 116 13.173 -9.281 5.165 507 HA ILE 116 HA ILE 116 15.446 -7.530 5.188 508 HB ILE 116 HB ILE 116 13.485 -8.497 3.257 509 HG12 ILE 116 2HG1 ILE 116 15.407 -8.373 1.766 510 HG13 ILE 116 1HG1 ILE 116 16.258 -7.324 2.900 511 HG21 ILE 116 1HG2 ILE 116 13.731 -6.551 1.694 512 HG22 ILE 116 2HG2 ILE 116 14.394 -5.611 3.026 513 HG23 ILE 116 3HG2 ILE 116 12.729 -6.196 3.096 514 HD11 ILE 116 1HD1 ILE 116 16.909 -9.070 4.184 515 HD12 ILE 116 2HD1 ILE 116 16.444 -10.088 2.821 516 HD13 ILE 116 3HD1 ILE 116 15.306 -9.804 4.138 517 HA PRO 117 HA PRO 117 14.086 -3.730 7.034 518 HB2 PRO 117 2HB PRO 117 14.676 -2.607 4.314 519 HB3 PRO 117 1HB PRO 117 15.114 -1.970 5.910 520 HG2 PRO 117 2HG PRO 117 16.834 -3.354 4.341 521 HG3 PRO 117 1HG PRO 117 16.919 -3.337 6.108 522 HD2 PRO 117 2HD PRO 117 16.243 -5.564 4.354 523 HD3 PRO 117 1HD PRO 117 16.517 -5.579 6.109 524 HA PRO 118 HA PRO 118 10.015 -3.961 4.904 525 HB2 PRO 118 2HB PRO 118 8.481 -4.279 7.101 526 HB3 PRO 118 1HB PRO 118 9.405 -5.627 6.405 527 HG2 PRO 118 2HG PRO 118 9.971 -3.992 8.815 528 HG3 PRO 118 1HG PRO 118 10.286 -5.708 8.508 529 HD2 PRO 118 2HD PRO 118 12.176 -3.632 8.315 530 HD3 PRO 118 1HD PRO 118 12.364 -5.272 7.664 531 H CYS 119 H CYS 119 8.478 -2.299 4.611 532 HA CYS 119 HA CYS 119 8.975 0.180 6.182 533 HB2 CYS 119 2HB CYS 119 7.417 -0.119 3.599 534 HB3 CYS 119 1HB CYS 119 7.983 1.381 4.333 535 H LYS 120 H LYS 120 7.522 0.557 7.793 536 HA LYS 120 HA LYS 120 4.672 -0.204 7.312 537 HB2 LYS 120 2HB LYS 120 6.249 -0.610 9.873 538 HB3 LYS 120 1HB LYS 120 4.513 -0.870 9.704 539 HG2 LYS 120 2HG LYS 120 4.981 -2.546 7.909 540 HG3 LYS 120 1HG LYS 120 6.706 -2.343 8.216 541 HD2 LYS 120 2HD LYS 120 6.322 -3.007 10.593 542 HD3 LYS 120 1HD LYS 120 4.630 -3.317 10.200 543 HE2 LYS 120 2HE LYS 120 6.676 -4.613 8.465 544 HE3 LYS 120 1HE LYS 120 6.493 -5.250 10.100 545 HZ1 LYS 120 1HZ LYS 120 4.403 -4.997 8.014 546 HZ2 LYS 120 2HZ LYS 120 4.053 -5.342 9.640 547 HZ3 LYS 120 3HZ LYS 120 4.992 -6.421 8.723 548 H ARG 121 H ARG 121 3.200 1.355 7.967 549 HA ARG 121 HA ARG 121 4.120 4.014 8.470 550 HB2 ARG 121 2HB ARG 121 1.398 2.749 8.902 551 HB3 ARG 121 1HB ARG 121 1.718 4.480 8.969 552 HG2 ARG 121 2HG ARG 121 2.600 4.366 6.632 553 HG3 ARG 121 1HG ARG 121 2.119 2.669 6.576 554 HD2 ARG 121 2HD ARG 121 0.276 5.036 7.022 555 HD3 ARG 121 1HD ARG 121 0.370 4.048 5.564 556 HE ARG 121 HE ARG 121 -0.204 2.168 7.446 557 HH11 ARG 121 1HH1 ARG 121 -2.276 1.672 8.205 558 HH12 ARG 121 2HH1 ARG 121 -3.511 2.886 8.164 559 HH21 ARG 121 1HH2 ARG 121 -1.456 5.310 6.780 560 HH22 ARG 121 2HH2 ARG 121 -3.046 4.945 7.357 561 H GLU 122 H GLU 122 3.047 1.404 10.589 562 HA GLU 122 HA GLU 122 3.900 3.053 12.922 563 HB2 GLU 122 2HB GLU 122 1.648 1.021 12.835 564 HB3 GLU 122 1HB GLU 122 2.156 1.942 14.253 565 HG2 GLU 122 2HG GLU 122 1.626 4.049 13.042 566 HG3 GLU 122 1HG GLU 122 1.046 3.092 11.678 567 H ASN 123 H ASN 123 4.973 1.855 14.590 568 HA ASN 123 HA ASN 123 6.697 -0.215 13.715 569 HB2 ASN 123 2HB ASN 123 5.770 0.258 16.558 570 HB3 ASN 123 1HB ASN 123 7.283 -0.493 16.048 571 HD21 ASN 123 1HD2 ASN 123 5.579 2.577 16.370 572 HD22 ASN 123 2HD2 ASN 123 6.920 3.568 16.047 573 H GLN 124 H GLN 124 3.620 -0.377 15.484 574 HA GLN 124 HA GLN 124 3.329 -3.180 14.559 575 HB2 GLN 124 2HB GLN 124 3.045 -2.296 17.446 576 HB3 GLN 124 1HB GLN 124 2.584 -3.884 16.831 577 HG2 GLN 124 2HG GLN 124 4.904 -4.297 16.119 578 HG3 GLN 124 1HG GLN 124 5.374 -2.701 16.706 579 HE21 GLN 124 1HE2 GLN 124 6.590 -5.034 17.791 580 HE22 GLN 124 2HE2 GLN 124 6.081 -5.218 19.401 581 H LYS 125 H LYS 125 1.090 -3.898 14.573 582 HA LYS 125 HA LYS 125 -0.916 -1.763 15.068 583 HB2 LYS 125 2HB LYS 125 -0.310 -1.803 12.626 584 HB3 LYS 125 1HB LYS 125 -0.890 -3.469 12.564 585 HG2 LYS 125 2HG LYS 125 -3.121 -2.779 13.226 586 HG3 LYS 125 1HG LYS 125 -2.571 -1.128 13.504 587 HD2 LYS 125 2HD LYS 125 -3.652 -1.161 11.351 588 HD3 LYS 125 1HD LYS 125 -1.919 -1.025 11.065 589 HE2 LYS 125 2HE LYS 125 -1.886 -2.969 9.932 590 HE3 LYS 125 1HE LYS 125 -2.710 -3.812 11.242 591 HZ1 LYS 125 1HZ LYS 125 -4.420 -3.922 9.844 592 HZ2 LYS 125 2HZ LYS 125 -3.770 -2.756 8.794 593 HZ3 LYS 125 3HZ LYS 125 -4.661 -2.273 10.158 594 H ASN 126 H ASN 126 -2.934 -2.567 15.756 595 HA ASN 126 HA ASN 126 -2.977 -5.035 17.129 596 HB2 ASN 126 2HB ASN 126 -5.338 -3.494 16.005 597 HB3 ASN 126 1HB ASN 126 -5.417 -4.718 17.273 598 HD21 ASN 126 1HD2 ASN 126 -5.888 -1.634 17.255 599 HD22 ASN 126 2HD2 ASN 126 -4.968 -1.093 18.574 600 H LEU 127 H LEU 127 -3.657 -7.098 16.569 601 HA LEU 127 HA LEU 127 -3.467 -7.902 13.833 602 HB2 LEU 127 2HB LEU 127 -4.484 -9.276 16.322 603 HB3 LEU 127 1HB LEU 127 -4.524 -10.074 14.751 604 HG LEU 127 HG LEU 127 -2.454 -10.518 16.188 605 HD11 LEU 127 1HD1 LEU 127 -2.728 -10.007 13.375 606 HD12 LEU 127 2HD1 LEU 127 -1.646 -11.137 14.185 607 HD13 LEU 127 3HD1 LEU 127 -1.129 -9.477 13.895 608 HD21 LEU 127 1HD2 LEU 127 -1.696 -7.732 15.265 609 HD22 LEU 127 2HD2 LEU 127 -0.766 -8.806 16.307 610 HD23 LEU 127 3HD2 LEU 127 -2.264 -8.089 16.897 611 H GLU 128 H GLU 128 -6.220 -7.059 15.868 612 HA GLU 128 HA GLU 128 -8.300 -8.076 14.225 613 HB2 GLU 128 2HB GLU 128 -8.252 -5.581 15.951 614 HB3 GLU 128 1HB GLU 128 -9.711 -6.305 15.276 615 HG2 GLU 128 2HG GLU 128 -9.188 -8.421 16.471 616 HG3 GLU 128 1HG GLU 128 -7.779 -7.643 17.192 617 H SER 129 H SER 129 -6.353 -5.151 13.967 618 HA SER 129 HA SER 129 -7.900 -3.763 12.032 619 HB2 SER 129 2HB SER 129 -4.875 -3.861 12.228 620 HB3 SER 129 1HB SER 129 -5.831 -2.601 11.452 621 HG SER 129 HG SER 129 -5.353 -3.107 14.134 622 H VAL 130 H VAL 130 -5.615 -6.437 11.709 623 HA VAL 130 HA VAL 130 -5.365 -6.375 8.868 624 HB VAL 130 HB VAL 130 -5.231 -8.705 10.801 625 HG11 VAL 130 1HG1 VAL 130 -5.329 -9.974 8.927 626 HG12 VAL 130 2HG1 VAL 130 -3.728 -9.332 8.558 627 HG13 VAL 130 3HG1 VAL 130 -5.164 -8.569 7.872 628 HG21 VAL 130 1HG2 VAL 130 -2.896 -7.495 9.367 629 HG22 VAL 130 2HG2 VAL 130 -2.954 -8.276 10.948 630 HG23 VAL 130 3HG2 VAL 130 -3.564 -6.633 10.754 631 H MET 131 H MET 131 -7.752 -7.967 10.981 632 HA MET 131 HA MET 131 -9.118 -9.436 8.982 633 HB2 MET 131 2HB MET 131 -9.572 -9.555 11.459 634 HB3 MET 131 1HB MET 131 -10.412 -8.010 11.325 635 HG2 MET 131 2HG MET 131 -11.867 -9.077 9.539 636 HG3 MET 131 1HG MET 131 -11.137 -10.621 9.974 637 HE1 MET 131 1HE MET 131 -14.120 -8.056 12.244 638 HE2 MET 131 2HE MET 131 -13.376 -7.802 10.667 639 HE3 MET 131 3HE MET 131 -12.468 -7.435 12.131 640 H ASN 132 H ASN 132 -9.401 -6.044 9.958 641 HA ASN 132 HA ASN 132 -11.655 -5.366 8.370 642 HB2 ASN 132 2HB ASN 132 -9.265 -3.727 9.219 643 HB3 ASN 132 1HB ASN 132 -10.693 -3.047 8.457 644 HD21 ASN 132 1HD2 ASN 132 -9.953 -2.288 11.112 645 HD22 ASN 132 2HD2 ASN 132 -11.117 -2.892 12.190 646 H TRP 133 H TRP 133 -8.200 -5.499 7.573 647 HA TRP 133 HA TRP 133 -8.350 -4.328 4.996 648 HB2 TRP 133 2HB TRP 133 -6.155 -4.666 5.684 649 HB3 TRP 133 1HB TRP 133 -6.492 -6.279 6.307 650 HD1 TRP 133 HD TRP 133 -5.798 -4.411 3.036 651 HE1 TRP 133 1HE TRP 133 -5.144 -6.128 1.230 652 HE3 TRP 133 3HE TRP 133 -6.673 -8.739 5.586 653 HZ2 TRP 133 2HZ TRP 133 -5.008 -8.970 0.910 654 HZ3 TRP 133 3HZ TRP 133 -6.271 -10.936 4.512 655 HH2 TRP 133 HH TRP 133 -5.439 -11.058 2.180 656 H GLN 134 H GLN 134 -8.640 -7.772 5.922 657 HA GLN 134 HA GLN 134 -9.254 -8.620 3.223 658 HB2 GLN 134 2HB GLN 134 -8.384 -10.139 5.031 659 HB3 GLN 134 1HB GLN 134 -9.954 -10.020 5.818 660 HG2 GLN 134 2HG GLN 134 -10.672 -10.658 3.246 661 HG3 GLN 134 1HG GLN 134 -9.161 -11.550 3.429 662 HE21 GLN 134 1HE2 GLN 134 -12.177 -10.910 5.312 663 HE22 GLN 134 2HE2 GLN 134 -12.282 -12.480 5.952 664 H GLN 135 H GLN 135 -11.278 -8.059 6.121 665 HA GLN 135 HA GLN 135 -13.751 -8.694 4.841 666 HB2 GLN 135 2HB GLN 135 -13.400 -8.526 7.317 667 HB3 GLN 135 1HB GLN 135 -13.328 -6.773 7.145 668 HG2 GLN 135 2HG GLN 135 -15.590 -7.289 7.734 669 HG3 GLN 135 1HG GLN 135 -15.609 -6.920 6.010 670 HE21 GLN 135 1HE2 GLN 135 -16.718 -8.438 4.778 671 HE22 GLN 135 2HE2 GLN 135 -16.929 -10.070 5.195 672 H TYR 136 H TYR 136 -12.103 -5.571 5.293 673 HA TYR 136 HA TYR 136 -14.204 -4.039 4.058 674 HB2 TYR 136 2HB TYR 136 -12.562 -2.987 5.536 675 HB3 TYR 136 1HB TYR 136 -11.267 -3.391 4.406 676 HD1 TYR 136 1HD TYR 136 -14.032 -1.129 5.129 677 HD2 TYR 136 2HD TYR 136 -11.223 -2.387 2.134 678 HE1 TYR 136 1HE TYR 136 -14.509 0.924 3.819 679 HE2 TYR 136 2HE TYR 136 -11.698 -0.336 0.824 680 HH TYR 136 HH TYR 136 -12.611 2.121 1.524 681 H TRP 137 H TRP 137 -11.006 -5.057 2.790 682 HA TRP 137 HA TRP 137 -11.635 -4.065 0.155 683 HB2 TRP 137 2HB TRP 137 -9.405 -5.824 1.180 684 HB3 TRP 137 1HB TRP 137 -9.505 -5.237 -0.479 685 HD1 TRP 137 HD TRP 137 -8.039 -4.321 2.700 686 HE1 TRP 137 1HE TRP 137 -7.450 -1.815 2.802 687 HE3 TRP 137 3HE TRP 137 -10.652 -2.662 -1.331 688 HZ2 TRP 137 2HZ TRP 137 -8.026 0.586 1.351 689 HZ3 TRP 137 3HZ TRP 137 -10.628 -0.263 -1.960 690 HH2 TRP 137 HH TRP 137 -9.317 1.362 -0.622 691 H LYS 138 H LYS 138 -11.696 -7.331 1.592 692 HA LYS 138 HA LYS 138 -12.078 -8.722 -0.854 693 HB2 LYS 138 2HB LYS 138 -11.654 -9.836 1.348 694 HB3 LYS 138 1HB LYS 138 -13.314 -9.451 1.813 695 HG2 LYS 138 2HG LYS 138 -14.136 -10.714 -0.161 696 HG3 LYS 138 1HG LYS 138 -12.471 -11.146 -0.554 697 HD2 LYS 138 2HD LYS 138 -12.263 -12.216 1.696 698 HD3 LYS 138 1HD LYS 138 -13.971 -11.881 1.975 699 HE2 LYS 138 2HE LYS 138 -13.479 -13.194 -0.597 700 HE3 LYS 138 1HE LYS 138 -12.962 -14.167 0.781 701 HZ1 LYS 138 1HZ LYS 138 -15.115 -14.734 0.846 702 HZ2 LYS 138 2HZ LYS 138 -15.624 -13.371 -0.031 703 HZ3 LYS 138 3HZ LYS 138 -15.319 -13.248 1.636 704 H ASP 139 H ASP 139 -14.467 -7.264 1.337 705 HA ASP 139 HA ASP 139 -16.762 -8.076 -0.174 706 HB2 ASP 139 2HB ASP 139 -16.332 -5.727 1.685 707 HB3 ASP 139 1HB ASP 139 -17.904 -6.209 1.046 708 H GLU 140 H GLU 140 -14.814 -5.084 -0.242 709 HA GLU 140 HA GLU 140 -16.435 -3.960 -2.393 710 HB2 GLU 140 2HB GLU 140 -13.767 -3.102 -1.235 711 HB3 GLU 140 1HB GLU 140 -14.694 -2.174 -2.415 712 HG2 GLU 140 2HG GLU 140 -16.601 -2.097 -0.822 713 HG3 GLU 140 1HG GLU 140 -15.621 -2.958 0.366 714 H ILE 141 H ILE 141 -13.052 -5.080 -2.171 715 HA ILE 141 HA ILE 141 -13.300 -5.980 -4.979 716 HB ILE 141 HB ILE 141 -10.917 -5.068 -5.322 717 HG12 ILE 141 2HG1 ILE 141 -11.546 -2.925 -3.396 718 HG13 ILE 141 1HG1 ILE 141 -11.129 -4.469 -2.651 719 HG21 ILE 141 1HG2 ILE 141 -12.621 -4.023 -6.559 720 HG22 ILE 141 2HG2 ILE 141 -11.918 -2.685 -5.648 721 HG23 ILE 141 3HG2 ILE 141 -13.429 -3.421 -5.112 722 HD11 ILE 141 1HD1 ILE 141 -9.448 -3.359 -4.888 723 HD12 ILE 141 2HD1 ILE 141 -8.995 -4.509 -3.630 724 HD13 ILE 141 3HD1 ILE 141 -9.205 -2.804 -3.233 725 H GLY 142 H GLY 142 -12.778 -8.082 -4.983 726 HA2 GLY 142 2HA GLY 142 -11.595 -9.537 -2.896 727 HA3 GLY 142 1HA GLY 142 -11.558 -10.054 -4.580 728 H SER 143 H SER 143 -10.070 -7.719 -5.502 729 HA SER 143 HA SER 143 -7.655 -7.234 -4.136 730 HB2 SER 143 2HB SER 143 -7.771 -9.847 -5.551 731 HB3 SER 143 1HB SER 143 -6.314 -8.889 -5.800 732 HG SER 143 HG SER 143 -5.861 -9.008 -3.691 733 H GLN 144 H GLN 144 -8.601 -5.335 -5.390 734 HA GLN 144 HA GLN 144 -7.377 -5.254 -8.107 735 HB2 GLN 144 2HB GLN 144 -10.080 -4.187 -7.268 736 HB3 GLN 144 1HB GLN 144 -9.304 -3.814 -8.808 737 HG2 GLN 144 2HG GLN 144 -9.169 -6.286 -9.259 738 HG3 GLN 144 1HG GLN 144 -10.135 -6.550 -7.808 739 HE21 GLN 144 1HE2 GLN 144 -11.003 -3.614 -9.312 740 HE22 GLN 144 2HE2 GLN 144 -12.367 -4.171 -10.154 741 HA PRO 145 HA PRO 145 -5.471 -1.866 -5.572 742 HB2 PRO 145 2HB PRO 145 -3.898 -1.734 -8.103 743 HB3 PRO 145 1HB PRO 145 -3.333 -1.736 -6.425 744 HG2 PRO 145 2HG PRO 145 -3.117 -3.884 -8.003 745 HG3 PRO 145 1HG PRO 145 -3.396 -4.011 -6.260 746 HD2 PRO 145 2HD PRO 145 -5.275 -4.517 -8.503 747 HD3 PRO 145 1HD PRO 145 -5.272 -5.193 -6.859 748 H PHE 146 H PHE 146 -5.513 0.496 -5.972 749 HA PHE 146 HA PHE 146 -6.783 1.317 -8.506 750 HB2 PHE 146 2HB PHE 146 -8.372 2.777 -7.248 751 HB3 PHE 146 1HB PHE 146 -8.668 1.057 -7.017 752 HD1 PHE 146 1HD PHE 146 -7.278 0.016 -4.923 753 HD2 PHE 146 2HD PHE 146 -8.409 4.136 -5.405 754 HE1 PHE 146 1HE PHE 146 -7.115 0.353 -2.477 755 HE2 PHE 146 2HE PHE 146 -8.249 4.465 -2.955 756 HZ PHE 146 HZ PHE 146 -7.594 2.575 -1.490 757 H THR 147 H THR 147 -6.432 3.510 -9.063 758 HA THR 147 HA THR 147 -4.234 4.797 -7.513 759 HB THR 147 HB THR 147 -3.444 5.739 -9.588 760 HG1 THR 147 1HG THR 147 -4.711 4.765 -11.508 761 HG21 THR 147 1HG2 THR 147 -3.644 3.262 -10.887 762 HG22 THR 147 2HG2 THR 147 -3.721 2.895 -9.162 763 HG23 THR 147 3HG2 THR 147 -2.351 3.796 -9.812 764 H CYS 148 H CYS 148 -4.302 7.129 -7.466 765 HA CYS 148 HA CYS 148 -6.922 8.329 -8.101 766 HB2 CYS 148 2HB CYS 148 -5.780 9.188 -5.518 767 HB3 CYS 148 1HB CYS 148 -7.447 8.795 -5.933 768 H TYR 149 H TYR 149 -6.806 10.693 -8.196 769 HA TYR 149 HA TYR 149 -4.071 11.863 -8.198 770 HB2 TYR 149 2HB TYR 149 -5.934 11.989 -10.591 771 HB3 TYR 149 1HB TYR 149 -4.406 12.848 -10.440 772 HD1 TYR 149 1HD TYR 149 -6.003 9.648 -11.154 773 HD2 TYR 149 2HD TYR 149 -2.263 11.574 -10.296 774 HE1 TYR 149 1HE TYR 149 -4.787 7.657 -11.989 775 HE2 TYR 149 2HE TYR 149 -1.046 9.582 -11.130 776 HH TYR 149 HH TYR 149 -2.691 6.978 -12.769 777 H PHE 150 H PHE 150 -4.165 13.961 -7.390 778 HA PHE 150 HA PHE 150 -6.775 15.343 -7.544 779 HB2 PHE 150 2HB PHE 150 -7.225 15.277 -5.329 780 HB3 PHE 150 1HB PHE 150 -6.042 13.975 -5.257 781 HD1 PHE 150 1HD PHE 150 -6.753 17.445 -4.453 782 HD2 PHE 150 2HD PHE 150 -3.661 14.479 -4.675 783 HE1 PHE 150 1HE PHE 150 -5.315 18.862 -3.018 784 HE2 PHE 150 2HE PHE 150 -2.204 15.886 -3.249 785 HZ PHE 150 HZ PHE 150 -3.029 18.075 -2.410 786 H ASN 151 H ASN 151 -6.661 17.604 -7.384 787 HA ASN 151 HA ASN 151 -3.960 18.794 -7.068 788 HB2 ASN 151 2HB ASN 151 -4.087 19.994 -9.163 789 HB3 ASN 151 1HB ASN 151 -4.319 18.279 -9.497 790 HD21 ASN 151 1HD2 ASN 151 -5.313 20.383 -11.235 791 HD22 ASN 151 2HD2 ASN 151 -7.008 20.303 -11.219 792 H GLN 152 H GLN 152 -4.101 20.542 -5.823 793 HA GLN 152 HA GLN 152 -6.721 21.786 -5.263 794 HB2 GLN 152 2HB GLN 152 -5.195 21.209 -3.386 795 HB3 GLN 152 1HB GLN 152 -3.977 22.291 -4.057 796 HG2 GLN 152 2HG GLN 152 -5.379 24.217 -3.701 797 HG3 GLN 152 1HG GLN 152 -6.758 23.205 -3.276 798 HE21 GLN 152 1HE2 GLN 152 -6.074 25.054 -1.370 799 HE22 GLN 152 2HE2 GLN 152 -5.268 24.322 -0.067 800 H HIS 153 H HIS 153 -4.262 22.157 -7.469 801 HA HIS 153 HA HIS 153 -3.613 24.849 -7.605 802 HB2 HIS 153 2HB HIS 153 -4.285 22.930 -9.847 803 HB3 HIS 153 1HB HIS 153 -3.550 24.512 -10.100 804 HD1 HIS 153 1HD HIS 153 -1.057 24.590 -9.967 805 HD2 HIS 153 2HD HIS 153 -2.596 21.251 -7.994 806 HE1 HIS 153 1HE HIS 153 0.937 23.231 -9.192 807 HE2 HIS 153 2HE HIS 153 0.012 21.197 -7.994 808 H GLN 154 H GLN 154 -6.695 23.341 -8.509 809 HA GLN 154 HA GLN 154 -7.778 25.728 -9.727 810 HB2 GLN 154 2HB GLN 154 -9.140 23.320 -8.482 811 HB3 GLN 154 1HB GLN 154 -9.972 24.572 -9.400 812 HG2 GLN 154 2HG GLN 154 -8.583 24.071 -11.370 813 HG3 GLN 154 1HG GLN 154 -7.730 22.828 -10.456 814 HE21 GLN 154 1HE2 GLN 154 -9.065 22.008 -12.765 815 HE22 GLN 154 2HE2 GLN 154 -10.453 21.123 -12.350 816 H ARG 155 H ARG 155 -8.765 24.174 -6.665 817 HA ARG 155 HA ARG 155 -8.361 26.556 -5.118 818 HB2 ARG 155 2HB ARG 155 -10.793 26.495 -6.590 819 HB3 ARG 155 1HB ARG 155 -11.202 26.233 -4.893 820 HG2 ARG 155 2HG ARG 155 -9.409 28.465 -5.889 821 HG3 ARG 155 1HG ARG 155 -11.123 28.657 -5.527 822 HD2 ARG 155 2HD ARG 155 -10.388 27.537 -3.218 823 HD3 ARG 155 1HD ARG 155 -8.828 28.230 -3.661 824 HE ARG 155 HE ARG 155 -10.814 30.239 -4.001 825 HH11 ARG 155 1HH1 ARG 155 -11.058 31.808 -2.392 826 HH12 ARG 155 2HH1 ARG 155 -10.467 31.492 -0.795 827 HH21 ARG 155 1HH2 ARG 155 -9.280 28.330 -1.575 828 HH22 ARG 155 2HH2 ARG 155 -9.459 29.523 -0.332 829 HA PRO 156 HA PRO 156 -10.146 23.146 -2.407 830 HB2 PRO 156 2HB PRO 156 -11.875 21.328 -3.344 831 HB3 PRO 156 1HB PRO 156 -12.364 23.015 -3.106 832 HG2 PRO 156 2HG PRO 156 -11.846 21.549 -5.607 833 HG3 PRO 156 1HG PRO 156 -12.871 22.963 -5.316 834 HD2 PRO 156 2HD PRO 156 -10.167 22.915 -6.350 835 HD3 PRO 156 1HD PRO 156 -11.218 24.318 -6.090 836 H ASP 157 H ASP 157 -10.764 20.568 -4.611 837 HA ASP 157 HA ASP 157 -8.101 19.561 -4.925 838 HB2 ASP 157 2HB ASP 157 -8.646 17.577 -3.233 839 HB3 ASP 157 1HB ASP 157 -7.863 19.056 -2.676 840 H ASP 158 H ASP 158 -9.225 19.233 -7.027 841 HA ASP 158 HA ASP 158 -11.502 17.529 -7.326 842 HB2 ASP 158 2HB ASP 158 -9.130 17.963 -9.178 843 HB3 ASP 158 1HB ASP 158 -10.603 17.111 -9.638 844 H VAL 159 H VAL 159 -11.561 15.184 -7.658 845 HA VAL 159 HA VAL 159 -9.000 13.808 -6.949 846 HB VAL 159 HB VAL 159 -11.726 13.128 -5.826 847 HG11 VAL 159 1HG1 VAL 159 -9.137 11.761 -5.930 848 HG12 VAL 159 2HG1 VAL 159 -10.723 11.127 -5.486 849 HG13 VAL 159 3HG1 VAL 159 -9.737 11.959 -4.283 850 HG21 VAL 159 1HG2 VAL 159 -9.349 14.627 -4.704 851 HG22 VAL 159 2HG2 VAL 159 -10.551 13.865 -3.662 852 HG23 VAL 159 3HG2 VAL 159 -11.033 15.149 -4.769 853 H LEU 160 H LEU 160 -8.666 11.805 -7.850 854 HA LEU 160 HA LEU 160 -10.698 10.839 -9.824 855 HB2 LEU 160 2HB LEU 160 -7.672 10.668 -9.996 856 HB3 LEU 160 1HB LEU 160 -8.789 9.996 -11.176 857 HG LEU 160 HG LEU 160 -8.390 12.926 -10.495 858 HD11 LEU 160 1HD1 LEU 160 -7.062 12.974 -12.315 859 HD12 LEU 160 2HD1 LEU 160 -8.297 12.179 -13.292 860 HD13 LEU 160 3HD1 LEU 160 -7.153 11.213 -12.360 861 HD21 LEU 160 1HD2 LEU 160 -10.063 13.102 -12.523 862 HD22 LEU 160 2HD2 LEU 160 -10.695 12.854 -10.895 863 HD23 LEU 160 3HD2 LEU 160 -10.559 11.490 -12.007 864 H LEU 161 H LEU 161 -10.933 8.511 -9.908 865 HA LEU 161 HA LEU 161 -9.428 7.003 -7.828 866 HB2 LEU 161 2HB LEU 161 -11.617 7.837 -6.888 867 HB3 LEU 161 1HB LEU 161 -12.438 6.844 -8.095 868 HG LEU 161 HG LEU 161 -10.776 4.984 -7.107 869 HD11 LEU 161 1HD1 LEU 161 -10.587 5.260 -4.663 870 HD12 LEU 161 2HD1 LEU 161 -11.304 6.866 -4.788 871 HD13 LEU 161 3HD1 LEU 161 -9.728 6.544 -5.511 872 HD21 LEU 161 1HD2 LEU 161 -13.201 4.773 -7.220 873 HD22 LEU 161 2HD2 LEU 161 -13.391 5.895 -5.872 874 HD23 LEU 161 3HD2 LEU 161 -12.657 4.313 -5.607 875 H HIS 162 H HIS 162 -8.600 6.418 -10.206 876 HA HIS 162 HA HIS 162 -10.268 4.609 -11.744 877 HB2 HIS 162 2HB HIS 162 -7.258 5.006 -11.700 878 HB3 HIS 162 1HB HIS 162 -8.114 4.009 -12.877 879 HD1 HIS 162 1HD HIS 162 -6.562 6.437 -13.904 880 HD2 HIS 162 2HD HIS 162 -10.580 6.612 -12.799 881 HE1 HIS 162 1HE HIS 162 -7.549 8.441 -15.102 882 HE2 HIS 162 2HE HIS 162 -9.994 8.556 -14.436 883 H ARG 163 H ARG 163 -10.192 2.289 -11.731 884 HA ARG 163 HA ARG 163 -8.905 1.131 -9.286 885 HB2 ARG 163 2HB ARG 163 -11.446 0.311 -10.710 886 HB3 ARG 163 1HB ARG 163 -10.729 -0.568 -9.360 887 HG2 ARG 163 2HG ARG 163 -10.886 1.512 -7.981 888 HG3 ARG 163 1HG ARG 163 -11.731 2.294 -9.319 889 HD2 ARG 163 2HD ARG 163 -12.649 -0.184 -7.828 890 HD3 ARG 163 1HD ARG 163 -13.363 1.426 -7.715 891 HE ARG 163 HE ARG 163 -13.400 0.679 -10.447 892 HH11 ARG 163 1HH1 ARG 163 -15.301 -0.159 -11.341 893 HH12 ARG 163 2HH1 ARG 163 -16.498 -0.853 -10.302 894 HH21 ARG 163 1HH2 ARG 163 -14.696 -0.271 -7.397 895 HH22 ARG 163 2HH2 ARG 163 -16.157 -0.917 -8.068 896 H THR 164 H THR 164 -8.046 -1.019 -9.458 897 HA THR 164 HA THR 164 -6.794 -1.585 -12.027 898 HB THR 164 HB THR 164 -6.824 -3.103 -9.410 899 HG1 THR 164 1HG THR 164 -4.586 -1.910 -10.569 900 HG21 THR 164 1HG2 THR 164 -6.214 -4.846 -10.744 901 HG22 THR 164 2HG2 THR 164 -4.657 -4.022 -10.777 902 HG23 THR 164 3HG2 THR 164 -5.804 -3.795 -12.098 903 H HIS 165 H HIS 165 -7.365 -3.186 -13.491 904 HA HIS 165 HA HIS 165 -9.872 -4.705 -12.873 905 HB2 HIS 165 2HB HIS 165 -10.106 -3.011 -14.687 906 HB3 HIS 165 1HB HIS 165 -8.825 -3.831 -15.583 907 HD1 HIS 165 1HD HIS 165 -12.149 -4.795 -13.952 908 HD2 HIS 165 2HD HIS 165 -9.835 -5.744 -17.291 909 HE1 HIS 165 1HE HIS 165 -13.480 -6.487 -15.291 910 HE2 HIS 165 2HE HIS 165 -12.082 -7.071 -17.324 911 H ASP 166 H ASP 166 -9.687 -6.899 -12.907 912 HA ASP 166 HA ASP 166 -7.283 -8.294 -12.998 913 HB2 ASP 166 2HB ASP 166 -10.028 -9.235 -13.874 914 HB3 ASP 166 1HB ASP 166 -8.656 -10.309 -13.600 Start of MODEL 3 1 H1 GLN 45 1HT GLN 45 2.267 14.318 -3.594 2 H2 GLN 45 2HT GLN 45 1.488 13.267 -2.510 3 H3 GLN 45 3HT GLN 45 2.124 12.670 -3.968 4 HA GLN 45 HA GLN 45 3.413 12.378 -1.726 5 HB2 GLN 45 2HB GLN 45 4.645 13.196 -4.374 6 HB3 GLN 45 1HB GLN 45 5.522 12.399 -3.066 7 HG2 GLN 45 2HG GLN 45 4.005 10.473 -3.195 8 HG3 GLN 45 1HG GLN 45 3.082 11.270 -4.469 9 HE21 GLN 45 1HE2 GLN 45 4.332 8.756 -4.959 10 HE22 GLN 45 2HE2 GLN 45 5.599 8.983 -6.064 11 H ASP 46 H ASP 46 4.453 15.131 -3.750 12 HA ASP 46 HA ASP 46 5.877 16.406 -1.615 13 HB2 ASP 46 2HB ASP 46 4.760 17.525 -4.203 14 HB3 ASP 46 1HB ASP 46 5.844 18.408 -3.128 15 H LEU 47 H LEU 47 5.271 18.341 -0.440 16 HA LEU 47 HA LEU 47 2.698 18.310 0.709 17 HB2 LEU 47 2HB LEU 47 4.520 20.717 0.401 18 HB3 LEU 47 1HB LEU 47 3.239 20.526 1.598 19 HG LEU 47 HG LEU 47 5.721 18.801 1.356 20 HD11 LEU 47 1HD1 LEU 47 6.157 21.029 2.303 21 HD12 LEU 47 2HD1 LEU 47 6.277 19.794 3.555 22 HD13 LEU 47 3HD1 LEU 47 4.838 20.808 3.453 23 HD21 LEU 47 1HD2 LEU 47 3.197 18.598 2.964 24 HD22 LEU 47 2HD2 LEU 47 4.714 18.081 3.701 25 HD23 LEU 47 3HD2 LEU 47 4.150 17.317 2.214 26 H GLN 48 H GLN 48 3.873 19.920 -2.188 27 HA GLN 48 HA GLN 48 1.677 21.694 -2.590 28 HB2 GLN 48 2HB GLN 48 4.004 21.320 -3.881 29 HB3 GLN 48 1HB GLN 48 2.956 20.398 -4.957 30 HG2 GLN 48 2HG GLN 48 2.845 23.329 -4.272 31 HG3 GLN 48 1HG GLN 48 2.852 22.564 -5.862 32 HE21 GLN 48 1HE2 GLN 48 0.823 21.187 -6.346 33 HE22 GLN 48 2HE2 GLN 48 -0.656 21.745 -5.733 34 H ALA 49 H ALA 49 -0.303 21.380 -3.675 35 HA ALA 49 HA ALA 49 -1.376 18.676 -3.609 36 HB1 ALA 49 1HB ALA 49 -3.439 19.774 -4.470 37 HB2 ALA 49 2HB ALA 49 -2.530 21.275 -4.653 38 HB3 ALA 49 3HB ALA 49 -2.787 20.592 -3.049 39 H THR 50 H THR 50 -1.314 17.222 -5.267 40 HA THR 50 HA THR 50 -1.667 17.955 -8.024 41 HB THR 50 HB THR 50 1.136 17.079 -7.271 42 HG1 THR 50 1HG THR 50 0.269 19.568 -8.300 43 HG21 THR 50 1HG2 THR 50 1.572 16.890 -9.503 44 HG22 THR 50 2HG2 THR 50 0.495 18.219 -9.930 45 HG23 THR 50 3HG2 THR 50 -0.168 16.616 -9.614 46 H GLU 51 H GLU 51 0.430 15.477 -6.548 47 HA GLU 51 HA GLU 51 -1.368 13.425 -7.750 48 HB2 GLU 51 2HB GLU 51 1.549 13.205 -6.977 49 HB3 GLU 51 1HB GLU 51 0.594 11.964 -7.788 50 HG2 GLU 51 2HG GLU 51 0.197 13.550 -9.672 51 HG3 GLU 51 1HG GLU 51 1.253 14.716 -8.876 52 H ALA 52 H ALA 52 -2.183 11.806 -6.517 53 HA ALA 52 HA ALA 52 -1.173 11.295 -3.799 54 HB1 ALA 52 1HB ALA 52 -3.885 12.460 -4.418 55 HB2 ALA 52 2HB ALA 52 -2.778 12.881 -3.111 56 HB3 ALA 52 3HB ALA 52 -3.688 11.371 -3.044 57 H ASN 53 H ASN 53 -0.855 9.087 -4.126 58 HA ASN 53 HA ASN 53 -2.937 7.665 -5.681 59 HB2 ASN 53 2HB ASN 53 -0.114 6.868 -5.022 60 HB3 ASN 53 1HB ASN 53 -1.259 5.823 -5.857 61 HD21 ASN 53 1HD2 ASN 53 -2.558 8.038 -7.361 62 HD22 ASN 53 2HD2 ASN 53 -1.436 8.542 -8.528 63 H CYS 54 H CYS 54 -4.117 5.985 -4.899 64 HA CYS 54 HA CYS 54 -3.649 5.200 -2.054 65 HB2 CYS 54 2HB CYS 54 -6.275 5.092 -2.072 66 HB3 CYS 54 1HB CYS 54 -5.492 6.653 -1.839 67 H THR 55 H THR 55 -2.862 3.085 -2.606 68 HA THR 55 HA THR 55 -4.821 1.488 -4.182 69 HB THR 55 HB THR 55 -3.255 1.052 -5.723 70 HG1 THR 55 1HG THR 55 -1.116 0.259 -4.635 71 HG21 THR 55 1HG2 THR 55 -2.438 3.341 -5.103 72 HG22 THR 55 2HG2 THR 55 -1.160 2.288 -5.705 73 HG23 THR 55 3HG2 THR 55 -1.312 2.587 -3.977 74 H VAL 56 H VAL 56 -5.184 -0.599 -3.630 75 HA VAL 56 HA VAL 56 -4.172 -1.439 -0.964 76 HB VAL 56 HB VAL 56 -6.516 -2.291 -2.678 77 HG11 VAL 56 1HG1 VAL 56 -6.918 -3.932 -0.728 78 HG12 VAL 56 2HG1 VAL 56 -5.211 -3.701 -0.351 79 HG13 VAL 56 3HG1 VAL 56 -5.685 -4.373 -1.909 80 HG21 VAL 56 1HG2 VAL 56 -6.219 -0.432 -0.628 81 HG22 VAL 56 2HG2 VAL 56 -6.892 -1.845 0.183 82 HG23 VAL 56 3HG2 VAL 56 -7.744 -1.125 -1.181 83 H LEU 57 H LEU 57 -2.421 -2.761 -1.076 84 HA LEU 57 HA LEU 57 -1.299 -3.781 -3.418 85 HB2 LEU 57 2HB LEU 57 -0.282 -3.741 -1.071 86 HB3 LEU 57 1HB LEU 57 -1.157 -5.244 -0.781 87 HG LEU 57 HG LEU 57 -0.076 -6.145 -2.904 88 HD11 LEU 57 1HD1 LEU 57 2.264 -4.554 -2.851 89 HD12 LEU 57 2HD1 LEU 57 0.906 -3.435 -2.955 90 HD13 LEU 57 3HD1 LEU 57 1.098 -4.702 -4.164 91 HD21 LEU 57 1HD2 LEU 57 0.883 -7.087 -1.034 92 HD22 LEU 57 2HD2 LEU 57 1.304 -5.522 -0.335 93 HD23 LEU 57 3HD2 LEU 57 2.276 -6.196 -1.646 94 H SER 58 H SER 58 -1.327 -5.878 -4.387 95 HA SER 58 HA SER 58 -3.934 -7.249 -4.093 96 HB2 SER 58 2HB SER 58 -3.399 -8.307 -6.214 97 HB3 SER 58 1HB SER 58 -3.060 -6.585 -6.371 98 HG SER 58 HG SER 58 -1.386 -8.094 -7.122 99 H VAL 59 H VAL 59 -3.959 -9.562 -3.650 100 HA VAL 59 HA VAL 59 -1.544 -10.402 -2.142 101 HB VAL 59 HB VAL 59 -4.189 -11.857 -2.272 102 HG11 VAL 59 1HG1 VAL 59 -2.261 -11.648 0.038 103 HG12 VAL 59 2HG1 VAL 59 -2.005 -12.825 -1.250 104 HG13 VAL 59 3HG1 VAL 59 -3.472 -12.890 -0.275 105 HG21 VAL 59 1HG2 VAL 59 -3.426 -9.330 -0.863 106 HG22 VAL 59 2HG2 VAL 59 -4.412 -10.492 0.022 107 HG23 VAL 59 3HG2 VAL 59 -4.992 -9.824 -1.504 108 H GLN 60 H GLN 60 -0.097 -11.620 -3.205 109 HA GLN 60 HA GLN 60 -1.061 -13.758 -5.013 110 HB2 GLN 60 2HB GLN 60 0.988 -11.659 -5.784 111 HB3 GLN 60 1HB GLN 60 0.625 -13.104 -6.729 112 HG2 GLN 60 2HG GLN 60 -1.728 -12.375 -6.938 113 HG3 GLN 60 1HG GLN 60 -1.356 -10.923 -6.009 114 HE21 GLN 60 1HE2 GLN 60 -2.329 -10.431 -8.517 115 HE22 GLN 60 2HE2 GLN 60 -1.091 -9.944 -9.572 116 H GLN 61 H GLN 61 0.578 -15.420 -5.359 117 HA GLN 61 HA GLN 61 2.160 -15.926 -2.998 118 HB2 GLN 61 2HB GLN 61 2.306 -17.306 -5.688 119 HB3 GLN 61 1HB GLN 61 2.865 -17.953 -4.148 120 HG2 GLN 61 2HG GLN 61 0.004 -17.287 -4.895 121 HG3 GLN 61 1HG GLN 61 0.681 -18.902 -4.680 122 HE21 GLN 61 1HE2 GLN 61 -1.063 -16.533 -3.077 123 HE22 GLN 61 2HE2 GLN 61 -0.711 -16.982 -1.483 124 H ILE 62 H ILE 62 4.555 -16.487 -3.198 125 HA ILE 62 HA ILE 62 6.153 -14.292 -3.700 126 HB ILE 62 HB ILE 62 6.932 -17.189 -4.159 127 HG12 ILE 62 2HG1 ILE 62 7.166 -15.475 -1.670 128 HG13 ILE 62 1HG1 ILE 62 5.877 -16.647 -1.936 129 HG21 ILE 62 1HG2 ILE 62 8.500 -14.637 -3.785 130 HG22 ILE 62 2HG2 ILE 62 8.711 -15.889 -5.010 131 HG23 ILE 62 3HG2 ILE 62 9.189 -16.199 -3.342 132 HD11 ILE 62 1HD1 ILE 62 8.501 -17.804 -2.451 133 HD12 ILE 62 2HD1 ILE 62 7.218 -18.376 -1.384 134 HD13 ILE 62 3HD1 ILE 62 8.378 -17.176 -0.807 135 H GLY 63 H GLY 63 7.890 -14.115 -5.491 136 HA2 GLY 63 2HA GLY 63 8.494 -14.332 -7.819 137 HA3 GLY 63 1HA GLY 63 6.889 -14.992 -8.145 138 H GLU 64 H GLU 64 6.539 -12.412 -6.088 139 HA GLU 64 HA GLU 64 6.090 -10.523 -8.356 140 HB2 GLU 64 2HB GLU 64 4.504 -10.789 -5.788 141 HB3 GLU 64 1HB GLU 64 4.228 -9.573 -7.034 142 HG2 GLU 64 2HG GLU 64 4.049 -12.570 -7.435 143 HG3 GLU 64 1HG GLU 64 2.683 -11.469 -7.289 144 H VAL 65 H VAL 65 6.728 -8.393 -8.037 145 HA VAL 65 HA VAL 65 8.227 -7.851 -5.506 146 HB VAL 65 HB VAL 65 9.770 -6.471 -6.829 147 HG11 VAL 65 1HG1 VAL 65 10.850 -8.461 -6.892 148 HG12 VAL 65 2HG1 VAL 65 10.269 -8.582 -8.553 149 HG13 VAL 65 3HG1 VAL 65 9.365 -9.346 -7.245 150 HG21 VAL 65 1HG2 VAL 65 9.554 -6.736 -9.386 151 HG22 VAL 65 2HG2 VAL 65 8.412 -5.647 -8.597 152 HG23 VAL 65 3HG2 VAL 65 7.904 -7.269 -9.068 153 H PHE 66 H PHE 66 7.834 -5.871 -4.535 154 HA PHE 66 HA PHE 66 5.876 -4.077 -5.902 155 HB2 PHE 66 2HB PHE 66 6.034 -4.743 -2.947 156 HB3 PHE 66 1HB PHE 66 4.899 -3.610 -3.685 157 HD1 PHE 66 1HD PHE 66 5.702 -7.107 -3.089 158 HD2 PHE 66 2HD PHE 66 3.189 -4.433 -5.316 159 HE1 PHE 66 1HE PHE 66 4.186 -8.992 -3.638 160 HE2 PHE 66 2HE PHE 66 1.669 -6.313 -5.860 161 HZ PHE 66 HZ PHE 66 2.167 -8.594 -5.022 162 H GLU 67 H GLU 67 6.055 -1.797 -5.241 163 HA GLU 67 HA GLU 67 8.867 -1.138 -4.510 164 HB2 GLU 67 2HB GLU 67 8.580 0.925 -5.707 165 HB3 GLU 67 1HB GLU 67 7.948 -0.363 -6.734 166 HG2 GLU 67 2HG GLU 67 5.652 0.134 -5.835 167 HG3 GLU 67 1HG GLU 67 6.336 1.528 -4.995 168 H CYS 68 H CYS 68 9.276 0.502 -2.973 169 HA CYS 68 HA CYS 68 6.994 1.037 -1.119 170 HB2 CYS 68 2HB CYS 68 9.188 -0.184 -0.374 171 HB3 CYS 68 1HB CYS 68 9.901 1.428 -0.422 172 H THR 69 H THR 69 6.982 3.276 -0.167 173 HA THR 69 HA THR 69 8.145 5.242 -2.101 174 HB THR 69 HB THR 69 6.053 6.004 -2.389 175 HG1 THR 69 1HG THR 69 5.088 7.066 -0.662 176 HG21 THR 69 1HG2 THR 69 5.353 3.681 -1.858 177 HG22 THR 69 2HG2 THR 69 4.150 4.865 -1.345 178 HG23 THR 69 3HG2 THR 69 5.224 4.128 -0.155 179 H PHE 70 H PHE 70 9.246 6.982 -1.291 180 HA PHE 70 HA PHE 70 9.111 7.585 1.597 181 HB2 PHE 70 2HB PHE 70 11.502 7.473 1.935 182 HB3 PHE 70 1HB PHE 70 10.965 5.906 1.326 183 HD1 PHE 70 1HD PHE 70 12.835 8.974 0.573 184 HD2 PHE 70 2HD PHE 70 11.462 5.214 -0.985 185 HE1 PHE 70 1HE PHE 70 14.412 9.187 -1.329 186 HE2 PHE 70 2HE PHE 70 13.038 5.429 -2.888 187 HZ PHE 70 HZ PHE 70 14.512 7.414 -3.061 188 H THR 71 H THR 71 10.151 9.686 2.061 189 HA THR 71 HA THR 71 10.549 11.352 -0.375 190 HB THR 71 HB THR 71 9.049 12.288 2.080 191 HG1 THR 71 1HG THR 71 8.113 11.230 -0.376 192 HG21 THR 71 1HG2 THR 71 9.082 14.284 1.052 193 HG22 THR 71 2HG2 THR 71 8.443 13.574 -0.430 194 HG23 THR 71 3HG2 THR 71 10.183 13.597 -0.142 195 H CYS 72 H CYS 72 12.121 12.956 -0.161 196 HA CYS 72 HA CYS 72 13.532 13.091 2.472 197 HB2 CYS 72 2HB CYS 72 15.487 12.448 1.539 198 HB3 CYS 72 1HB CYS 72 14.547 11.937 0.140 199 H GLY 73 H GLY 73 14.960 15.139 2.542 200 HA2 GLY 73 2HA GLY 73 13.282 17.391 1.691 201 HA3 GLY 73 1HA GLY 73 14.720 17.498 2.708 202 H ALA 74 H ALA 74 14.687 19.402 0.884 203 HA ALA 74 HA ALA 74 16.114 20.302 -0.771 204 HB1 ALA 74 1HB ALA 74 17.234 17.647 -1.511 205 HB2 ALA 74 2HB ALA 74 17.582 18.223 0.120 206 HB3 ALA 74 3HB ALA 74 18.059 19.187 -1.278 207 H ASP 75 H ASP 75 13.453 18.937 -1.160 208 HA ASP 75 HA ASP 75 12.024 18.399 -2.932 209 HB2 ASP 75 2HB ASP 75 14.208 19.822 -4.488 210 HB3 ASP 75 1HB ASP 75 12.628 19.393 -5.142 211 H CYS 76 H CYS 76 13.640 16.299 -2.104 212 HA CYS 76 HA CYS 76 14.194 14.929 -4.702 213 HB2 CYS 76 2HB CYS 76 16.297 14.445 -4.059 214 HB3 CYS 76 1HB CYS 76 16.071 15.527 -2.688 215 H ARG 77 H ARG 77 12.841 13.258 -4.961 216 HA ARG 77 HA ARG 77 11.975 11.716 -2.556 217 HB2 ARG 77 2HB ARG 77 9.746 11.498 -3.975 218 HB3 ARG 77 1HB ARG 77 10.003 12.892 -2.927 219 HG2 ARG 77 2HG ARG 77 11.075 13.096 -5.694 220 HG3 ARG 77 1HG ARG 77 9.321 13.143 -5.522 221 HD2 ARG 77 2HD ARG 77 9.568 14.952 -3.822 222 HD3 ARG 77 1HD ARG 77 11.309 14.947 -4.106 223 HE ARG 77 HE ARG 77 10.907 16.200 -6.053 224 HH11 ARG 77 1HH1 ARG 77 9.593 17.091 -7.660 225 HH12 ARG 77 2HH1 ARG 77 7.932 16.614 -7.767 226 HH21 ARG 77 1HH2 ARG 77 8.111 14.436 -5.074 227 HH22 ARG 77 2HH2 ARG 77 7.093 15.111 -6.303 228 H GLY 78 H GLY 78 11.360 9.459 -3.108 229 HA2 GLY 78 2HA GLY 78 11.744 8.492 -5.817 230 HA3 GLY 78 1HA GLY 78 13.145 8.144 -4.803 231 H THR 79 H THR 79 12.050 5.938 -5.663 232 HA THR 79 HA THR 79 10.399 4.936 -3.390 233 HB THR 79 HB THR 79 9.141 3.544 -4.896 234 HG1 THR 79 1HG THR 79 11.118 4.371 -6.714 235 HG21 THR 79 1HG2 THR 79 8.127 5.241 -6.408 236 HG22 THR 79 2HG2 THR 79 9.467 6.329 -6.043 237 HG23 THR 79 3HG2 THR 79 8.348 5.847 -4.767 238 H SER 80 H SER 80 10.713 2.597 -2.985 239 HA SER 80 HA SER 80 13.423 1.666 -3.861 240 HB2 SER 80 2HB SER 80 11.999 1.092 -1.245 241 HB3 SER 80 1HB SER 80 13.600 0.514 -1.699 242 HG SER 80 HG SER 80 12.834 2.915 -0.699 243 H GLN 81 H GLN 81 13.616 -0.657 -4.191 244 HA GLN 81 HA GLN 81 10.990 -1.947 -4.793 245 HB2 GLN 81 2HB GLN 81 12.497 -1.486 -6.749 246 HB3 GLN 81 1HB GLN 81 13.688 -2.558 -6.018 247 HG2 GLN 81 2HG GLN 81 12.482 -3.904 -7.571 248 HG3 GLN 81 1HG GLN 81 11.867 -4.342 -5.976 249 HE21 GLN 81 1HE2 GLN 81 9.648 -4.101 -5.633 250 HE22 GLN 81 2HE2 GLN 81 8.603 -3.285 -6.686 251 H TYR 82 H TYR 82 10.507 -3.768 -3.660 252 HA TYR 82 HA TYR 82 12.742 -5.311 -2.442 253 HB2 TYR 82 2HB TYR 82 10.402 -4.034 -1.065 254 HB3 TYR 82 1HB TYR 82 11.033 -5.553 -0.435 255 HD1 TYR 82 1HD TYR 82 13.766 -5.593 -0.420 256 HD2 TYR 82 2HD TYR 82 11.281 -2.101 -0.130 257 HE1 TYR 82 1HE TYR 82 15.621 -4.362 0.673 258 HE2 TYR 82 2HE TYR 82 13.137 -0.871 0.963 259 HH TYR 82 HH TYR 82 15.197 -1.475 2.312 260 HA PRO 83 HA PRO 83 10.716 -8.993 -3.880 261 HB2 PRO 83 2HB PRO 83 10.594 -9.989 -1.077 262 HB3 PRO 83 1HB PRO 83 11.293 -10.750 -2.517 263 HG2 PRO 83 2HG PRO 83 12.793 -9.630 -0.592 264 HG3 PRO 83 1HG PRO 83 13.277 -9.663 -2.295 265 HD2 PRO 83 2HD PRO 83 12.354 -7.373 -0.659 266 HD3 PRO 83 1HD PRO 83 13.354 -7.393 -2.126 267 H CYS 84 H CYS 84 8.939 -10.635 -2.219 268 HA CYS 84 HA CYS 84 6.456 -9.212 -2.704 269 HB2 CYS 84 2HB CYS 84 5.824 -11.372 -2.845 270 HB3 CYS 84 1HB CYS 84 7.279 -11.917 -2.011 271 H VAL 85 H VAL 85 5.024 -8.348 -1.156 272 HA VAL 85 HA VAL 85 6.047 -8.231 1.653 273 HB VAL 85 HB VAL 85 5.246 -5.904 1.788 274 HG11 VAL 85 1HG1 VAL 85 7.011 -4.901 0.452 275 HG12 VAL 85 2HG1 VAL 85 7.079 -6.326 -0.587 276 HG13 VAL 85 3HG1 VAL 85 7.591 -6.437 1.097 277 HG21 VAL 85 1HG2 VAL 85 3.495 -5.772 0.217 278 HG22 VAL 85 2HG2 VAL 85 4.473 -6.479 -1.070 279 HG23 VAL 85 3HG2 VAL 85 4.784 -4.828 -0.530 280 H GLN 86 H GLN 86 4.288 -7.711 3.229 281 HA GLN 86 HA GLN 86 2.103 -9.481 2.997 282 HB2 GLN 86 2HB GLN 86 2.291 -6.968 4.678 283 HB3 GLN 86 1HB GLN 86 1.152 -8.288 4.922 284 HG2 GLN 86 2HG GLN 86 4.172 -8.531 5.035 285 HG3 GLN 86 1HG GLN 86 3.096 -8.509 6.432 286 HE21 GLN 86 1HE2 GLN 86 4.861 -10.674 4.806 287 HE22 GLN 86 2HE2 GLN 86 3.838 -12.028 4.846 288 H VAL 87 H VAL 87 -0.138 -7.879 3.763 289 HA VAL 87 HA VAL 87 -0.737 -6.495 1.173 290 HB VAL 87 HB VAL 87 -2.674 -8.000 2.956 291 HG11 VAL 87 1HG1 VAL 87 -3.585 -6.104 1.571 292 HG12 VAL 87 2HG1 VAL 87 -4.246 -7.679 1.138 293 HG13 VAL 87 3HG1 VAL 87 -2.999 -6.940 0.133 294 HG21 VAL 87 1HG2 VAL 87 -2.633 -9.739 1.249 295 HG22 VAL 87 2HG2 VAL 87 -0.986 -9.463 1.815 296 HG23 VAL 87 3HG2 VAL 87 -1.509 -8.797 0.269 297 H TYR 88 H TYR 88 -1.790 -4.499 1.314 298 HA TYR 88 HA TYR 88 -3.118 -3.520 3.638 299 HB2 TYR 88 2HB TYR 88 -1.209 -1.823 4.196 300 HB3 TYR 88 1HB TYR 88 -1.139 -3.448 4.832 301 HD1 TYR 88 1HD TYR 88 0.591 -4.955 4.240 302 HD2 TYR 88 2HD TYR 88 0.085 -1.290 2.060 303 HE1 TYR 88 1HE TYR 88 2.724 -5.358 3.089 304 HE2 TYR 88 2HE TYR 88 2.239 -1.692 0.900 305 HH TYR 88 HH TYR 88 3.808 -3.297 0.440 306 H VAL 89 H VAL 89 -1.859 -0.722 3.175 307 HA VAL 89 HA VAL 89 -2.820 -0.274 0.411 308 HB VAL 89 HB VAL 89 -4.721 0.130 1.978 309 HG11 VAL 89 1HG1 VAL 89 -4.594 1.910 3.601 310 HG12 VAL 89 2HG1 VAL 89 -2.997 2.390 3.026 311 HG13 VAL 89 3HG1 VAL 89 -3.206 0.856 3.873 312 HG21 VAL 89 1HG2 VAL 89 -4.601 1.392 -0.114 313 HG22 VAL 89 2HG2 VAL 89 -3.527 2.575 0.633 314 HG23 VAL 89 3HG2 VAL 89 -5.202 2.443 1.169 315 H ASN 90 H ASN 90 -1.639 1.250 -0.666 316 HA ASN 90 HA ASN 90 0.589 2.482 0.818 317 HB2 ASN 90 2HB ASN 90 0.027 2.693 -2.140 318 HB3 ASN 90 1HB ASN 90 1.567 2.887 -1.313 319 HD21 ASN 90 1HD2 ASN 90 1.166 0.540 0.458 320 HD22 ASN 90 2HD2 ASN 90 1.333 -0.829 -0.531 321 H ASN 91 H ASN 91 0.059 4.393 1.780 322 HA ASN 91 HA ASN 91 -2.003 6.093 0.527 323 HB2 ASN 91 2HB ASN 91 -0.503 6.310 3.154 324 HB3 ASN 91 1HB ASN 91 -1.727 7.461 2.615 325 HD21 ASN 91 1HD2 ASN 91 -2.110 5.917 4.994 326 HD22 ASN 91 2HD2 ASN 91 -3.378 4.823 4.727 327 H SER 92 H SER 92 -0.774 6.771 -1.317 328 HA SER 92 HA SER 92 1.682 8.326 -0.811 329 HB2 SER 92 2HB SER 92 0.630 8.394 -3.533 330 HB3 SER 92 1HB SER 92 2.208 7.869 -2.959 331 HG SER 92 HG SER 92 0.709 6.022 -2.101 332 H GLU 93 H GLU 93 -1.191 9.055 -0.040 333 HA GLU 93 HA GLU 93 -1.878 11.387 -1.628 334 HB2 GLU 93 2HB GLU 93 -2.705 10.796 1.227 335 HB3 GLU 93 1HB GLU 93 -3.580 11.752 0.028 336 HG2 GLU 93 2HG GLU 93 -3.812 9.698 -1.375 337 HG3 GLU 93 1HG GLU 93 -3.050 8.772 -0.080 338 H SER 94 H SER 94 0.428 10.667 0.719 339 HA SER 94 HA SER 94 1.473 13.365 0.776 340 HB2 SER 94 2HB SER 94 -0.101 12.308 3.107 341 HB3 SER 94 1HB SER 94 1.314 13.309 3.420 342 HG SER 94 HG SER 94 -0.315 14.267 1.434 343 H ASN 95 H ASN 95 2.401 10.800 0.026 344 HA ASN 95 HA ASN 95 4.269 9.422 0.267 345 HB2 ASN 95 2HB ASN 95 5.167 11.535 2.252 346 HB3 ASN 95 1HB ASN 95 6.189 10.334 1.466 347 HD21 ASN 95 1HD2 ASN 95 5.854 13.480 1.273 348 HD22 ASN 95 2HD2 ASN 95 5.880 13.743 -0.404 349 H SER 96 H SER 96 2.026 8.650 1.763 350 HA SER 96 HA SER 96 3.264 7.745 4.341 351 HB2 SER 96 2HB SER 96 0.750 7.267 4.887 352 HB3 SER 96 1HB SER 96 1.350 8.918 4.985 353 HG SER 96 HG SER 96 0.662 8.999 2.669 354 H ARG 97 H ARG 97 3.248 5.543 4.806 355 HA ARG 97 HA ARG 97 2.166 3.730 2.699 356 HB2 ARG 97 2HB ARG 97 4.608 3.905 2.478 357 HB3 ARG 97 1HB ARG 97 4.805 3.520 4.184 358 HG2 ARG 97 2HG ARG 97 5.235 1.495 2.986 359 HG3 ARG 97 1HG ARG 97 3.636 1.305 3.693 360 HD2 ARG 97 2HD ARG 97 2.569 1.802 1.599 361 HD3 ARG 97 1HD ARG 97 4.093 2.297 0.869 362 HE ARG 97 HE ARG 97 3.999 -0.484 1.833 363 HH11 ARG 97 1HH1 ARG 97 4.289 -2.035 0.215 364 HH12 ARG 97 2HH1 ARG 97 4.212 -1.558 -1.446 365 HH21 ARG 97 1HH2 ARG 97 3.600 1.780 -0.740 366 HH22 ARG 97 2HH2 ARG 97 3.822 0.600 -1.987 367 H ALA 98 H ALA 98 0.744 2.279 3.559 368 HA ALA 98 HA ALA 98 0.844 1.801 6.500 369 HB1 ALA 98 1HB ALA 98 -1.509 0.678 5.399 370 HB2 ALA 98 2HB ALA 98 -1.310 2.257 4.640 371 HB3 ALA 98 3HB ALA 98 -1.381 2.126 6.397 372 H LEU 99 H LEU 99 1.511 -0.180 7.179 373 HA LEU 99 HA LEU 99 1.579 -2.396 5.171 374 HB2 LEU 99 2HB LEU 99 3.808 -1.530 5.889 375 HB3 LEU 99 1HB LEU 99 3.410 -1.989 7.544 376 HG LEU 99 HG LEU 99 2.841 -4.305 6.202 377 HD11 LEU 99 1HD1 LEU 99 3.841 -3.076 4.151 378 HD12 LEU 99 2HD1 LEU 99 4.402 -4.716 4.486 379 HD13 LEU 99 3HD1 LEU 99 5.396 -3.332 4.939 380 HD21 LEU 99 1HD2 LEU 99 5.616 -3.587 7.179 381 HD22 LEU 99 2HD2 LEU 99 4.867 -5.181 7.167 382 HD23 LEU 99 3HD2 LEU 99 4.272 -3.939 8.266 383 H LEU 100 H LEU 100 0.235 -4.050 5.641 384 HA LEU 100 HA LEU 100 -0.392 -4.591 8.509 385 HB2 LEU 100 2HB LEU 100 -2.315 -3.526 7.333 386 HB3 LEU 100 1HB LEU 100 -2.297 -4.845 6.167 387 HG LEU 100 HG LEU 100 -2.603 -6.457 8.040 388 HD11 LEU 100 1HD1 LEU 100 -3.615 -5.143 10.132 389 HD12 LEU 100 2HD1 LEU 100 -2.516 -3.886 9.567 390 HD13 LEU 100 3HD1 LEU 100 -1.888 -5.474 10.008 391 HD21 LEU 100 1HD2 LEU 100 -4.698 -6.192 7.208 392 HD22 LEU 100 2HD2 LEU 100 -4.523 -4.441 7.103 393 HD23 LEU 100 3HD2 LEU 100 -4.988 -5.191 8.631 394 H HIS 101 H HIS 101 -0.419 -6.781 9.082 395 HA HIS 101 HA HIS 101 0.777 -8.600 7.086 396 HB2 HIS 101 2HB HIS 101 0.286 -8.802 10.058 397 HB3 HIS 101 1HB HIS 101 0.879 -10.161 9.100 398 HD1 HIS 101 1HD HIS 101 1.791 -6.450 9.120 399 HD2 HIS 101 2HD HIS 101 3.627 -10.185 9.379 400 HE1 HIS 101 1HE HIS 101 4.284 -6.016 9.216 401 HE2 HIS 101 2HE HIS 101 5.413 -8.283 9.385 402 H SER 102 H SER 102 -0.555 -9.819 5.849 403 HA SER 102 HA SER 102 -3.372 -10.031 6.282 404 HB2 SER 102 2HB SER 102 -1.602 -11.916 4.694 405 HB3 SER 102 1HB SER 102 -3.342 -11.704 4.506 406 HG SER 102 HG SER 102 -1.652 -10.466 3.134 407 H ASP 103 H ASP 103 -0.669 -12.189 7.070 408 HA ASP 103 HA ASP 103 -2.016 -13.289 9.353 409 HB2 ASP 103 2HB ASP 103 -3.218 -14.368 7.298 410 HB3 ASP 103 1HB ASP 103 -1.739 -15.316 7.149 411 H GLU 104 H GLU 104 -0.615 -14.746 10.502 412 HA GLU 104 HA GLU 104 2.186 -14.315 10.006 413 HB2 GLU 104 2HB GLU 104 1.199 -14.769 12.267 414 HB3 GLU 104 1HB GLU 104 0.909 -16.435 11.763 415 HG2 GLU 104 2HG GLU 104 3.349 -16.683 11.302 416 HG3 GLU 104 1HG GLU 104 3.603 -15.053 11.925 417 H HIS 105 H HIS 105 -0.029 -16.991 9.307 418 HA HIS 105 HA HIS 105 1.862 -18.945 8.544 419 HB2 HIS 105 2HB HIS 105 -0.864 -18.370 7.344 420 HB3 HIS 105 1HB HIS 105 0.058 -19.849 7.082 421 HD1 HIS 105 1HD HIS 105 0.777 -21.097 9.463 422 HD2 HIS 105 2HD HIS 105 -2.512 -18.534 9.557 423 HE1 HIS 105 1HE HIS 105 -0.531 -21.682 11.555 424 HE2 HIS 105 2HE HIS 105 -2.534 -20.128 11.621 425 H GLN 106 H GLN 106 0.521 -16.228 6.696 426 HA GLN 106 HA GLN 106 1.714 -16.886 4.187 427 HB2 GLN 106 2HB GLN 106 -0.031 -15.101 4.568 428 HB3 GLN 106 1HB GLN 106 1.234 -14.098 5.281 429 HG2 GLN 106 2HG GLN 106 1.094 -13.439 2.987 430 HG3 GLN 106 1HG GLN 106 2.542 -14.440 3.116 431 HE21 GLN 106 1HE2 GLN 106 2.681 -16.038 1.541 432 HE22 GLN 106 2HE2 GLN 106 1.358 -16.735 0.738 433 H LEU 107 H LEU 107 2.906 -15.042 6.969 434 HA LEU 107 HA LEU 107 5.391 -14.233 5.793 435 HB2 LEU 107 2HB LEU 107 4.460 -13.264 7.896 436 HB3 LEU 107 1HB LEU 107 4.773 -14.795 8.711 437 HG LEU 107 HG LEU 107 7.196 -14.560 8.098 438 HD11 LEU 107 1HD1 LEU 107 6.085 -12.241 6.681 439 HD12 LEU 107 2HD1 LEU 107 7.616 -13.078 6.435 440 HD13 LEU 107 3HD1 LEU 107 7.479 -11.839 7.682 441 HD21 LEU 107 1HD2 LEU 107 5.684 -13.215 10.092 442 HD22 LEU 107 2HD2 LEU 107 6.928 -12.088 9.546 443 HD23 LEU 107 3HD2 LEU 107 7.386 -13.677 10.161 444 H LEU 108 H LEU 108 4.474 -17.060 7.755 445 HA LEU 108 HA LEU 108 7.097 -18.255 7.740 446 HB2 LEU 108 2HB LEU 108 4.388 -19.608 7.988 447 HB3 LEU 108 1HB LEU 108 5.940 -20.298 8.459 448 HG LEU 108 HG LEU 108 4.639 -17.837 9.662 449 HD11 LEU 108 1HD1 LEU 108 5.349 -19.976 11.478 450 HD12 LEU 108 2HD1 LEU 108 4.296 -20.584 10.199 451 HD13 LEU 108 3HD1 LEU 108 3.773 -19.232 11.204 452 HD21 LEU 108 1HD2 LEU 108 6.912 -17.355 9.850 453 HD22 LEU 108 2HD2 LEU 108 7.372 -19.056 9.902 454 HD23 LEU 108 3HD2 LEU 108 6.650 -18.297 11.320 455 H THR 109 H THR 109 4.376 -18.244 5.546 456 HA THR 109 HA THR 109 5.257 -20.422 3.880 457 HB THR 109 HB THR 109 3.458 -18.069 3.223 458 HG1 THR 109 1HG THR 109 3.125 -19.913 5.004 459 HG21 THR 109 1HG2 THR 109 2.813 -20.564 1.949 460 HG22 THR 109 2HG2 THR 109 4.495 -20.144 1.623 461 HG23 THR 109 3HG2 THR 109 3.208 -19.012 1.212 462 H ASN 110 H ASN 110 5.709 -16.908 3.827 463 HA ASN 110 HA ASN 110 7.835 -17.310 1.770 464 HB2 ASN 110 2HB ASN 110 5.926 -14.962 1.838 465 HB3 ASN 110 1HB ASN 110 7.132 -15.322 0.602 466 HD21 ASN 110 1HD2 ASN 110 4.211 -15.092 0.167 467 HD22 ASN 110 2HD2 ASN 110 3.694 -16.600 -0.416 468 HA PRO 111 HA PRO 111 9.236 -15.023 5.678 469 HB2 PRO 111 2HB PRO 111 11.640 -16.657 5.064 470 HB3 PRO 111 1HB PRO 111 10.837 -16.376 6.618 471 HG2 PRO 111 2HG PRO 111 10.645 -18.703 5.312 472 HG3 PRO 111 1HG PRO 111 9.316 -18.048 6.284 473 HD2 PRO 111 2HD PRO 111 9.589 -18.174 3.316 474 HD3 PRO 111 1HD PRO 111 8.129 -18.225 4.325 475 H LYS 112 H LYS 112 10.418 -15.497 2.440 476 HA LYS 112 HA LYS 112 12.534 -13.484 2.659 477 HB2 LYS 112 2HB LYS 112 11.332 -14.884 0.254 478 HB3 LYS 112 1HB LYS 112 12.739 -13.821 0.200 479 HG2 LYS 112 2HG LYS 112 13.882 -15.321 1.839 480 HG3 LYS 112 1HG LYS 112 12.502 -16.417 1.748 481 HD2 LYS 112 2HD LYS 112 12.869 -16.605 -0.718 482 HD3 LYS 112 1HD LYS 112 14.321 -15.618 -0.542 483 HE2 LYS 112 2HE LYS 112 14.955 -17.973 -0.538 484 HE3 LYS 112 1HE LYS 112 15.220 -17.300 1.071 485 HZ1 LYS 112 1HZ LYS 112 13.570 -18.524 1.954 486 HZ2 LYS 112 2HZ LYS 112 13.862 -19.539 0.624 487 HZ3 LYS 112 3HZ LYS 112 12.587 -18.419 0.577 488 H CYS 113 H CYS 113 9.221 -13.287 2.511 489 HA CYS 113 HA CYS 113 8.883 -11.175 0.585 490 HB2 CYS 113 2HB CYS 113 7.224 -12.184 2.890 491 HB3 CYS 113 1HB CYS 113 6.733 -10.762 1.969 492 H SER 114 H SER 114 9.734 -11.199 4.021 493 HA SER 114 HA SER 114 10.234 -8.269 3.784 494 HB2 SER 114 2HB SER 114 8.228 -9.539 5.432 495 HB3 SER 114 1HB SER 114 9.409 -8.708 6.440 496 HG SER 114 HG SER 114 8.476 -6.934 5.841 497 H TYR 115 H TYR 115 11.904 -10.864 3.959 498 HA TYR 115 HA TYR 115 13.224 -10.797 6.518 499 HB2 TYR 115 2HB TYR 115 14.709 -12.366 5.641 500 HB3 TYR 115 1HB TYR 115 13.290 -12.620 4.631 501 HD1 TYR 115 1HD TYR 115 16.776 -11.812 4.676 502 HD2 TYR 115 2HD TYR 115 13.170 -11.302 2.401 503 HE1 TYR 115 1HE TYR 115 18.123 -11.290 2.659 504 HE2 TYR 115 2HE TYR 115 14.515 -10.778 0.385 505 HH TYR 115 HH TYR 115 17.042 -11.428 -0.357 506 H ILE 116 H ILE 116 13.462 -8.853 3.657 507 HA ILE 116 HA ILE 116 16.037 -7.669 4.524 508 HB ILE 116 HB ILE 116 15.339 -6.144 2.419 509 HG12 ILE 116 2HG1 ILE 116 14.139 -7.515 0.763 510 HG13 ILE 116 1HG1 ILE 116 13.924 -8.791 1.959 511 HG21 ILE 116 1HG2 ILE 116 16.689 -8.790 2.660 512 HG22 ILE 116 2HG2 ILE 116 17.340 -7.240 2.131 513 HG23 ILE 116 3HG2 ILE 116 16.351 -8.202 1.034 514 HD11 ILE 116 1HD1 ILE 116 12.409 -7.528 3.225 515 HD12 ILE 116 2HD1 ILE 116 11.990 -7.064 1.577 516 HD13 ILE 116 3HD1 ILE 116 12.988 -5.998 2.564 517 HA PRO 117 HA PRO 117 14.656 -4.170 6.813 518 HB2 PRO 117 2HB PRO 117 15.626 -2.513 4.513 519 HB3 PRO 117 1HB PRO 117 15.927 -2.316 6.250 520 HG2 PRO 117 2HG PRO 117 17.734 -3.398 4.571 521 HG3 PRO 117 1HG PRO 117 17.599 -3.861 6.273 522 HD2 PRO 117 2HD PRO 117 16.943 -5.437 3.883 523 HD3 PRO 117 1HD PRO 117 17.151 -5.978 5.561 524 HA PRO 118 HA PRO 118 10.858 -3.539 4.295 525 HB2 PRO 118 2HB PRO 118 9.067 -3.908 6.289 526 HB3 PRO 118 1HB PRO 118 9.862 -5.267 5.472 527 HG2 PRO 118 2HG PRO 118 10.381 -4.105 8.145 528 HG3 PRO 118 1HG PRO 118 10.518 -5.781 7.592 529 HD2 PRO 118 2HD PRO 118 12.654 -3.976 7.905 530 HD3 PRO 118 1HD PRO 118 12.711 -5.513 7.020 531 H CYS 119 H CYS 119 9.509 -1.676 4.131 532 HA CYS 119 HA CYS 119 10.190 0.509 6.031 533 HB2 CYS 119 2HB CYS 119 8.833 1.791 4.109 534 HB3 CYS 119 1HB CYS 119 10.550 1.425 3.942 535 H LYS 120 H LYS 120 8.733 0.585 7.691 536 HA LYS 120 HA LYS 120 5.837 0.537 6.969 537 HB2 LYS 120 2HB LYS 120 5.336 -0.852 8.898 538 HB3 LYS 120 1HB LYS 120 6.552 -1.672 7.921 539 HG2 LYS 120 2HG LYS 120 8.323 -0.696 9.407 540 HG3 LYS 120 1HG LYS 120 7.043 -0.064 10.440 541 HD2 LYS 120 2HD LYS 120 6.165 -2.432 10.635 542 HD3 LYS 120 1HD LYS 120 7.640 -2.967 9.829 543 HE2 LYS 120 2HE LYS 120 9.010 -1.996 11.597 544 HE3 LYS 120 1HE LYS 120 7.579 -1.322 12.375 545 HZ1 LYS 120 1HZ LYS 120 8.019 -3.289 13.521 546 HZ2 LYS 120 2HZ LYS 120 8.356 -4.162 12.103 547 HZ3 LYS 120 3HZ LYS 120 6.758 -3.706 12.464 548 H ARG 121 H ARG 121 4.637 2.098 8.032 549 HA ARG 121 HA ARG 121 6.040 4.181 9.448 550 HB2 ARG 121 2HB ARG 121 3.087 3.613 9.083 551 HB3 ARG 121 1HB ARG 121 3.719 5.063 9.858 552 HG2 ARG 121 2HG ARG 121 5.015 5.565 7.787 553 HG3 ARG 121 1HG ARG 121 4.263 4.169 7.015 554 HD2 ARG 121 2HD ARG 121 2.808 6.589 8.125 555 HD3 ARG 121 1HD ARG 121 3.044 6.214 6.419 556 HE ARG 121 HE ARG 121 1.765 3.973 7.279 557 HH11 ARG 121 1HH1 ARG 121 -0.473 3.749 7.499 558 HH12 ARG 121 2HH1 ARG 121 -1.446 5.150 7.802 559 HH21 ARG 121 1HH2 ARG 121 1.241 7.340 7.806 560 HH22 ARG 121 2HH2 ARG 121 -0.474 7.184 7.976 561 H GLU 122 H GLU 122 3.969 1.477 10.446 562 HA GLU 122 HA GLU 122 4.945 1.895 13.221 563 HB2 GLU 122 2HB GLU 122 2.067 1.272 12.497 564 HB3 GLU 122 1HB GLU 122 2.713 1.513 14.121 565 HG2 GLU 122 2HG GLU 122 3.370 3.829 13.476 566 HG3 GLU 122 1HG GLU 122 2.605 3.575 11.907 567 H ASN 123 H ASN 123 4.935 -0.077 14.486 568 HA ASN 123 HA ASN 123 5.707 -2.422 13.092 569 HB2 ASN 123 2HB ASN 123 4.439 -2.295 15.844 570 HB3 ASN 123 1HB ASN 123 5.504 -3.562 15.230 571 HD21 ASN 123 1HD2 ASN 123 5.429 -0.109 16.138 572 HD22 ASN 123 2HD2 ASN 123 7.101 0.026 16.407 573 H GLN 124 H GLN 124 2.577 -1.280 14.199 574 HA GLN 124 HA GLN 124 0.408 -2.030 13.740 575 HB2 GLN 124 2HB GLN 124 1.333 -1.844 11.389 576 HB3 GLN 124 1HB GLN 124 1.686 -3.571 11.471 577 HG2 GLN 124 2HG GLN 124 -0.462 -3.381 10.434 578 HG3 GLN 124 1HG GLN 124 -0.760 -3.918 12.087 579 HE21 GLN 124 1HE2 GLN 124 -2.364 -2.741 13.134 580 HE22 GLN 124 2HE2 GLN 124 -2.781 -1.132 12.784 581 H LYS 125 H LYS 125 -0.083 -3.344 15.463 582 HA LYS 125 HA LYS 125 1.034 -6.007 15.782 583 HB2 LYS 125 2HB LYS 125 -0.524 -6.197 17.660 584 HB3 LYS 125 1HB LYS 125 0.255 -4.616 17.699 585 HG2 LYS 125 2HG LYS 125 -1.728 -3.672 16.487 586 HG3 LYS 125 1HG LYS 125 -2.514 -5.244 16.644 587 HD2 LYS 125 2HD LYS 125 -2.211 -5.077 19.133 588 HD3 LYS 125 1HD LYS 125 -1.612 -3.434 18.901 589 HE2 LYS 125 2HE LYS 125 -4.243 -4.188 17.680 590 HE3 LYS 125 1HE LYS 125 -4.174 -3.862 19.411 591 HZ1 LYS 125 1HZ LYS 125 -2.918 -1.766 18.722 592 HZ2 LYS 125 2HZ LYS 125 -4.598 -1.802 18.465 593 HZ3 LYS 125 3HZ LYS 125 -3.532 -2.055 17.167 594 H ASN 126 H ASN 126 -0.165 -8.013 15.573 595 HA ASN 126 HA ASN 126 -2.270 -7.843 13.469 596 HB2 ASN 126 2HB ASN 126 -0.513 -10.151 14.356 597 HB3 ASN 126 1HB ASN 126 -1.744 -10.254 13.095 598 HD21 ASN 126 1HD2 ASN 126 1.025 -10.719 12.508 599 HD22 ASN 126 2HD2 ASN 126 1.576 -9.465 11.506 600 H LEU 127 H LEU 127 -4.328 -8.216 14.064 601 HA LEU 127 HA LEU 127 -4.881 -10.072 16.313 602 HB2 LEU 127 2HB LEU 127 -5.992 -7.268 16.024 603 HB3 LEU 127 1HB LEU 127 -6.648 -8.472 17.130 604 HG LEU 127 HG LEU 127 -3.777 -7.493 17.146 605 HD11 LEU 127 1HD1 LEU 127 -5.731 -5.911 17.878 606 HD12 LEU 127 2HD1 LEU 127 -4.339 -6.095 18.943 607 HD13 LEU 127 3HD1 LEU 127 -5.830 -6.972 19.283 608 HD21 LEU 127 1HD2 LEU 127 -4.287 -8.637 19.575 609 HD22 LEU 127 2HD2 LEU 127 -3.539 -9.493 18.228 610 HD23 LEU 127 3HD2 LEU 127 -5.270 -9.649 18.519 611 H GLU 128 H GLU 128 -7.410 -10.422 16.368 612 HA GLU 128 HA GLU 128 -8.181 -11.576 13.894 613 HB2 GLU 128 2HB GLU 128 -9.906 -10.670 16.219 614 HB3 GLU 128 1HB GLU 128 -10.459 -11.709 14.904 615 HG2 GLU 128 2HG GLU 128 -8.690 -13.354 15.487 616 HG3 GLU 128 1HG GLU 128 -8.212 -12.330 16.843 617 H SER 129 H SER 129 -8.681 -8.348 15.203 618 HA SER 129 HA SER 129 -10.706 -7.443 13.433 619 HB2 SER 129 2HB SER 129 -8.366 -5.836 14.503 620 HB3 SER 129 1HB SER 129 -9.898 -5.191 13.921 621 HG SER 129 HG SER 129 -10.797 -5.710 15.756 622 H VAL 130 H VAL 130 -7.225 -7.811 13.003 623 HA VAL 130 HA VAL 130 -6.968 -6.373 10.555 624 HB VAL 130 HB VAL 130 -5.456 -8.779 11.609 625 HG11 VAL 130 1HG1 VAL 130 -4.621 -8.933 9.510 626 HG12 VAL 130 2HG1 VAL 130 -3.810 -7.403 9.845 627 HG13 VAL 130 3HG1 VAL 130 -5.369 -7.413 9.021 628 HG21 VAL 130 1HG2 VAL 130 -5.046 -6.952 13.043 629 HG22 VAL 130 2HG2 VAL 130 -5.103 -5.787 11.725 630 HG23 VAL 130 3HG2 VAL 130 -3.715 -6.861 11.890 631 H MET 131 H MET 131 -7.932 -9.736 11.222 632 HA MET 131 HA MET 131 -7.987 -10.657 8.537 633 HB2 MET 131 2HB MET 131 -8.366 -12.114 10.536 634 HB3 MET 131 1HB MET 131 -9.948 -11.360 10.745 635 HG2 MET 131 2HG MET 131 -9.872 -12.105 8.045 636 HG3 MET 131 1HG MET 131 -9.152 -13.467 8.907 637 HE1 MET 131 1HE MET 131 -12.067 -11.191 8.274 638 HE2 MET 131 2HE MET 131 -13.437 -12.263 8.545 639 HE3 MET 131 3HE MET 131 -12.230 -12.679 7.332 640 H ASN 132 H ASN 132 -10.311 -8.787 10.426 641 HA ASN 132 HA ASN 132 -12.469 -8.798 8.577 642 HB2 ASN 132 2HB ASN 132 -12.461 -7.874 10.956 643 HB3 ASN 132 1HB ASN 132 -11.684 -6.435 10.298 644 HD21 ASN 132 1HD2 ASN 132 -14.053 -5.797 11.345 645 HD22 ASN 132 2HD2 ASN 132 -15.275 -5.651 10.175 646 H TRP 133 H TRP 133 -9.548 -6.783 8.739 647 HA TRP 133 HA TRP 133 -10.269 -4.877 6.761 648 HB2 TRP 133 2HB TRP 133 -8.270 -4.172 7.557 649 HB3 TRP 133 1HB TRP 133 -7.787 -5.802 8.022 650 HD1 TRP 133 HD TRP 133 -6.761 -7.376 6.043 651 HE1 TRP 133 1HE TRP 133 -5.428 -6.727 3.936 652 HE3 TRP 133 3HE TRP 133 -7.908 -2.405 5.767 653 HZ2 TRP 133 2HZ TRP 133 -4.915 -4.409 2.344 654 HZ3 TRP 133 3HZ TRP 133 -6.983 -1.003 3.945 655 HH2 TRP 133 HH TRP 133 -5.490 -2.000 2.236 656 H GLN 134 H GLN 134 -8.745 -8.077 6.421 657 HA GLN 134 HA GLN 134 -8.326 -7.971 3.611 658 HB2 GLN 134 2HB GLN 134 -7.451 -9.746 5.162 659 HB3 GLN 134 1HB GLN 134 -9.083 -10.408 5.243 660 HG2 GLN 134 2HG GLN 134 -8.778 -10.223 2.551 661 HG3 GLN 134 1HG GLN 134 -7.108 -10.521 3.038 662 HE21 GLN 134 1HE2 GLN 134 -10.427 -11.803 3.523 663 HE22 GLN 134 2HE2 GLN 134 -9.937 -13.409 3.766 664 H GLN 135 H GLN 135 -11.109 -8.994 5.534 665 HA GLN 135 HA GLN 135 -12.750 -9.809 3.330 666 HB2 GLN 135 2HB GLN 135 -13.089 -10.397 5.768 667 HB3 GLN 135 1HB GLN 135 -13.691 -8.757 6.007 668 HG2 GLN 135 2HG GLN 135 -15.610 -10.147 5.630 669 HG3 GLN 135 1HG GLN 135 -15.362 -9.214 4.153 670 HE21 GLN 135 1HE2 GLN 135 -16.159 -10.745 2.623 671 HE22 GLN 135 2HE2 GLN 135 -15.464 -12.278 2.393 672 H TYR 136 H TYR 136 -12.229 -6.696 4.918 673 HA TYR 136 HA TYR 136 -14.470 -5.303 3.904 674 HB2 TYR 136 2HB TYR 136 -13.016 -4.319 5.593 675 HB3 TYR 136 1HB TYR 136 -11.679 -4.259 4.442 676 HD1 TYR 136 1HD TYR 136 -11.881 -2.839 2.374 677 HD2 TYR 136 2HD TYR 136 -14.723 -2.640 5.591 678 HE1 TYR 136 1HE TYR 136 -12.700 -0.666 1.511 679 HE2 TYR 136 2HE TYR 136 -15.541 -0.461 4.730 680 HH TYR 136 HH TYR 136 -14.386 0.852 1.660 681 H TRP 137 H TRP 137 -11.170 -5.427 2.418 682 HA TRP 137 HA TRP 137 -12.303 -4.106 0.055 683 HB2 TRP 137 2HB TRP 137 -9.969 -4.341 -0.875 684 HB3 TRP 137 1HB TRP 137 -10.084 -3.412 0.614 685 HD1 TRP 137 HD TRP 137 -8.737 -4.227 2.626 686 HE1 TRP 137 1HE TRP 137 -7.188 -6.237 3.080 687 HE3 TRP 137 3HE TRP 137 -9.667 -6.987 -1.541 688 HZ2 TRP 137 2HZ TRP 137 -6.447 -8.702 1.825 689 HZ3 TRP 137 3HZ TRP 137 -8.533 -9.164 -1.901 690 HH2 TRP 137 HH TRP 137 -6.923 -10.024 -0.222 691 H LYS 138 H LYS 138 -11.417 -7.380 0.995 692 HA LYS 138 HA LYS 138 -11.340 -8.519 -1.614 693 HB2 LYS 138 2HB LYS 138 -10.735 -9.732 0.498 694 HB3 LYS 138 1HB LYS 138 -12.451 -9.807 0.898 695 HG2 LYS 138 2HG LYS 138 -12.873 -11.019 -1.231 696 HG3 LYS 138 1HG LYS 138 -11.142 -10.998 -1.564 697 HD2 LYS 138 2HD LYS 138 -10.764 -12.204 0.599 698 HD3 LYS 138 1HD LYS 138 -12.513 -12.339 0.781 699 HE2 LYS 138 2HE LYS 138 -12.724 -13.762 -1.082 700 HE3 LYS 138 1HE LYS 138 -11.153 -13.293 -1.732 701 HZ1 LYS 138 1HZ LYS 138 -11.177 -14.508 0.916 702 HZ2 LYS 138 2HZ LYS 138 -10.056 -14.679 -0.348 703 HZ3 LYS 138 3HZ LYS 138 -11.525 -15.531 -0.391 704 H ASP 139 H ASP 139 -14.083 -7.937 0.574 705 HA ASP 139 HA ASP 139 -16.053 -9.041 -1.225 706 HB2 ASP 139 2HB ASP 139 -16.310 -7.078 1.067 707 HB3 ASP 139 1HB ASP 139 -17.679 -7.799 0.222 708 H GLU 140 H GLU 140 -14.921 -5.711 -0.606 709 HA GLU 140 HA GLU 140 -16.729 -4.594 -2.601 710 HB2 GLU 140 2HB GLU 140 -14.341 -3.406 -1.160 711 HB3 GLU 140 1HB GLU 140 -15.431 -2.495 -2.205 712 HG2 GLU 140 2HG GLU 140 -16.280 -4.019 0.275 713 HG3 GLU 140 1HG GLU 140 -16.047 -2.273 0.192 714 H ILE 141 H ILE 141 -13.189 -4.982 -2.410 715 HA ILE 141 HA ILE 141 -13.177 -5.223 -5.368 716 HB ILE 141 HB ILE 141 -10.944 -3.951 -5.269 717 HG12 ILE 141 2HG1 ILE 141 -11.824 -2.411 -2.964 718 HG13 ILE 141 1HG1 ILE 141 -11.494 -4.084 -2.524 719 HG21 ILE 141 1HG2 ILE 141 -12.430 -1.733 -4.788 720 HG22 ILE 141 2HG2 ILE 141 -13.711 -2.918 -5.041 721 HG23 ILE 141 3HG2 ILE 141 -12.505 -2.641 -6.297 722 HD11 ILE 141 1HD1 ILE 141 -9.495 -2.501 -2.420 723 HD12 ILE 141 2HD1 ILE 141 -9.576 -2.438 -4.181 724 HD13 ILE 141 3HD1 ILE 141 -9.260 -3.970 -3.366 725 H GLY 142 H GLY 142 -12.452 -7.257 -5.764 726 HA2 GLY 142 2HA GLY 142 -10.915 -8.772 -3.850 727 HA3 GLY 142 1HA GLY 142 -11.235 -9.252 -5.517 728 H SER 143 H SER 143 -8.908 -7.971 -3.363 729 HA SER 143 HA SER 143 -6.777 -6.981 -3.736 730 HB2 SER 143 2HB SER 143 -5.443 -8.592 -5.255 731 HB3 SER 143 1HB SER 143 -6.169 -9.260 -3.797 732 HG SER 143 HG SER 143 -8.047 -9.627 -5.339 733 H GLN 144 H GLN 144 -7.984 -5.143 -4.965 734 HA GLN 144 HA GLN 144 -6.853 -5.023 -7.720 735 HB2 GLN 144 2HB GLN 144 -9.636 -4.840 -6.893 736 HB3 GLN 144 1HB GLN 144 -9.119 -3.398 -7.768 737 HG2 GLN 144 2HG GLN 144 -8.194 -4.883 -9.560 738 HG3 GLN 144 1HG GLN 144 -8.875 -6.270 -8.709 739 HE21 GLN 144 1HE2 GLN 144 -9.790 -3.221 -10.354 740 HE22 GLN 144 2HE2 GLN 144 -11.384 -3.696 -10.689 741 HA PRO 145 HA PRO 145 -5.169 -1.555 -5.119 742 HB2 PRO 145 2HB PRO 145 -3.322 -1.476 -7.444 743 HB3 PRO 145 1HB PRO 145 -2.955 -1.497 -5.712 744 HG2 PRO 145 2HG PRO 145 -2.608 -3.633 -7.318 745 HG3 PRO 145 1HG PRO 145 -2.989 -3.765 -5.597 746 HD2 PRO 145 2HD PRO 145 -4.716 -4.299 -7.943 747 HD3 PRO 145 1HD PRO 145 -4.831 -4.939 -6.290 748 H PHE 146 H PHE 146 -5.205 0.753 -5.569 749 HA PHE 146 HA PHE 146 -6.149 1.535 -8.254 750 HB2 PHE 146 2HB PHE 146 -7.894 2.995 -7.251 751 HB3 PHE 146 1HB PHE 146 -8.199 1.283 -6.984 752 HD1 PHE 146 1HD PHE 146 -7.060 0.355 -4.693 753 HD2 PHE 146 2HD PHE 146 -8.166 4.431 -5.492 754 HE1 PHE 146 1HE PHE 146 -7.205 0.799 -2.261 755 HE2 PHE 146 2HE PHE 146 -8.308 4.870 -3.060 756 HZ PHE 146 HZ PHE 146 -7.825 3.054 -1.442 757 H THR 147 H THR 147 -5.882 3.816 -8.709 758 HA THR 147 HA THR 147 -3.870 5.123 -6.930 759 HB THR 147 HB THR 147 -2.814 6.050 -8.924 760 HG1 THR 147 1HG THR 147 -3.841 6.045 -10.738 761 HG21 THR 147 1HG2 THR 147 -1.645 4.136 -8.596 762 HG22 THR 147 2HG2 THR 147 -2.458 3.603 -10.067 763 HG23 THR 147 3HG2 THR 147 -3.102 3.149 -8.489 764 H CYS 148 H CYS 148 -3.944 7.450 -6.965 765 HA CYS 148 HA CYS 148 -6.419 8.619 -8.066 766 HB2 CYS 148 2HB CYS 148 -6.298 9.932 -5.693 767 HB3 CYS 148 1HB CYS 148 -7.282 8.493 -5.945 768 H TYR 149 H TYR 149 -6.310 10.987 -8.159 769 HA TYR 149 HA TYR 149 -3.592 12.167 -7.861 770 HB2 TYR 149 2HB TYR 149 -5.181 12.135 -10.446 771 HB3 TYR 149 1HB TYR 149 -3.808 13.196 -10.153 772 HD1 TYR 149 1HD TYR 149 -4.808 9.587 -10.190 773 HD2 TYR 149 2HD TYR 149 -1.611 12.437 -10.486 774 HE1 TYR 149 1HE TYR 149 -3.251 7.771 -10.832 775 HE2 TYR 149 2HE TYR 149 -0.050 10.619 -11.125 776 HH TYR 149 HH TYR 149 -1.107 7.535 -12.053 777 H PHE 150 H PHE 150 -3.794 14.254 -7.062 778 HA PHE 150 HA PHE 150 -6.380 15.624 -7.497 779 HB2 PHE 150 2HB PHE 150 -7.078 15.450 -5.360 780 HB3 PHE 150 1HB PHE 150 -5.791 14.274 -5.117 781 HD1 PHE 150 1HD PHE 150 -3.666 14.915 -4.099 782 HD2 PHE 150 2HD PHE 150 -6.814 17.773 -4.678 783 HE1 PHE 150 1HE PHE 150 -2.525 16.478 -2.555 784 HE2 PHE 150 2HE PHE 150 -5.686 19.347 -3.127 785 HZ PHE 150 HZ PHE 150 -3.535 18.692 -2.061 786 H ASN 151 H ASN 151 -6.229 17.855 -7.557 787 HA ASN 151 HA ASN 151 -3.631 19.070 -6.787 788 HB2 ASN 151 2HB ASN 151 -3.318 20.116 -8.930 789 HB3 ASN 151 1HB ASN 151 -3.562 18.396 -9.218 790 HD21 ASN 151 1HD2 ASN 151 -4.131 20.474 -11.188 791 HD22 ASN 151 2HD2 ASN 151 -5.801 20.436 -11.490 792 H GLN 152 H GLN 152 -3.896 21.013 -5.858 793 HA GLN 152 HA GLN 152 -6.589 22.217 -5.748 794 HB2 GLN 152 2HB GLN 152 -5.258 21.946 -3.658 795 HB3 GLN 152 1HB GLN 152 -4.011 22.990 -4.336 796 HG2 GLN 152 2HG GLN 152 -5.526 24.871 -4.404 797 HG3 GLN 152 1HG GLN 152 -6.891 23.852 -3.954 798 HE21 GLN 152 1HE2 GLN 152 -6.452 25.994 -2.288 799 HE22 GLN 152 2HE2 GLN 152 -5.743 25.495 -0.830 800 H HIS 153 H HIS 153 -3.886 22.376 -7.679 801 HA HIS 153 HA HIS 153 -3.311 25.056 -8.131 802 HB2 HIS 153 2HB HIS 153 -3.602 22.775 -10.100 803 HB3 HIS 153 1HB HIS 153 -2.941 24.349 -10.536 804 HD1 HIS 153 1HD HIS 153 -0.486 24.610 -10.207 805 HD2 HIS 153 2HD HIS 153 -2.041 21.594 -7.777 806 HE1 HIS 153 1HE HIS 153 1.486 23.563 -9.007 807 HE2 HIS 153 2HE HIS 153 0.552 21.726 -7.531 808 H GLN 154 H GLN 154 -6.189 23.256 -9.138 809 HA GLN 154 HA GLN 154 -7.216 25.335 -10.855 810 HB2 GLN 154 2HB GLN 154 -8.613 23.098 -9.356 811 HB3 GLN 154 1HB GLN 154 -9.386 24.125 -10.560 812 HG2 GLN 154 2HG GLN 154 -7.788 23.375 -12.263 813 HG3 GLN 154 1HG GLN 154 -6.959 22.383 -11.064 814 HE21 GLN 154 1HE2 GLN 154 -8.115 21.194 -13.392 815 HE22 GLN 154 2HE2 GLN 154 -9.431 20.237 -12.912 816 H ARG 155 H ARG 155 -8.515 24.267 -7.707 817 HA ARG 155 HA ARG 155 -8.367 26.887 -6.535 818 HB2 ARG 155 2HB ARG 155 -10.550 26.585 -8.274 819 HB3 ARG 155 1HB ARG 155 -11.224 26.369 -6.658 820 HG2 ARG 155 2HG ARG 155 -11.325 28.705 -7.027 821 HG3 ARG 155 1HG ARG 155 -9.916 28.474 -5.996 822 HD2 ARG 155 2HD ARG 155 -8.407 28.794 -7.793 823 HD3 ARG 155 1HD ARG 155 -9.662 28.540 -9.005 824 HE ARG 155 HE ARG 155 -10.164 30.847 -7.289 825 HH11 ARG 155 1HH1 ARG 155 -10.070 32.854 -8.327 826 HH12 ARG 155 2HH1 ARG 155 -9.355 32.968 -9.900 827 HH21 ARG 155 1HH2 ARG 155 -8.603 29.588 -10.093 828 HH22 ARG 155 2HH2 ARG 155 -8.524 31.119 -10.899 829 HA PRO 156 HA PRO 156 -10.359 23.851 -3.542 830 HB2 PRO 156 2HB PRO 156 -11.984 21.893 -4.390 831 HB3 PRO 156 1HB PRO 156 -12.484 23.593 -4.458 832 HG2 PRO 156 2HG PRO 156 -11.756 21.777 -6.646 833 HG3 PRO 156 1HG PRO 156 -12.713 23.266 -6.685 834 HD2 PRO 156 2HD PRO 156 -9.878 22.916 -7.300 835 HD3 PRO 156 1HD PRO 156 -10.890 24.354 -7.525 836 H ASP 157 H ASP 157 -10.765 20.944 -5.323 837 HA ASP 157 HA ASP 157 -8.044 19.965 -5.067 838 HB2 ASP 157 2HB ASP 157 -8.546 18.277 -3.317 839 HB3 ASP 157 1HB ASP 157 -8.709 19.920 -2.700 840 H ASP 158 H ASP 158 -8.923 19.658 -7.375 841 HA ASP 158 HA ASP 158 -10.996 17.838 -8.013 842 HB2 ASP 158 2HB ASP 158 -9.647 19.211 -9.667 843 HB3 ASP 158 1HB ASP 158 -8.343 18.039 -9.475 844 H VAL 159 H VAL 159 -10.909 15.485 -8.352 845 HA VAL 159 HA VAL 159 -8.501 14.174 -7.169 846 HB VAL 159 HB VAL 159 -10.240 14.408 -5.412 847 HG11 VAL 159 1HG1 VAL 159 -11.884 12.632 -7.241 848 HG12 VAL 159 2HG1 VAL 159 -12.186 14.349 -6.974 849 HG13 VAL 159 3HG1 VAL 159 -12.354 13.206 -5.641 850 HG21 VAL 159 1HG2 VAL 159 -8.822 12.110 -6.179 851 HG22 VAL 159 2HG2 VAL 159 -10.449 11.535 -5.812 852 HG23 VAL 159 3HG2 VAL 159 -9.533 12.424 -4.596 853 H LEU 160 H LEU 160 -8.056 12.107 -7.945 854 HA LEU 160 HA LEU 160 -9.754 11.168 -10.231 855 HB2 LEU 160 2HB LEU 160 -7.400 12.000 -10.801 856 HB3 LEU 160 1HB LEU 160 -6.798 10.632 -9.875 857 HG LEU 160 HG LEU 160 -8.162 9.109 -11.321 858 HD11 LEU 160 1HD1 LEU 160 -9.820 10.131 -12.480 859 HD12 LEU 160 2HD1 LEU 160 -8.558 10.605 -13.618 860 HD13 LEU 160 3HD1 LEU 160 -9.054 11.713 -12.339 861 HD21 LEU 160 1HD2 LEU 160 -5.775 10.585 -12.006 862 HD22 LEU 160 2HD2 LEU 160 -6.673 10.191 -13.469 863 HD23 LEU 160 3HD2 LEU 160 -6.176 8.907 -12.368 864 H LEU 161 H LEU 161 -10.103 8.863 -10.322 865 HA LEU 161 HA LEU 161 -9.062 7.307 -8.003 866 HB2 LEU 161 2HB LEU 161 -11.373 8.203 -7.507 867 HB3 LEU 161 1HB LEU 161 -11.963 7.228 -8.854 868 HG LEU 161 HG LEU 161 -10.549 5.340 -7.555 869 HD11 LEU 161 1HD1 LEU 161 -10.596 5.596 -5.202 870 HD12 LEU 161 2HD1 LEU 161 -11.691 6.976 -5.289 871 HD13 LEU 161 3HD1 LEU 161 -10.012 7.151 -5.795 872 HD21 LEU 161 1HD2 LEU 161 -13.364 6.268 -6.908 873 HD22 LEU 161 2HD2 LEU 161 -12.713 4.682 -6.494 874 HD23 LEU 161 3HD2 LEU 161 -12.896 5.146 -8.186 875 H HIS 162 H HIS 162 -7.805 6.715 -10.180 876 HA HIS 162 HA HIS 162 -9.215 4.914 -11.985 877 HB2 HIS 162 2HB HIS 162 -6.269 5.464 -11.530 878 HB3 HIS 162 1HB HIS 162 -6.869 4.343 -12.753 879 HD1 HIS 162 1HD HIS 162 -5.388 6.632 -13.913 880 HD2 HIS 162 2HD HIS 162 -9.444 6.946 -12.989 881 HE1 HIS 162 1HE HIS 162 -6.299 8.536 -15.316 882 HE2 HIS 162 2HE HIS 162 -8.765 8.734 -14.761 883 H ARG 163 H ARG 163 -8.878 2.583 -12.082 884 HA ARG 163 HA ARG 163 -8.093 1.419 -9.435 885 HB2 ARG 163 2HB ARG 163 -10.147 0.450 -11.440 886 HB3 ARG 163 1HB ARG 163 -9.691 -0.414 -9.972 887 HG2 ARG 163 2HG ARG 163 -10.372 1.581 -8.633 888 HG3 ARG 163 1HG ARG 163 -10.928 2.351 -10.120 889 HD2 ARG 163 2HD ARG 163 -12.431 0.359 -10.494 890 HD3 ARG 163 1HD ARG 163 -11.985 -0.204 -8.883 891 HE ARG 163 HE ARG 163 -13.405 1.448 -7.980 892 HH11 ARG 163 1HH1 ARG 163 -14.830 3.194 -8.153 893 HH12 ARG 163 2HH1 ARG 163 -14.948 4.055 -9.653 894 HH21 ARG 163 1HH2 ARG 163 -12.595 2.086 -11.270 895 HH22 ARG 163 2HH2 ARG 163 -13.682 3.427 -11.417 896 H THR 164 H THR 164 -6.981 -0.620 -9.474 897 HA THR 164 HA THR 164 -5.300 -0.975 -11.869 898 HB THR 164 HB THR 164 -5.225 -2.501 -9.258 899 HG1 THR 164 1HG THR 164 -4.876 -0.053 -9.398 900 HG21 THR 164 1HG2 THR 164 -2.909 -2.986 -9.959 901 HG22 THR 164 2HG2 THR 164 -3.181 -2.100 -11.458 902 HG23 THR 164 3HG2 THR 164 -4.073 -3.587 -11.141 903 H HIS 165 H HIS 165 -5.395 -2.754 -13.225 904 HA HIS 165 HA HIS 165 -7.581 -4.725 -12.665 905 HB2 HIS 165 2HB HIS 165 -6.528 -3.735 -15.334 906 HB3 HIS 165 1HB HIS 165 -7.781 -4.960 -15.124 907 HD1 HIS 165 1HD HIS 165 -9.931 -4.071 -13.626 908 HD2 HIS 165 2HD HIS 165 -7.546 -1.165 -15.437 909 HE1 HIS 165 1HE HIS 165 -11.302 -1.940 -13.667 910 HE2 HIS 165 2HE HIS 165 -9.859 -0.165 -14.766 911 H ASP 166 H ASP 166 -7.026 -6.884 -12.742 912 HA ASP 166 HA ASP 166 -4.200 -7.561 -12.767 913 HB2 ASP 166 2HB ASP 166 -5.892 -8.738 -11.348 914 HB3 ASP 166 1HB ASP 166 -6.601 -9.415 -12.816 Start of MODEL 4 1 H1 GLN 45 1HT GLN 45 6.793 15.510 0.745 2 H2 GLN 45 2HT GLN 45 5.489 14.453 1.004 3 H3 GLN 45 3HT GLN 45 5.900 15.605 2.183 4 HA GLN 45 HA GLN 45 3.937 15.963 0.442 5 HB2 GLN 45 2HB GLN 45 5.848 18.059 1.523 6 HB3 GLN 45 1HB GLN 45 4.238 18.401 0.885 7 HG2 GLN 45 2HG GLN 45 3.228 16.965 2.600 8 HG3 GLN 45 1HG GLN 45 4.828 16.563 3.223 9 HE21 GLN 45 1HE2 GLN 45 2.902 17.829 4.904 10 HE22 GLN 45 2HE2 GLN 45 3.432 19.407 5.243 11 H ASP 46 H ASP 46 3.708 16.289 -1.721 12 HA ASP 46 HA ASP 46 6.022 16.481 -3.447 13 HB2 ASP 46 2HB ASP 46 3.059 16.821 -4.006 14 HB3 ASP 46 1HB ASP 46 4.305 16.770 -5.254 15 H LEU 47 H LEU 47 6.642 18.311 -4.744 16 HA LEU 47 HA LEU 47 6.628 20.819 -3.462 17 HB2 LEU 47 2HB LEU 47 6.809 20.311 -6.449 18 HB3 LEU 47 1HB LEU 47 7.387 21.746 -5.598 19 HG LEU 47 HG LEU 47 8.399 18.915 -5.202 20 HD11 LEU 47 1HD1 LEU 47 9.295 21.266 -6.792 21 HD12 LEU 47 2HD1 LEU 47 9.505 19.545 -7.113 22 HD13 LEU 47 3HD1 LEU 47 10.547 20.358 -5.945 23 HD21 LEU 47 1HD2 LEU 47 8.699 19.874 -3.102 24 HD22 LEU 47 2HD2 LEU 47 8.843 21.505 -3.754 25 HD23 LEU 47 3HD2 LEU 47 10.188 20.375 -3.904 26 H GLN 48 H GLN 48 4.378 19.452 -5.819 27 HA GLN 48 HA GLN 48 2.453 21.591 -5.084 28 HB2 GLN 48 2HB GLN 48 3.672 21.167 -7.730 29 HB3 GLN 48 1HB GLN 48 1.910 21.237 -7.759 30 HG2 GLN 48 2HG GLN 48 3.611 23.288 -6.325 31 HG3 GLN 48 1HG GLN 48 3.080 23.481 -7.997 32 HE21 GLN 48 1HE2 GLN 48 0.850 21.735 -6.014 33 HE22 GLN 48 2HE2 GLN 48 -0.246 23.003 -5.750 34 H ALA 49 H ALA 49 0.246 20.937 -5.320 35 HA ALA 49 HA ALA 49 -0.244 18.129 -4.907 36 HB1 ALA 49 1HB ALA 49 -1.765 19.684 -3.918 37 HB2 ALA 49 2HB ALA 49 -2.673 18.868 -5.192 38 HB3 ALA 49 3HB ALA 49 -2.041 20.494 -5.457 39 H THR 50 H THR 50 -0.876 16.554 -6.392 40 HA THR 50 HA THR 50 -1.940 17.157 -8.996 41 HB THR 50 HB THR 50 0.934 16.207 -8.974 42 HG1 THR 50 1HG THR 50 1.103 18.306 -8.513 43 HG21 THR 50 1HG2 THR 50 -0.255 17.354 -11.406 44 HG22 THR 50 2HG2 THR 50 -1.023 15.860 -10.872 45 HG23 THR 50 3HG2 THR 50 0.708 15.891 -11.206 46 H GLU 51 H GLU 51 0.418 14.715 -7.898 47 HA GLU 51 HA GLU 51 -1.608 12.647 -8.587 48 HB2 GLU 51 2HB GLU 51 1.395 12.382 -8.354 49 HB3 GLU 51 1HB GLU 51 0.279 11.141 -8.925 50 HG2 GLU 51 2HG GLU 51 -0.422 12.679 -10.769 51 HG3 GLU 51 1HG GLU 51 0.804 13.825 -10.231 52 H ALA 52 H ALA 52 -2.200 11.131 -7.146 53 HA ALA 52 HA ALA 52 -0.737 10.717 -4.625 54 HB1 ALA 52 1HB ALA 52 -3.241 10.861 -3.601 55 HB2 ALA 52 2HB ALA 52 -3.363 12.107 -4.842 56 HB3 ALA 52 3HB ALA 52 -2.132 12.232 -3.583 57 H ASN 53 H ASN 53 -0.545 8.468 -4.858 58 HA ASN 53 HA ASN 53 -2.902 7.075 -6.003 59 HB2 ASN 53 2HB ASN 53 -0.051 6.140 -5.686 60 HB3 ASN 53 1HB ASN 53 -1.362 5.129 -6.290 61 HD21 ASN 53 1HD2 ASN 53 -2.762 7.201 -7.787 62 HD22 ASN 53 2HD2 ASN 53 -1.783 7.623 -9.108 63 H CYS 54 H CYS 54 -4.041 5.533 -4.972 64 HA CYS 54 HA CYS 54 -3.211 4.852 -2.184 65 HB2 CYS 54 2HB CYS 54 -6.094 4.956 -2.576 66 HB3 CYS 54 1HB CYS 54 -5.120 5.759 -1.349 67 H THR 55 H THR 55 -2.629 2.711 -2.626 68 HA THR 55 HA THR 55 -4.711 1.115 -4.051 69 HB THR 55 HB THR 55 -3.172 0.378 -5.520 70 HG1 THR 55 1HG THR 55 -1.446 -0.738 -4.812 71 HG21 THR 55 1HG2 THR 55 -1.159 2.183 -4.167 72 HG22 THR 55 2HG2 THR 55 -2.454 2.817 -5.176 73 HG23 THR 55 3HG2 THR 55 -1.244 1.743 -5.868 74 H VAL 56 H VAL 56 -5.008 -1.030 -3.457 75 HA VAL 56 HA VAL 56 -4.134 -1.662 -0.693 76 HB VAL 56 HB VAL 56 -6.267 -2.863 -2.487 77 HG11 VAL 56 1HG1 VAL 56 -5.499 -4.717 -1.261 78 HG12 VAL 56 2HG1 VAL 56 -6.801 -4.093 -0.246 79 HG13 VAL 56 3HG1 VAL 56 -5.121 -3.739 0.158 80 HG21 VAL 56 1HG2 VAL 56 -7.595 -1.331 -1.507 81 HG22 VAL 56 2HG2 VAL 56 -6.227 -0.718 -0.578 82 HG23 VAL 56 3HG2 VAL 56 -7.214 -2.030 0.066 83 H LEU 57 H LEU 57 -2.276 -2.790 -0.662 84 HA LEU 57 HA LEU 57 -0.765 -3.868 -2.630 85 HB2 LEU 57 2HB LEU 57 -1.008 -4.293 0.168 86 HB3 LEU 57 1HB LEU 57 -0.836 -5.871 -0.597 87 HG LEU 57 HG LEU 57 1.370 -4.915 -0.042 88 HD11 LEU 57 1HD1 LEU 57 2.308 -5.707 -1.962 89 HD12 LEU 57 2HD1 LEU 57 1.356 -4.633 -2.986 90 HD13 LEU 57 3HD1 LEU 57 0.643 -6.121 -2.368 91 HD21 LEU 57 1HD2 LEU 57 1.951 -2.770 -0.517 92 HD22 LEU 57 2HD2 LEU 57 0.219 -2.510 -0.734 93 HD23 LEU 57 3HD2 LEU 57 1.243 -2.844 -2.131 94 H SER 58 H SER 58 -0.584 -5.876 -3.733 95 HA SER 58 HA SER 58 -3.177 -7.270 -4.067 96 HB2 SER 58 2HB SER 58 -1.890 -6.433 -6.077 97 HB3 SER 58 1HB SER 58 -0.619 -7.580 -5.672 98 HG SER 58 HG SER 58 -2.290 -9.218 -5.788 99 H VAL 59 H VAL 59 -3.398 -9.424 -3.404 100 HA VAL 59 HA VAL 59 -1.096 -10.499 -1.869 101 HB VAL 59 HB VAL 59 -3.886 -11.656 -2.003 102 HG11 VAL 59 1HG1 VAL 59 -1.749 -11.689 0.151 103 HG12 VAL 59 2HG1 VAL 59 -2.050 -13.006 -0.984 104 HG13 VAL 59 3HG1 VAL 59 -3.286 -12.552 0.191 105 HG21 VAL 59 1HG2 VAL 59 -4.034 -9.256 -1.413 106 HG22 VAL 59 2HG2 VAL 59 -2.830 -9.496 -0.147 107 HG23 VAL 59 3HG2 VAL 59 -4.407 -10.275 -0.023 108 H GLN 60 H GLN 60 0.217 -11.887 -2.942 109 HA GLN 60 HA GLN 60 -1.002 -13.979 -4.640 110 HB2 GLN 60 2HB GLN 60 1.226 -12.148 -5.577 111 HB3 GLN 60 1HB GLN 60 0.677 -13.589 -6.433 112 HG2 GLN 60 2HG GLN 60 -1.615 -12.604 -6.544 113 HG3 GLN 60 1HG GLN 60 -0.986 -11.133 -5.800 114 HE21 GLN 60 1HE2 GLN 60 -1.812 -10.238 -8.018 115 HE22 GLN 60 2HE2 GLN 60 -0.701 -10.258 -9.303 116 H GLN 61 H GLN 61 0.453 -15.817 -4.950 117 HA GLN 61 HA GLN 61 2.089 -16.315 -2.606 118 HB2 GLN 61 2HB GLN 61 1.916 -17.935 -5.157 119 HB3 GLN 61 1HB GLN 61 2.471 -18.505 -3.586 120 HG2 GLN 61 2HG GLN 61 -0.325 -17.561 -4.280 121 HG3 GLN 61 1HG GLN 61 0.167 -19.221 -3.934 122 HE21 GLN 61 1HE2 GLN 61 -1.182 -16.499 -2.507 123 HE22 GLN 61 2HE2 GLN 61 -0.813 -16.845 -0.891 124 H ILE 62 H ILE 62 3.630 -14.484 -2.927 125 HA ILE 62 HA ILE 62 5.697 -13.612 -3.642 126 HB ILE 62 HB ILE 62 6.174 -16.552 -4.228 127 HG12 ILE 62 2HG1 ILE 62 6.856 -14.907 -1.772 128 HG13 ILE 62 1HG1 ILE 62 5.464 -15.983 -1.882 129 HG21 ILE 62 1HG2 ILE 62 8.592 -15.764 -3.710 130 HG22 ILE 62 2HG2 ILE 62 7.983 -14.144 -4.037 131 HG23 ILE 62 3HG2 ILE 62 7.926 -15.378 -5.296 132 HD11 ILE 62 1HD1 ILE 62 7.984 -17.241 -2.715 133 HD12 ILE 62 2HD1 ILE 62 6.736 -17.840 -1.623 134 HD13 ILE 62 3HD1 ILE 62 7.975 -16.734 -1.025 135 H GLY 63 H GLY 63 7.206 -13.506 -5.635 136 HA2 GLY 63 2HA GLY 63 7.510 -13.722 -8.018 137 HA3 GLY 63 1HA GLY 63 5.846 -14.288 -8.152 138 H GLU 64 H GLU 64 5.806 -11.697 -6.092 139 HA GLU 64 HA GLU 64 5.249 -9.802 -8.332 140 HB2 GLU 64 2HB GLU 64 3.910 -10.020 -5.625 141 HB3 GLU 64 1HB GLU 64 3.627 -8.709 -6.769 142 HG2 GLU 64 2HG GLU 64 3.150 -11.650 -7.332 143 HG3 GLU 64 1HG GLU 64 1.902 -10.462 -6.959 144 H VAL 65 H VAL 65 6.047 -7.728 -8.153 145 HA VAL 65 HA VAL 65 7.832 -7.202 -5.815 146 HB VAL 65 HB VAL 65 8.184 -6.225 -8.663 147 HG11 VAL 65 1HG1 VAL 65 9.374 -5.529 -6.090 148 HG12 VAL 65 2HG1 VAL 65 9.524 -4.715 -7.647 149 HG13 VAL 65 3HG1 VAL 65 10.587 -6.066 -7.253 150 HG21 VAL 65 1HG2 VAL 65 9.847 -8.273 -7.177 151 HG22 VAL 65 2HG2 VAL 65 9.913 -7.866 -8.892 152 HG23 VAL 65 3HG2 VAL 65 8.516 -8.725 -8.242 153 H PHE 66 H PHE 66 7.479 -5.279 -4.757 154 HA PHE 66 HA PHE 66 5.529 -3.386 -6.001 155 HB2 PHE 66 2HB PHE 66 5.898 -4.018 -3.062 156 HB3 PHE 66 1HB PHE 66 4.716 -2.899 -3.743 157 HD1 PHE 66 1HD PHE 66 5.561 -6.389 -3.139 158 HD2 PHE 66 2HD PHE 66 2.877 -3.749 -5.203 159 HE1 PHE 66 1HE PHE 66 4.007 -8.277 -3.528 160 HE2 PHE 66 2HE PHE 66 1.319 -5.637 -5.590 161 HZ PHE 66 HZ PHE 66 1.882 -7.903 -4.753 162 H GLU 67 H GLU 67 5.860 -1.131 -5.482 163 HA GLU 67 HA GLU 67 8.706 -0.540 -4.810 164 HB2 GLU 67 2HB GLU 67 8.487 1.465 -6.119 165 HB3 GLU 67 1HB GLU 67 7.804 0.153 -7.077 166 HG2 GLU 67 2HG GLU 67 5.533 0.783 -6.193 167 HG3 GLU 67 1HG GLU 67 6.275 2.190 -5.433 168 H CYS 68 H CYS 68 9.173 0.998 -3.243 169 HA CYS 68 HA CYS 68 6.872 1.830 -1.531 170 HB2 CYS 68 2HB CYS 68 9.310 0.564 -0.893 171 HB3 CYS 68 1HB CYS 68 9.482 2.228 -0.331 172 H THR 69 H THR 69 7.046 4.053 -0.619 173 HA THR 69 HA THR 69 8.560 5.856 -2.464 174 HB THR 69 HB THR 69 6.761 7.360 -2.458 175 HG1 THR 69 1HG THR 69 5.972 5.982 -0.118 176 HG21 THR 69 1HG2 THR 69 5.058 6.114 -3.376 177 HG22 THR 69 2HG2 THR 69 5.070 4.939 -2.060 178 HG23 THR 69 3HG2 THR 69 6.303 4.866 -3.320 179 H PHE 70 H PHE 70 9.551 7.692 -1.542 180 HA PHE 70 HA PHE 70 9.387 8.114 1.363 181 HB2 PHE 70 2HB PHE 70 11.763 7.817 1.773 182 HB3 PHE 70 1HB PHE 70 11.128 6.329 1.073 183 HD1 PHE 70 1HD PHE 70 11.608 5.726 -1.268 184 HD2 PHE 70 2HD PHE 70 13.278 9.248 0.533 185 HE1 PHE 70 1HE PHE 70 13.245 5.898 -3.123 186 HE2 PHE 70 2HE PHE 70 14.915 9.422 -1.321 187 HZ PHE 70 HZ PHE 70 14.899 7.747 -3.150 188 H THR 71 H THR 71 10.646 10.107 1.968 189 HA THR 71 HA THR 71 11.106 11.892 -0.378 190 HB THR 71 HB THR 71 10.173 13.496 1.752 191 HG1 THR 71 1HG THR 71 8.600 12.423 2.623 192 HG21 THR 71 1HG2 THR 71 8.196 13.767 0.164 193 HG22 THR 71 2HG2 THR 71 8.965 12.548 -0.854 194 HG23 THR 71 3HG2 THR 71 9.786 14.077 -0.533 195 H CYS 72 H CYS 72 12.796 13.350 -0.132 196 HA CYS 72 HA CYS 72 14.313 13.224 2.440 197 HB2 CYS 72 2HB CYS 72 16.202 12.535 1.396 198 HB3 CYS 72 1HB CYS 72 15.152 12.085 0.053 199 H GLY 73 H GLY 73 15.913 15.147 2.536 200 HA2 GLY 73 2HA GLY 73 14.384 17.565 1.882 201 HA3 GLY 73 1HA GLY 73 15.878 17.507 2.822 202 H ALA 74 H ALA 74 15.913 19.493 1.077 203 HA ALA 74 HA ALA 74 17.331 20.338 -0.615 204 HB1 ALA 74 1HB ALA 74 18.644 18.087 0.091 205 HB2 ALA 74 2HB ALA 74 19.135 19.083 -1.279 206 HB3 ALA 74 3HB ALA 74 18.160 17.636 -1.544 207 H ASP 75 H ASP 75 14.539 19.195 -0.889 208 HA ASP 75 HA ASP 75 12.965 18.872 -2.589 209 HB2 ASP 75 2HB ASP 75 15.147 20.229 -4.203 210 HB3 ASP 75 1HB ASP 75 13.500 19.959 -4.772 211 H CYS 76 H CYS 76 14.415 16.588 -2.015 212 HA CYS 76 HA CYS 76 14.738 15.379 -4.733 213 HB2 CYS 76 2HB CYS 76 16.788 14.602 -4.210 214 HB3 CYS 76 1HB CYS 76 16.742 15.651 -2.793 215 H ARG 77 H ARG 77 13.363 13.719 -5.073 216 HA ARG 77 HA ARG 77 12.324 12.210 -2.711 217 HB2 ARG 77 2HB ARG 77 10.711 13.213 -5.080 218 HB3 ARG 77 1HB ARG 77 10.094 12.167 -3.800 219 HG2 ARG 77 2HG ARG 77 9.498 14.128 -2.805 220 HG3 ARG 77 1HG ARG 77 11.196 14.189 -2.331 221 HD2 ARG 77 2HD ARG 77 10.767 16.299 -3.345 222 HD3 ARG 77 1HD ARG 77 11.617 15.364 -4.574 223 HE ARG 77 HE ARG 77 9.598 15.250 -5.838 224 HH11 ARG 77 1HH1 ARG 77 7.524 16.027 -6.278 225 HH12 ARG 77 2HH1 ARG 77 6.649 16.874 -5.048 226 HH21 ARG 77 1HH2 ARG 77 9.172 16.592 -2.687 227 HH22 ARG 77 2HH2 ARG 77 7.581 17.191 -3.015 228 H GLY 78 H GLY 78 11.754 9.970 -3.225 229 HA2 GLY 78 2HA GLY 78 12.165 8.990 -5.944 230 HA3 GLY 78 1HA GLY 78 13.492 8.568 -4.861 231 H THR 79 H THR 79 12.311 6.434 -5.805 232 HA THR 79 HA THR 79 10.506 5.500 -3.621 233 HB THR 79 HB THR 79 9.298 4.129 -5.222 234 HG1 THR 79 1HG THR 79 11.159 5.198 -7.072 235 HG21 THR 79 1HG2 THR 79 8.001 5.892 -5.710 236 HG22 THR 79 2HG2 THR 79 9.164 6.456 -6.910 237 HG23 THR 79 3HG2 THR 79 9.320 6.956 -5.226 238 H SER 80 H SER 80 10.672 3.135 -3.238 239 HA SER 80 HA SER 80 13.368 2.073 -3.994 240 HB2 SER 80 2HB SER 80 11.829 1.609 -1.423 241 HB3 SER 80 1HB SER 80 13.406 0.930 -1.817 242 HG SER 80 HG SER 80 13.698 3.451 -2.239 243 H GLN 81 H GLN 81 13.465 -0.241 -4.331 244 HA GLN 81 HA GLN 81 10.801 -1.446 -4.941 245 HB2 GLN 81 2HB GLN 81 13.509 -1.852 -6.231 246 HB3 GLN 81 1HB GLN 81 12.116 -2.885 -6.556 247 HG2 GLN 81 2HG GLN 81 11.738 0.071 -6.779 248 HG3 GLN 81 1HG GLN 81 12.630 -0.746 -8.064 249 HE21 GLN 81 1HE2 GLN 81 9.575 -1.177 -6.178 250 HE22 GLN 81 2HE2 GLN 81 8.680 -1.770 -7.491 251 H TYR 82 H TYR 82 10.343 -3.457 -4.070 252 HA TYR 82 HA TYR 82 12.509 -4.992 -2.784 253 HB2 TYR 82 2HB TYR 82 10.255 -3.640 -1.327 254 HB3 TYR 82 1HB TYR 82 10.903 -5.159 -0.710 255 HD1 TYR 82 1HD TYR 82 11.203 -1.695 -0.486 256 HD2 TYR 82 2HD TYR 82 13.621 -5.233 -0.792 257 HE1 TYR 82 1HE TYR 82 13.121 -0.473 0.505 258 HE2 TYR 82 2HE TYR 82 15.537 -4.010 0.199 259 HH TYR 82 HH TYR 82 15.425 -0.553 0.745 260 HA PRO 83 HA PRO 83 10.269 -8.571 -4.158 261 HB2 PRO 83 2HB PRO 83 10.261 -9.587 -1.361 262 HB3 PRO 83 1HB PRO 83 10.858 -10.357 -2.842 263 HG2 PRO 83 2HG PRO 83 12.488 -9.305 -0.983 264 HG3 PRO 83 1HG PRO 83 12.889 -9.357 -2.705 265 HD2 PRO 83 2HD PRO 83 12.153 -7.028 -1.033 266 HD3 PRO 83 1HD PRO 83 13.061 -7.093 -2.557 267 H CYS 84 H CYS 84 8.536 -10.150 -2.390 268 HA CYS 84 HA CYS 84 6.104 -8.552 -2.670 269 HB2 CYS 84 2HB CYS 84 5.234 -10.612 -2.912 270 HB3 CYS 84 1HB CYS 84 6.772 -11.338 -2.442 271 H VAL 85 H VAL 85 4.732 -7.907 -0.952 272 HA VAL 85 HA VAL 85 5.919 -8.055 1.784 273 HB VAL 85 HB VAL 85 4.921 -5.733 2.130 274 HG11 VAL 85 1HG1 VAL 85 6.863 -4.631 1.086 275 HG12 VAL 85 2HG1 VAL 85 7.151 -6.068 0.106 276 HG13 VAL 85 3HG1 VAL 85 7.333 -6.145 1.860 277 HG21 VAL 85 1HG2 VAL 85 5.065 -5.553 -0.879 278 HG22 VAL 85 2HG2 VAL 85 4.304 -4.436 0.253 279 HG23 VAL 85 3HG2 VAL 85 3.564 -6.003 -0.072 280 H GLN 86 H GLN 86 4.205 -7.573 3.489 281 HA GLN 86 HA GLN 86 2.032 -9.364 3.231 282 HB2 GLN 86 2HB GLN 86 2.226 -6.963 5.069 283 HB3 GLN 86 1HB GLN 86 1.174 -8.361 5.291 284 HG2 GLN 86 2HG GLN 86 4.184 -8.586 5.072 285 HG3 GLN 86 1HG GLN 86 3.345 -8.434 6.611 286 HE21 GLN 86 1HE2 GLN 86 1.145 -10.062 4.823 287 HE22 GLN 86 2HE2 GLN 86 1.617 -11.661 5.138 288 H VAL 87 H VAL 87 -0.242 -7.834 4.110 289 HA VAL 87 HA VAL 87 -0.821 -6.301 1.604 290 HB VAL 87 HB VAL 87 -1.963 -8.506 1.721 291 HG11 VAL 87 1HG1 VAL 87 -3.395 -9.088 3.461 292 HG12 VAL 87 2HG1 VAL 87 -3.676 -7.410 3.925 293 HG13 VAL 87 3HG1 VAL 87 -2.152 -8.195 4.338 294 HG21 VAL 87 1HG2 VAL 87 -4.009 -7.679 0.926 295 HG22 VAL 87 2HG2 VAL 87 -2.944 -6.288 0.728 296 HG23 VAL 87 3HG2 VAL 87 -4.046 -6.366 2.101 297 H TYR 88 H TYR 88 -1.964 -4.420 1.746 298 HA TYR 88 HA TYR 88 -3.505 -3.557 3.952 299 HB2 TYR 88 2HB TYR 88 -1.311 -3.478 5.096 300 HB3 TYR 88 1HB TYR 88 -0.754 -2.317 3.914 301 HD1 TYR 88 1HD TYR 88 -4.227 -1.629 4.471 302 HD2 TYR 88 2HD TYR 88 -0.355 -1.204 6.312 303 HE1 TYR 88 1HE TYR 88 -5.091 0.179 5.886 304 HE2 TYR 88 2HE TYR 88 -1.244 0.613 7.727 305 HH TYR 88 HH TYR 88 -3.773 1.205 8.589 306 H VAL 89 H VAL 89 -1.994 -0.763 3.457 307 HA VAL 89 HA VAL 89 -3.095 -0.281 0.740 308 HB VAL 89 HB VAL 89 -4.831 0.336 2.422 309 HG11 VAL 89 1HG1 VAL 89 -4.429 1.842 4.136 310 HG12 VAL 89 2HG1 VAL 89 -3.110 2.631 3.273 311 HG13 VAL 89 3HG1 VAL 89 -2.850 1.064 4.039 312 HG21 VAL 89 1HG2 VAL 89 -5.327 2.470 1.450 313 HG22 VAL 89 2HG2 VAL 89 -4.468 1.556 0.210 314 HG23 VAL 89 3HG2 VAL 89 -3.623 2.795 1.138 315 H ASN 90 H ASN 90 -1.835 1.086 -0.458 316 HA ASN 90 HA ASN 90 0.604 2.149 0.828 317 HB2 ASN 90 2HB ASN 90 -0.233 2.176 -2.086 318 HB3 ASN 90 1HB ASN 90 1.368 2.532 -1.453 319 HD21 ASN 90 1HD2 ASN 90 1.230 0.353 0.579 320 HD22 ASN 90 2HD2 ASN 90 1.416 -1.098 -0.283 321 H ASN 91 H ASN 91 0.594 4.254 1.523 322 HA ASN 91 HA ASN 91 -1.538 6.040 0.489 323 HB2 ASN 91 2HB ASN 91 0.334 6.300 2.858 324 HB3 ASN 91 1HB ASN 91 -0.866 7.510 2.401 325 HD21 ASN 91 1HD2 ASN 91 -1.002 6.161 4.930 326 HD22 ASN 91 2HD2 ASN 91 -2.380 5.170 4.932 327 H SER 92 H SER 92 -0.526 6.477 -1.553 328 HA SER 92 HA SER 92 2.118 7.782 -1.535 329 HB2 SER 92 2HB SER 92 0.214 7.305 -3.828 330 HB3 SER 92 1HB SER 92 1.891 7.809 -3.965 331 HG SER 92 HG SER 92 1.928 5.686 -2.464 332 H GLU 93 H GLU 93 -0.182 9.032 -0.181 333 HA GLU 93 HA GLU 93 -1.289 11.157 -1.746 334 HB2 GLU 93 2HB GLU 93 -0.657 11.218 1.222 335 HB3 GLU 93 1HB GLU 93 -1.897 12.147 0.378 336 HG2 GLU 93 2HG GLU 93 -3.012 10.005 -0.260 337 HG3 GLU 93 1HG GLU 93 -1.817 9.137 0.709 338 H SER 94 H SER 94 1.842 10.541 -0.634 339 HA SER 94 HA SER 94 2.885 13.001 -1.746 340 HB2 SER 94 2HB SER 94 3.986 13.679 0.469 341 HB3 SER 94 1HB SER 94 2.264 14.024 0.321 342 HG SER 94 HG SER 94 2.630 13.011 2.282 343 H ASN 95 H ASN 95 3.473 10.256 0.445 344 HA ASN 95 HA ASN 95 5.382 8.953 -1.108 345 HB2 ASN 95 2HB ASN 95 7.470 9.764 0.330 346 HB3 ASN 95 1HB ASN 95 6.987 10.629 -1.127 347 HD21 ASN 95 1HD2 ASN 95 6.735 10.701 2.439 348 HD22 ASN 95 2HD2 ASN 95 6.367 12.356 2.539 349 H SER 96 H SER 96 3.407 8.155 0.714 350 HA SER 96 HA SER 96 5.083 6.875 2.848 351 HB2 SER 96 2HB SER 96 3.058 6.934 4.301 352 HB3 SER 96 1HB SER 96 3.654 8.543 3.896 353 HG SER 96 HG SER 96 2.078 8.248 2.028 354 H ARG 97 H ARG 97 4.615 4.710 3.311 355 HA ARG 97 HA ARG 97 2.538 3.397 1.629 356 HB2 ARG 97 2HB ARG 97 4.848 3.048 0.674 357 HB3 ARG 97 1HB ARG 97 5.291 2.249 2.182 358 HG2 ARG 97 2HG ARG 97 2.794 1.255 0.949 359 HG3 ARG 97 1HG ARG 97 4.254 0.949 0.010 360 HD2 ARG 97 2HD ARG 97 4.128 0.343 2.965 361 HD3 ARG 97 1HD ARG 97 3.589 -0.825 1.760 362 HE ARG 97 HE ARG 97 6.370 -0.027 2.265 363 HH11 ARG 97 1HH1 ARG 97 7.907 -1.206 1.103 364 HH12 ARG 97 2HH1 ARG 97 7.395 -2.216 -0.207 365 HH21 ARG 97 1HH2 ARG 97 4.036 -1.435 0.154 366 HH22 ARG 97 2HH2 ARG 97 5.203 -2.345 -0.745 367 H ALA 98 H ALA 98 1.168 2.249 2.924 368 HA ALA 98 HA ALA 98 2.075 1.629 5.685 369 HB1 ALA 98 1HB ALA 98 -0.195 2.873 4.842 370 HB2 ALA 98 2HB ALA 98 -0.062 2.009 6.374 371 HB3 ALA 98 3HB ALA 98 -0.761 1.209 4.965 372 H LEU 99 H LEU 99 2.509 -0.444 6.226 373 HA LEU 99 HA LEU 99 1.426 -2.620 4.478 374 HB2 LEU 99 2HB LEU 99 3.879 -2.382 4.293 375 HB3 LEU 99 1HB LEU 99 4.023 -2.582 6.039 376 HG LEU 99 HG LEU 99 2.996 -4.822 5.866 377 HD11 LEU 99 1HD1 LEU 99 2.747 -3.963 3.006 378 HD12 LEU 99 2HD1 LEU 99 1.597 -4.846 4.011 379 HD13 LEU 99 3HD1 LEU 99 3.007 -5.672 3.353 380 HD21 LEU 99 1HD2 LEU 99 5.412 -4.210 4.156 381 HD22 LEU 99 2HD2 LEU 99 4.876 -5.864 4.451 382 HD23 LEU 99 3HD2 LEU 99 5.373 -4.845 5.801 383 H LEU 100 H LEU 100 0.213 -4.143 5.484 384 HA LEU 100 HA LEU 100 0.236 -4.204 8.477 385 HB2 LEU 100 2HB LEU 100 -1.847 -3.204 7.356 386 HB3 LEU 100 1HB LEU 100 -2.152 -4.819 6.720 387 HG LEU 100 HG LEU 100 -2.095 -5.709 9.050 388 HD11 LEU 100 1HD1 LEU 100 -2.554 -3.636 10.714 389 HD12 LEU 100 2HD1 LEU 100 -1.463 -2.847 9.576 390 HD13 LEU 100 3HD1 LEU 100 -0.941 -4.292 10.442 391 HD21 LEU 100 1HD2 LEU 100 -4.234 -5.120 7.966 392 HD22 LEU 100 2HD2 LEU 100 -4.074 -3.462 8.546 393 HD23 LEU 100 3HD2 LEU 100 -4.297 -4.780 9.696 394 H HIS 101 H HIS 101 0.189 -6.289 9.413 395 HA HIS 101 HA HIS 101 0.859 -8.476 7.538 396 HB2 HIS 101 2HB HIS 101 0.726 -8.552 10.566 397 HB3 HIS 101 1HB HIS 101 1.525 -9.714 9.508 398 HD1 HIS 101 1HD HIS 101 2.615 -7.219 7.657 399 HD2 HIS 101 2HD HIS 101 3.307 -7.892 11.713 400 HE1 HIS 101 1HE HIS 101 4.754 -5.996 8.227 401 HE2 HIS 101 2HE HIS 101 5.182 -6.388 10.697 402 H SER 102 H SER 102 -0.796 -9.698 6.757 403 HA SER 102 HA SER 102 -3.451 -9.598 7.891 404 HB2 SER 102 2HB SER 102 -4.021 -11.257 6.220 405 HB3 SER 102 1HB SER 102 -2.923 -10.100 5.476 406 HG SER 102 HG SER 102 -2.516 -12.491 5.255 407 H ASP 103 H ASP 103 -0.760 -11.890 8.038 408 HA ASP 103 HA ASP 103 -1.460 -12.853 10.637 409 HB2 ASP 103 2HB ASP 103 -3.307 -13.895 9.128 410 HB3 ASP 103 1HB ASP 103 -2.015 -14.925 8.517 411 H GLU 104 H GLU 104 0.086 -14.484 11.352 412 HA GLU 104 HA GLU 104 2.660 -14.260 10.098 413 HB2 GLU 104 2HB GLU 104 2.288 -14.809 12.525 414 HB3 GLU 104 1HB GLU 104 1.727 -16.408 12.031 415 HG2 GLU 104 2HG GLU 104 3.914 -16.789 10.898 416 HG3 GLU 104 1HG GLU 104 4.473 -15.231 11.508 417 H HIS 105 H HIS 105 0.068 -16.659 9.920 418 HA HIS 105 HA HIS 105 1.449 -18.706 8.532 419 HB2 HIS 105 2HB HIS 105 -1.438 -17.817 8.246 420 HB3 HIS 105 1HB HIS 105 -0.788 -19.347 7.653 421 HD1 HIS 105 1HD HIS 105 -2.969 -19.572 9.726 422 HD2 HIS 105 2HD HIS 105 1.056 -19.233 10.768 423 HE1 HIS 105 1HE HIS 105 -2.754 -20.513 12.070 424 HE2 HIS 105 2HE HIS 105 -0.307 -20.313 12.713 425 H GLN 106 H GLN 106 -0.113 -15.750 7.344 426 HA GLN 106 HA GLN 106 0.188 -16.269 4.557 427 HB2 GLN 106 2HB GLN 106 -1.127 -14.365 5.589 428 HB3 GLN 106 1HB GLN 106 0.413 -13.557 5.893 429 HG2 GLN 106 2HG GLN 106 0.930 -13.678 3.465 430 HG3 GLN 106 1HG GLN 106 -0.649 -14.409 3.184 431 HE21 GLN 106 1HE2 GLN 106 -2.049 -12.847 2.372 432 HE22 GLN 106 2HE2 GLN 106 -2.135 -11.239 2.910 433 H LEU 107 H LEU 107 2.373 -14.846 6.948 434 HA LEU 107 HA LEU 107 4.483 -14.155 5.149 435 HB2 LEU 107 2HB LEU 107 4.427 -13.364 7.486 436 HB3 LEU 107 1HB LEU 107 4.632 -15.020 8.058 437 HG LEU 107 HG LEU 107 6.809 -15.135 6.851 438 HD11 LEU 107 1HD1 LEU 107 5.863 -12.477 5.942 439 HD12 LEU 107 2HD1 LEU 107 6.921 -13.633 5.132 440 HD13 LEU 107 3HD1 LEU 107 7.569 -12.568 6.380 441 HD21 LEU 107 1HD2 LEU 107 6.145 -13.531 9.165 442 HD22 LEU 107 2HD2 LEU 107 7.550 -12.852 8.341 443 HD23 LEU 107 3HD2 LEU 107 7.572 -14.530 8.883 444 H LEU 108 H LEU 108 3.735 -17.134 6.941 445 HA LEU 108 HA LEU 108 6.021 -18.627 6.084 446 HB2 LEU 108 2HB LEU 108 4.410 -19.304 7.918 447 HB3 LEU 108 1HB LEU 108 3.242 -19.702 6.659 448 HG LEU 108 HG LEU 108 4.967 -21.244 5.652 449 HD11 LEU 108 1HD1 LEU 108 6.544 -20.043 7.794 450 HD12 LEU 108 2HD1 LEU 108 7.081 -20.990 6.408 451 HD13 LEU 108 3HD1 LEU 108 6.555 -21.804 7.881 452 HD21 LEU 108 1HD2 LEU 108 3.759 -22.775 6.776 453 HD22 LEU 108 2HD2 LEU 108 3.341 -21.572 7.996 454 HD23 LEU 108 3HD2 LEU 108 4.802 -22.543 8.180 455 H THR 109 H THR 109 2.899 -17.912 4.666 456 HA THR 109 HA THR 109 3.128 -19.727 2.427 457 HB THR 109 HB THR 109 1.438 -17.233 2.784 458 HG1 THR 109 1HG THR 109 -0.106 -18.667 3.524 459 HG21 THR 109 1HG2 THR 109 0.183 -19.198 1.197 460 HG22 THR 109 2HG2 THR 109 1.831 -19.033 0.589 461 HG23 THR 109 3HG2 THR 109 0.781 -17.619 0.689 462 H ASN 110 H ASN 110 4.146 -16.453 3.123 463 HA ASN 110 HA ASN 110 5.354 -16.278 0.396 464 HB2 ASN 110 2HB ASN 110 4.527 -13.818 1.899 465 HB3 ASN 110 1HB ASN 110 4.707 -14.053 0.160 466 HD21 ASN 110 1HD2 ASN 110 3.152 -16.473 -0.088 467 HD22 ASN 110 2HD2 ASN 110 1.533 -16.086 0.237 468 HA PRO 111 HA PRO 111 8.413 -15.877 3.878 469 HB2 PRO 111 2HB PRO 111 10.187 -17.712 2.849 470 HB3 PRO 111 1HB PRO 111 8.928 -18.093 4.030 471 HG2 PRO 111 2HG PRO 111 9.016 -18.610 1.125 472 HG3 PRO 111 1HG PRO 111 8.226 -19.524 2.418 473 HD2 PRO 111 2HD PRO 111 6.907 -17.852 0.655 474 HD3 PRO 111 1HD PRO 111 6.286 -18.316 2.246 475 H LYS 112 H LYS 112 10.395 -14.780 3.759 476 HA LYS 112 HA LYS 112 12.039 -13.395 2.833 477 HB2 LYS 112 2HB LYS 112 12.426 -15.535 1.434 478 HB3 LYS 112 1HB LYS 112 11.518 -14.709 0.166 479 HG2 LYS 112 2HG LYS 112 13.092 -12.812 0.267 480 HG3 LYS 112 1HG LYS 112 14.009 -13.645 1.524 481 HD2 LYS 112 2HD LYS 112 14.336 -15.555 -0.068 482 HD3 LYS 112 1HD LYS 112 13.577 -14.576 -1.324 483 HE2 LYS 112 2HE LYS 112 16.228 -14.202 0.026 484 HE3 LYS 112 1HE LYS 112 15.822 -14.076 -1.685 485 HZ1 LYS 112 1HZ LYS 112 16.106 -11.888 -1.010 486 HZ2 LYS 112 2HZ LYS 112 15.323 -12.129 0.478 487 HZ3 LYS 112 3HZ LYS 112 14.422 -12.086 -0.962 488 H CYS 113 H CYS 113 9.319 -12.580 2.996 489 HA CYS 113 HA CYS 113 8.962 -10.955 0.521 490 HB2 CYS 113 2HB CYS 113 7.115 -12.052 2.597 491 HB3 CYS 113 1HB CYS 113 6.670 -10.527 1.835 492 H SER 114 H SER 114 8.149 -10.447 3.971 493 HA SER 114 HA SER 114 9.011 -7.625 3.679 494 HB2 SER 114 2HB SER 114 7.783 -7.192 5.668 495 HB3 SER 114 1HB SER 114 6.800 -8.345 4.767 496 HG SER 114 HG SER 114 8.715 -9.412 6.467 497 H TYR 115 H TYR 115 10.568 -10.417 4.391 498 HA TYR 115 HA TYR 115 11.900 -9.890 6.850 499 HB2 TYR 115 2HB TYR 115 12.765 -11.430 4.396 500 HB3 TYR 115 1HB TYR 115 13.711 -11.383 5.886 501 HD1 TYR 115 1HD TYR 115 10.560 -12.516 4.339 502 HD2 TYR 115 2HD TYR 115 12.929 -12.455 7.919 503 HE1 TYR 115 1HE TYR 115 9.111 -14.265 5.327 504 HE2 TYR 115 2HE TYR 115 11.480 -14.205 8.909 505 HH TYR 115 HH TYR 115 9.867 -16.161 7.687 506 H ILE 116 H ILE 116 12.642 -8.819 3.551 507 HA ILE 116 HA ILE 116 15.129 -7.545 4.399 508 HB ILE 116 HB ILE 116 14.574 -6.327 2.032 509 HG12 ILE 116 2HG1 ILE 116 13.484 -7.957 0.559 510 HG13 ILE 116 1HG1 ILE 116 13.201 -9.033 1.923 511 HG21 ILE 116 1HG2 ILE 116 16.592 -7.581 2.453 512 HG22 ILE 116 2HG2 ILE 116 15.849 -8.243 0.996 513 HG23 ILE 116 3HG2 ILE 116 15.694 -9.097 2.531 514 HD11 ILE 116 1HD1 ILE 116 11.330 -7.314 1.086 515 HD12 ILE 116 2HD1 ILE 116 12.217 -6.220 2.146 516 HD13 ILE 116 3HD1 ILE 116 11.520 -7.702 2.796 517 HA PRO 117 HA PRO 117 14.040 -3.666 6.133 518 HB2 PRO 117 2HB PRO 117 14.975 -2.491 3.534 519 HB3 PRO 117 1HB PRO 117 15.339 -1.981 5.193 520 HG2 PRO 117 2HG PRO 117 17.024 -3.483 3.681 521 HG3 PRO 117 1HG PRO 117 16.984 -3.523 5.450 522 HD2 PRO 117 2HD PRO 117 16.238 -5.629 3.587 523 HD3 PRO 117 1HD PRO 117 16.330 -5.704 5.360 524 HA PRO 118 HA PRO 118 10.187 -3.253 3.661 525 HB2 PRO 118 2HB PRO 118 8.435 -3.865 5.619 526 HB3 PRO 118 1HB PRO 118 9.339 -5.120 4.750 527 HG2 PRO 118 2HG PRO 118 9.697 -4.104 7.494 528 HG3 PRO 118 1HG PRO 118 10.087 -5.689 6.813 529 HD2 PRO 118 2HD PRO 118 11.888 -3.509 7.272 530 HD3 PRO 118 1HD PRO 118 12.254 -5.061 6.496 531 H CYS 119 H CYS 119 8.734 -1.463 3.607 532 HA CYS 119 HA CYS 119 9.264 0.622 5.664 533 HB2 CYS 119 2HB CYS 119 7.665 1.703 3.613 534 HB3 CYS 119 1HB CYS 119 9.394 1.958 3.849 535 H LYS 120 H LYS 120 7.795 0.469 7.305 536 HA LYS 120 HA LYS 120 4.914 0.310 6.550 537 HB2 LYS 120 2HB LYS 120 4.468 -1.286 8.311 538 HB3 LYS 120 1HB LYS 120 5.779 -1.933 7.326 539 HG2 LYS 120 2HG LYS 120 7.414 -0.973 8.968 540 HG3 LYS 120 1HG LYS 120 6.052 -0.514 9.991 541 HD2 LYS 120 2HD LYS 120 5.329 -2.957 9.912 542 HD3 LYS 120 1HD LYS 120 6.902 -3.305 9.190 543 HE2 LYS 120 2HE LYS 120 6.225 -2.698 11.976 544 HE3 LYS 120 1HE LYS 120 7.664 -3.475 11.313 545 HZ1 LYS 120 1HZ LYS 120 8.387 -1.460 12.244 546 HZ2 LYS 120 2HZ LYS 120 7.106 -0.578 11.560 547 HZ3 LYS 120 3HZ LYS 120 8.348 -1.184 10.572 548 H ARG 121 H ARG 121 3.488 1.280 8.170 549 HA ARG 121 HA ARG 121 4.537 3.663 9.351 550 HB2 ARG 121 2HB ARG 121 1.962 2.155 9.902 551 HB3 ARG 121 1HB ARG 121 2.312 3.786 10.469 552 HG2 ARG 121 2HG ARG 121 2.632 4.506 8.105 553 HG3 ARG 121 1HG ARG 121 2.161 2.889 7.580 554 HD2 ARG 121 2HD ARG 121 0.208 4.323 7.469 555 HD3 ARG 121 1HD ARG 121 -0.009 3.189 8.802 556 HE ARG 121 HE ARG 121 1.092 5.302 10.098 557 HH11 ARG 121 1HH1 ARG 121 -0.022 7.129 10.829 558 HH12 ARG 121 2HH1 ARG 121 -1.474 7.622 10.025 559 HH21 ARG 121 1HH2 ARG 121 -1.382 5.046 7.709 560 HH22 ARG 121 2HH2 ARG 121 -2.244 6.443 8.259 561 H GLU 122 H GLU 122 4.089 0.398 10.503 562 HA GLU 122 HA GLU 122 5.208 -0.630 12.325 563 HB2 GLU 122 2HB GLU 122 6.693 1.523 12.327 564 HB3 GLU 122 1HB GLU 122 5.638 2.037 13.648 565 HG2 GLU 122 2HG GLU 122 6.123 -0.066 14.849 566 HG3 GLU 122 1HG GLU 122 7.219 -0.542 13.553 567 H ASN 123 H ASN 123 2.415 -0.056 12.039 568 HA ASN 123 HA ASN 123 1.235 1.000 14.412 569 HB2 ASN 123 2HB ASN 123 -0.796 -0.121 13.701 570 HB3 ASN 123 1HB ASN 123 0.017 0.510 12.268 571 HD21 ASN 123 1HD2 ASN 123 -0.109 -1.006 10.611 572 HD22 ASN 123 2HD2 ASN 123 0.059 -2.683 10.807 573 H GLN 124 H GLN 124 2.530 -2.180 13.636 574 HA GLN 124 HA GLN 124 2.910 -4.058 14.982 575 HB2 GLN 124 2HB GLN 124 2.762 -1.972 17.182 576 HB3 GLN 124 1HB GLN 124 3.397 -3.606 17.366 577 HG2 GLN 124 2HG GLN 124 5.127 -3.149 15.689 578 HG3 GLN 124 1HG GLN 124 4.476 -1.528 15.442 579 HE21 GLN 124 1HE2 GLN 124 7.166 -1.884 16.323 580 HE22 GLN 124 2HE2 GLN 124 7.291 -1.328 17.922 581 H LYS 125 H LYS 125 0.304 -3.902 14.181 582 HA LYS 125 HA LYS 125 -1.220 -4.641 16.644 583 HB2 LYS 125 2HB LYS 125 -2.050 -2.571 15.492 584 HB3 LYS 125 1HB LYS 125 -2.358 -3.548 14.056 585 HG2 LYS 125 2HG LYS 125 -3.917 -4.955 15.305 586 HG3 LYS 125 1HG LYS 125 -3.561 -4.073 16.790 587 HD2 LYS 125 2HD LYS 125 -5.632 -3.209 15.862 588 HD3 LYS 125 1HD LYS 125 -4.381 -1.980 15.681 589 HE2 LYS 125 2HE LYS 125 -4.218 -2.287 13.383 590 HE3 LYS 125 1HE LYS 125 -4.806 -3.947 13.460 591 HZ1 LYS 125 1HZ LYS 125 -6.271 -1.549 13.085 592 HZ2 LYS 125 2HZ LYS 125 -6.848 -2.387 14.444 593 HZ3 LYS 125 3HZ LYS 125 -6.791 -3.154 12.930 594 H ASN 126 H ASN 126 -1.811 -6.746 16.700 595 HA ASN 126 HA ASN 126 -2.072 -8.220 14.109 596 HB2 ASN 126 2HB ASN 126 -0.867 -9.249 16.697 597 HB3 ASN 126 1HB ASN 126 -1.111 -10.202 15.233 598 HD21 ASN 126 1HD2 ASN 126 -0.304 -8.331 13.258 599 HD22 ASN 126 2HD2 ASN 126 1.346 -7.989 13.464 600 H LEU 127 H LEU 127 -4.209 -6.984 15.547 601 HA LEU 127 HA LEU 127 -5.524 -9.021 17.174 602 HB2 LEU 127 2HB LEU 127 -6.627 -6.456 15.989 603 HB3 LEU 127 1HB LEU 127 -7.412 -7.442 17.224 604 HG LEU 127 HG LEU 127 -4.737 -6.037 17.498 605 HD11 LEU 127 1HD1 LEU 127 -6.514 -5.234 19.504 606 HD12 LEU 127 2HD1 LEU 127 -7.500 -5.283 18.043 607 HD13 LEU 127 3HD1 LEU 127 -6.043 -4.290 18.090 608 HD21 LEU 127 1HD2 LEU 127 -5.308 -6.808 19.984 609 HD22 LEU 127 2HD2 LEU 127 -4.467 -7.889 18.872 610 HD23 LEU 127 3HD2 LEU 127 -6.200 -8.072 19.138 611 H GLU 128 H GLU 128 -7.575 -9.996 16.614 612 HA GLU 128 HA GLU 128 -7.593 -11.244 14.074 613 HB2 GLU 128 2HB GLU 128 -9.866 -10.839 16.038 614 HB3 GLU 128 1HB GLU 128 -9.911 -11.950 14.668 615 HG2 GLU 128 2HG GLU 128 -7.926 -13.129 15.588 616 HG3 GLU 128 1HG GLU 128 -7.957 -12.052 16.984 617 H SER 129 H SER 129 -8.882 -8.195 15.141 618 HA SER 129 HA SER 129 -10.856 -7.733 13.166 619 HB2 SER 129 2HB SER 129 -8.925 -5.696 14.315 620 HB3 SER 129 1HB SER 129 -10.489 -5.355 13.578 621 HG SER 129 HG SER 129 -9.929 -6.020 16.101 622 H VAL 130 H VAL 130 -7.333 -7.521 13.001 623 HA VAL 130 HA VAL 130 -7.137 -6.156 10.509 624 HB VAL 130 HB VAL 130 -5.337 -8.235 11.779 625 HG11 VAL 130 1HG1 VAL 130 -5.211 -6.807 9.160 626 HG12 VAL 130 2HG1 VAL 130 -4.601 -8.403 9.598 627 HG13 VAL 130 3HG1 VAL 130 -3.711 -6.958 10.073 628 HG21 VAL 130 1HG2 VAL 130 -5.334 -6.246 13.081 629 HG22 VAL 130 2HG2 VAL 130 -5.397 -5.216 11.652 630 HG23 VAL 130 3HG2 VAL 130 -3.918 -6.093 12.040 631 H MET 131 H MET 131 -7.571 -9.615 11.259 632 HA MET 131 HA MET 131 -7.308 -10.598 8.606 633 HB2 MET 131 2HB MET 131 -7.587 -12.018 10.682 634 HB3 MET 131 1HB MET 131 -9.298 -11.589 10.671 635 HG2 MET 131 2HG MET 131 -9.078 -12.387 8.122 636 HG3 MET 131 1HG MET 131 -7.774 -13.354 8.810 637 HE1 MET 131 1HE MET 131 -11.285 -13.782 7.743 638 HE2 MET 131 2HE MET 131 -11.313 -12.314 8.720 639 HE3 MET 131 3HE MET 131 -12.242 -13.721 9.231 640 H ASN 132 H ASN 132 -10.025 -9.123 10.313 641 HA ASN 132 HA ASN 132 -12.025 -9.521 8.326 642 HB2 ASN 132 2HB ASN 132 -12.411 -8.653 10.661 643 HB3 ASN 132 1HB ASN 132 -11.745 -7.106 10.138 644 HD21 ASN 132 1HD2 ASN 132 -14.343 -9.454 9.293 645 HD22 ASN 132 2HD2 ASN 132 -15.410 -8.281 8.687 646 H TRP 133 H TRP 133 -9.517 -7.028 8.668 647 HA TRP 133 HA TRP 133 -10.426 -5.265 6.638 648 HB2 TRP 133 2HB TRP 133 -8.630 -4.246 7.588 649 HB3 TRP 133 1HB TRP 133 -7.875 -5.778 8.019 650 HD1 TRP 133 HD TRP 133 -6.474 -7.047 6.073 651 HE1 TRP 133 1HE TRP 133 -5.255 -6.113 4.005 652 HE3 TRP 133 3HE TRP 133 -8.584 -2.405 5.829 653 HZ2 TRP 133 2HZ TRP 133 -5.186 -3.713 2.450 654 HZ3 TRP 133 3HZ TRP 133 -7.918 -0.814 4.051 655 HH2 TRP 133 HH TRP 133 -6.221 -1.465 2.367 656 H GLN 134 H GLN 134 -8.276 -8.101 6.406 657 HA GLN 134 HA GLN 134 -7.958 -7.858 3.548 658 HB2 GLN 134 2HB GLN 134 -6.507 -9.594 3.772 659 HB3 GLN 134 1HB GLN 134 -6.688 -9.301 5.497 660 HG2 GLN 134 2HG GLN 134 -7.051 -11.627 5.229 661 HG3 GLN 134 1HG GLN 134 -8.665 -10.947 5.403 662 HE21 GLN 134 1HE2 GLN 134 -10.028 -12.013 3.961 663 HE22 GLN 134 2HE2 GLN 134 -9.638 -12.398 2.357 664 H GLN 135 H GLN 135 -10.232 -9.535 5.656 665 HA GLN 135 HA GLN 135 -11.499 -11.112 3.623 666 HB2 GLN 135 2HB GLN 135 -11.785 -11.399 6.119 667 HB3 GLN 135 1HB GLN 135 -12.798 -9.956 6.107 668 HG2 GLN 135 2HG GLN 135 -14.319 -11.037 4.490 669 HG3 GLN 135 1HG GLN 135 -13.308 -12.483 4.507 670 HE21 GLN 135 1HE2 GLN 135 -15.909 -12.899 5.285 671 HE22 GLN 135 2HE2 GLN 135 -16.018 -13.093 6.969 672 H TYR 136 H TYR 136 -12.030 -7.817 4.805 673 HA TYR 136 HA TYR 136 -14.411 -7.323 3.276 674 HB2 TYR 136 2HB TYR 136 -13.838 -5.880 5.143 675 HB3 TYR 136 1HB TYR 136 -12.319 -5.423 4.369 676 HD1 TYR 136 1HD TYR 136 -15.942 -4.921 4.439 677 HD2 TYR 136 2HD TYR 136 -12.316 -4.055 2.304 678 HE1 TYR 136 1HE TYR 136 -17.104 -3.113 3.197 679 HE2 TYR 136 2HE TYR 136 -13.476 -2.248 1.063 680 HH TYR 136 HH TYR 136 -15.776 -0.720 1.770 681 H TRP 137 H TRP 137 -11.004 -6.355 2.650 682 HA TRP 137 HA TRP 137 -11.643 -5.326 0.040 683 HB2 TRP 137 2HB TRP 137 -9.053 -6.054 1.401 684 HB3 TRP 137 1HB TRP 137 -9.095 -5.505 -0.271 685 HD1 TRP 137 HD TRP 137 -8.624 -4.164 3.023 686 HE1 TRP 137 1HE TRP 137 -9.207 -1.654 3.148 687 HE3 TRP 137 3HE TRP 137 -11.179 -3.622 -1.357 688 HZ2 TRP 137 2HZ TRP 137 -10.563 0.320 1.596 689 HZ3 TRP 137 3HZ TRP 137 -12.105 -1.420 -2.015 690 HH2 TRP 137 HH TRP 137 -11.799 0.553 -0.544 691 H LYS 138 H LYS 138 -10.332 -8.429 1.169 692 HA LYS 138 HA LYS 138 -9.792 -9.523 -1.393 693 HB2 LYS 138 2HB LYS 138 -9.112 -10.557 0.783 694 HB3 LYS 138 1HB LYS 138 -10.793 -11.026 1.042 695 HG2 LYS 138 2HG LYS 138 -10.743 -12.307 -1.087 696 HG3 LYS 138 1HG LYS 138 -9.043 -11.881 -1.284 697 HD2 LYS 138 2HD LYS 138 -8.576 -12.963 0.932 698 HD3 LYS 138 1HD LYS 138 -10.253 -13.509 0.968 699 HE2 LYS 138 2HE LYS 138 -9.767 -14.535 -1.355 700 HE3 LYS 138 1HE LYS 138 -8.066 -14.303 -0.953 701 HZ1 LYS 138 1HZ LYS 138 -8.658 -15.495 1.207 702 HZ2 LYS 138 2HZ LYS 138 -8.541 -16.433 -0.205 703 HZ3 LYS 138 3HZ LYS 138 -10.065 -15.997 0.406 704 H ASP 139 H ASP 139 -12.773 -9.619 0.557 705 HA ASP 139 HA ASP 139 -14.253 -11.116 -1.431 706 HB2 ASP 139 2HB ASP 139 -15.177 -9.426 0.903 707 HB3 ASP 139 1HB ASP 139 -16.237 -10.443 -0.073 708 H GLU 140 H GLU 140 -14.113 -7.647 -0.572 709 HA GLU 140 HA GLU 140 -16.054 -6.874 -2.561 710 HB2 GLU 140 2HB GLU 140 -13.907 -5.279 -1.133 711 HB3 GLU 140 1HB GLU 140 -15.143 -4.566 -2.171 712 HG2 GLU 140 2HG GLU 140 -15.707 -6.241 0.294 713 HG3 GLU 140 1HG GLU 140 -15.781 -4.480 0.233 714 H ILE 141 H ILE 141 -12.517 -6.980 -2.490 715 HA ILE 141 HA ILE 141 -12.597 -6.989 -5.440 716 HB ILE 141 HB ILE 141 -10.928 -5.314 -5.691 717 HG12 ILE 141 2HG1 ILE 141 -10.626 -5.409 -2.670 718 HG13 ILE 141 1HG1 ILE 141 -9.436 -5.936 -3.857 719 HG21 ILE 141 1HG2 ILE 141 -12.715 -4.325 -3.455 720 HG22 ILE 141 2HG2 ILE 141 -13.252 -4.526 -5.122 721 HG23 ILE 141 3HG2 ILE 141 -11.983 -3.363 -4.738 722 HD11 ILE 141 1HD1 ILE 141 -9.368 -3.610 -4.761 723 HD12 ILE 141 2HD1 ILE 141 -8.815 -3.725 -3.090 724 HD13 ILE 141 3HD1 ILE 141 -10.429 -3.108 -3.444 725 H GLY 142 H GLY 142 -11.458 -8.676 -6.171 726 HA2 GLY 142 2HA GLY 142 -9.842 -10.262 -4.332 727 HA3 GLY 142 1HA GLY 142 -10.108 -10.616 -6.042 728 H SER 143 H SER 143 -7.997 -9.093 -3.750 729 HA SER 143 HA SER 143 -5.973 -7.902 -4.047 730 HB2 SER 143 2HB SER 143 -5.686 -10.444 -4.783 731 HB3 SER 143 1HB SER 143 -5.413 -9.718 -6.362 732 HG SER 143 HG SER 143 -3.499 -9.967 -5.055 733 H GLN 144 H GLN 144 -7.355 -6.055 -4.975 734 HA GLN 144 HA GLN 144 -6.438 -5.512 -7.757 735 HB2 GLN 144 2HB GLN 144 -8.957 -6.209 -7.423 736 HB3 GLN 144 1HB GLN 144 -9.129 -4.544 -6.866 737 HG2 GLN 144 2HG GLN 144 -7.879 -3.882 -9.023 738 HG3 GLN 144 1HG GLN 144 -8.223 -5.523 -9.573 739 HE21 GLN 144 1HE2 GLN 144 -9.497 -3.949 -11.205 740 HE22 GLN 144 2HE2 GLN 144 -11.121 -3.671 -10.797 741 HA PRO 145 HA PRO 145 -5.156 -2.077 -4.872 742 HB2 PRO 145 2HB PRO 145 -3.142 -1.809 -7.042 743 HB3 PRO 145 1HB PRO 145 -2.908 -1.877 -5.287 744 HG2 PRO 145 2HG PRO 145 -2.273 -3.921 -6.892 745 HG3 PRO 145 1HG PRO 145 -2.864 -4.157 -5.241 746 HD2 PRO 145 2HD PRO 145 -4.296 -4.570 -7.826 747 HD3 PRO 145 1HD PRO 145 -4.488 -5.421 -6.278 748 H PHE 146 H PHE 146 -5.211 0.307 -5.391 749 HA PHE 146 HA PHE 146 -6.160 0.920 -8.135 750 HB2 PHE 146 2HB PHE 146 -7.921 2.390 -7.246 751 HB3 PHE 146 1HB PHE 146 -8.181 0.713 -6.781 752 HD1 PHE 146 1HD PHE 146 -8.216 4.001 -5.652 753 HD2 PHE 146 2HD PHE 146 -6.954 0.081 -4.433 754 HE1 PHE 146 1HE PHE 146 -8.306 4.709 -3.281 755 HE2 PHE 146 2HE PHE 146 -7.032 0.797 -2.063 756 HZ PHE 146 HZ PHE 146 -7.714 3.106 -1.485 757 H THR 147 H THR 147 -5.900 3.124 -8.775 758 HA THR 147 HA THR 147 -3.835 4.561 -7.171 759 HB THR 147 HB THR 147 -2.928 5.404 -9.245 760 HG1 THR 147 1HG THR 147 -4.974 5.538 -10.314 761 HG21 THR 147 1HG2 THR 147 -2.417 3.196 -10.419 762 HG22 THR 147 2HG2 THR 147 -3.491 2.439 -9.244 763 HG23 THR 147 3HG2 THR 147 -2.032 3.269 -8.699 764 H CYS 148 H CYS 148 -3.960 6.888 -7.273 765 HA CYS 148 HA CYS 148 -6.556 7.996 -8.145 766 HB2 CYS 148 2HB CYS 148 -5.642 9.005 -5.531 767 HB3 CYS 148 1HB CYS 148 -7.253 8.511 -6.033 768 H TYR 149 H TYR 149 -6.459 10.404 -8.251 769 HA TYR 149 HA TYR 149 -3.705 11.534 -8.170 770 HB2 TYR 149 2HB TYR 149 -5.508 11.814 -10.599 771 HB3 TYR 149 1HB TYR 149 -3.911 12.522 -10.392 772 HD1 TYR 149 1HD TYR 149 -5.772 9.514 -11.241 773 HD2 TYR 149 2HD TYR 149 -1.903 11.054 -10.198 774 HE1 TYR 149 1HE TYR 149 -4.718 7.437 -12.095 775 HE2 TYR 149 2HE TYR 149 -0.845 8.977 -11.052 776 HH TYR 149 HH TYR 149 -1.454 7.167 -12.743 777 H PHE 150 H PHE 150 -3.740 13.717 -7.526 778 HA PHE 150 HA PHE 150 -6.360 15.072 -7.585 779 HB2 PHE 150 2HB PHE 150 -6.756 14.989 -5.368 780 HB3 PHE 150 1HB PHE 150 -5.502 13.754 -5.291 781 HD1 PHE 150 1HD PHE 150 -3.154 14.383 -4.742 782 HD2 PHE 150 2HD PHE 150 -6.371 17.219 -4.593 783 HE1 PHE 150 1HE PHE 150 -1.751 15.898 -3.375 784 HE2 PHE 150 2HE PHE 150 -4.982 18.743 -3.219 785 HZ PHE 150 HZ PHE 150 -2.664 18.077 -2.604 786 H ASN 151 H ASN 151 -6.252 17.320 -7.520 787 HA ASN 151 HA ASN 151 -3.561 18.547 -7.267 788 HB2 ASN 151 2HB ASN 151 -3.701 19.665 -9.398 789 HB3 ASN 151 1HB ASN 151 -3.962 17.946 -9.680 790 HD21 ASN 151 1HD2 ASN 151 -4.950 20.079 -11.427 791 HD22 ASN 151 2HD2 ASN 151 -6.645 19.997 -11.402 792 H GLN 152 H GLN 152 -3.717 20.332 -6.064 793 HA GLN 152 HA GLN 152 -6.346 21.558 -5.533 794 HB2 GLN 152 2HB GLN 152 -4.797 21.079 -3.649 795 HB3 GLN 152 1HB GLN 152 -3.601 22.151 -4.372 796 HG2 GLN 152 2HG GLN 152 -5.039 24.067 -4.087 797 HG3 GLN 152 1HG GLN 152 -6.389 23.047 -3.593 798 HE21 GLN 152 1HE2 GLN 152 -5.705 24.999 -1.788 799 HE22 GLN 152 2HE2 GLN 152 -4.865 24.342 -0.467 800 H HIS 153 H HIS 153 -3.891 21.882 -7.761 801 HA HIS 153 HA HIS 153 -3.312 24.585 -8.016 802 HB2 HIS 153 2HB HIS 153 -3.963 22.589 -10.202 803 HB3 HIS 153 1HB HIS 153 -3.195 24.150 -10.475 804 HD1 HIS 153 1HD HIS 153 -0.704 24.100 -10.435 805 HD2 HIS 153 2HD HIS 153 -2.335 21.002 -8.166 806 HE1 HIS 153 1HE HIS 153 1.249 22.731 -9.578 807 HE2 HIS 153 2HE HIS 153 0.265 20.839 -8.203 808 H GLN 154 H GLN 154 -6.338 22.936 -8.840 809 HA GLN 154 HA GLN 154 -7.517 25.204 -10.178 810 HB2 GLN 154 2HB GLN 154 -8.778 22.830 -8.769 811 HB3 GLN 154 1HB GLN 154 -9.663 23.990 -9.756 812 HG2 GLN 154 2HG GLN 154 -8.294 23.411 -11.709 813 HG3 GLN 154 1HG GLN 154 -7.354 22.285 -10.729 814 HE21 GLN 154 1HE2 GLN 154 -8.787 21.349 -13.006 815 HE22 GLN 154 2HE2 GLN 154 -10.070 20.369 -12.479 816 H ARG 155 H ARG 155 -8.442 23.805 -7.025 817 HA ARG 155 HA ARG 155 -8.082 26.283 -5.617 818 HB2 ARG 155 2HB ARG 155 -10.524 26.077 -7.073 819 HB3 ARG 155 1HB ARG 155 -10.909 25.941 -5.357 820 HG2 ARG 155 2HG ARG 155 -9.173 28.114 -6.562 821 HG3 ARG 155 1HG ARG 155 -10.877 28.308 -6.145 822 HD2 ARG 155 2HD ARG 155 -10.391 28.605 -3.964 823 HD3 ARG 155 1HD ARG 155 -9.376 27.163 -3.932 824 HE ARG 155 HE ARG 155 -7.482 28.548 -4.256 825 HH11 ARG 155 1HH1 ARG 155 -6.500 30.574 -4.449 826 HH12 ARG 155 2HH1 ARG 155 -7.474 31.964 -4.793 827 HH21 ARG 155 1HH2 ARG 155 -10.449 30.184 -4.894 828 HH22 ARG 155 2HH2 ARG 155 -9.710 31.745 -5.044 829 HA PRO 156 HA PRO 156 -9.808 23.027 -2.691 830 HB2 PRO 156 2HB PRO 156 -11.546 21.161 -3.474 831 HB3 PRO 156 1HB PRO 156 -12.026 22.865 -3.394 832 HG2 PRO 156 2HG PRO 156 -11.459 21.182 -5.754 833 HG3 PRO 156 1HG PRO 156 -12.538 22.575 -5.591 834 HD2 PRO 156 2HD PRO 156 -9.843 22.554 -6.621 835 HD3 PRO 156 1HD PRO 156 -10.927 23.945 -6.427 836 H ASP 157 H ASP 157 -10.470 20.269 -4.606 837 HA ASP 157 HA ASP 157 -7.758 19.262 -4.811 838 HB2 ASP 157 2HB ASP 157 -8.046 17.459 -3.110 839 HB3 ASP 157 1HB ASP 157 -8.034 19.066 -2.386 840 H ASP 158 H ASP 158 -8.834 18.999 -6.989 841 HA ASP 158 HA ASP 158 -11.063 17.268 -7.412 842 HB2 ASP 158 2HB ASP 158 -9.913 18.703 -9.172 843 HB3 ASP 158 1HB ASP 158 -8.638 17.483 -9.225 844 H VAL 159 H VAL 159 -11.102 14.939 -7.781 845 HA VAL 159 HA VAL 159 -8.564 13.536 -7.058 846 HB VAL 159 HB VAL 159 -10.000 13.755 -5.040 847 HG11 VAL 159 1HG1 VAL 159 -12.144 12.610 -4.955 848 HG12 VAL 159 2HG1 VAL 159 -11.939 12.029 -6.607 849 HG13 VAL 159 3HG1 VAL 159 -12.166 13.750 -6.300 850 HG21 VAL 159 1HG2 VAL 159 -10.013 10.887 -5.993 851 HG22 VAL 159 2HG2 VAL 159 -9.749 11.492 -4.357 852 HG23 VAL 159 3HG2 VAL 159 -8.512 11.721 -5.593 853 H LEU 160 H LEU 160 -8.297 11.499 -7.938 854 HA LEU 160 HA LEU 160 -10.358 10.592 -9.913 855 HB2 LEU 160 2HB LEU 160 -7.356 10.703 -10.080 856 HB3 LEU 160 1HB LEU 160 -8.252 9.538 -11.044 857 HG LEU 160 HG LEU 160 -9.618 11.415 -11.969 858 HD11 LEU 160 1HD1 LEU 160 -7.997 12.897 -9.984 859 HD12 LEU 160 2HD1 LEU 160 -9.606 13.249 -10.613 860 HD13 LEU 160 3HD1 LEU 160 -8.178 13.686 -11.550 861 HD21 LEU 160 1HD2 LEU 160 -8.069 11.859 -13.616 862 HD22 LEU 160 2HD2 LEU 160 -7.200 10.564 -12.791 863 HD23 LEU 160 3HD2 LEU 160 -6.797 12.249 -12.459 864 H LEU 161 H LEU 161 -10.662 8.279 -9.998 865 HA LEU 161 HA LEU 161 -9.254 6.754 -7.842 866 HB2 LEU 161 2HB LEU 161 -11.607 7.419 -7.202 867 HB3 LEU 161 1HB LEU 161 -12.177 6.414 -8.535 868 HG LEU 161 HG LEU 161 -10.512 4.653 -7.355 869 HD11 LEU 161 1HD1 LEU 161 -9.951 6.339 -5.579 870 HD12 LEU 161 2HD1 LEU 161 -10.629 4.841 -4.941 871 HD13 LEU 161 3HD1 LEU 161 -11.636 6.284 -5.059 872 HD21 LEU 161 1HD2 LEU 161 -13.355 5.263 -6.486 873 HD22 LEU 161 2HD2 LEU 161 -12.524 3.726 -6.249 874 HD23 LEU 161 3HD2 LEU 161 -12.888 4.290 -7.881 875 H HIS 162 H HIS 162 -8.073 6.330 -10.093 876 HA HIS 162 HA HIS 162 -9.387 4.468 -11.893 877 HB2 HIS 162 2HB HIS 162 -6.456 5.129 -11.474 878 HB3 HIS 162 1HB HIS 162 -7.067 4.102 -12.771 879 HD1 HIS 162 1HD HIS 162 -5.645 6.689 -13.550 880 HD2 HIS 162 2HD HIS 162 -9.762 6.475 -12.914 881 HE1 HIS 162 1HE HIS 162 -6.667 8.641 -14.803 882 HE2 HIS 162 2HE HIS 162 -9.172 8.518 -14.423 883 H ARG 163 H ARG 163 -8.789 2.161 -12.095 884 HA ARG 163 HA ARG 163 -8.025 0.991 -9.445 885 HB2 ARG 163 2HB ARG 163 -9.817 -0.122 -11.621 886 HB3 ARG 163 1HB ARG 163 -9.370 -0.982 -10.148 887 HG2 ARG 163 2HG ARG 163 -10.358 0.876 -8.806 888 HG3 ARG 163 1HG ARG 163 -10.891 1.636 -10.306 889 HD2 ARG 163 2HD ARG 163 -12.134 -0.494 -10.844 890 HD3 ARG 163 1HD ARG 163 -11.744 -1.060 -9.221 891 HE ARG 163 HE ARG 163 -12.949 1.509 -8.998 892 HH11 ARG 163 1HH1 ARG 163 -15.131 1.638 -8.425 893 HH12 ARG 163 2HH1 ARG 163 -16.154 0.260 -8.648 894 HH21 ARG 163 1HH2 ARG 163 -13.632 -1.735 -9.943 895 HH22 ARG 163 2HH2 ARG 163 -15.306 -1.651 -9.509 896 H THR 164 H THR 164 -6.674 -0.889 -9.461 897 HA THR 164 HA THR 164 -4.763 -0.939 -11.686 898 HB THR 164 HB THR 164 -4.838 -2.751 -9.261 899 HG1 THR 164 1HG THR 164 -4.665 -0.188 -9.226 900 HG21 THR 164 1HG2 THR 164 -2.343 -1.808 -10.587 901 HG22 THR 164 2HG2 THR 164 -3.311 -3.006 -11.446 902 HG23 THR 164 3HG2 THR 164 -2.699 -3.361 -9.831 903 H HIS 165 H HIS 165 -4.562 -2.581 -13.198 904 HA HIS 165 HA HIS 165 -6.596 -4.777 -13.052 905 HB2 HIS 165 2HB HIS 165 -7.032 -3.131 -14.872 906 HB3 HIS 165 1HB HIS 165 -5.435 -3.475 -15.534 907 HD1 HIS 165 1HD HIS 165 -8.523 -5.489 -14.508 908 HD2 HIS 165 2HD HIS 165 -5.523 -5.496 -17.407 909 HE1 HIS 165 1HE HIS 165 -9.037 -7.420 -16.067 910 HE2 HIS 165 2HE HIS 165 -7.217 -7.433 -17.835 911 H ASP 166 H ASP 166 -5.733 -6.797 -12.994 912 HA ASP 166 HA ASP 166 -2.916 -7.249 -12.916 913 HB2 ASP 166 2HB ASP 166 -5.212 -9.167 -13.411 914 HB3 ASP 166 1HB ASP 166 -3.547 -9.672 -13.120 Start of MODEL 5 1 H1 GLN 45 1HT GLN 45 2.502 18.284 1.798 2 H2 GLN 45 2HT GLN 45 3.698 18.971 2.790 3 H3 GLN 45 3HT GLN 45 4.139 18.144 1.372 4 HA GLN 45 HA GLN 45 2.471 20.004 0.392 5 HB2 GLN 45 2HB GLN 45 4.029 21.197 2.706 6 HB3 GLN 45 1HB GLN 45 3.214 22.138 1.456 7 HG2 GLN 45 2HG GLN 45 1.058 21.141 2.082 8 HG3 GLN 45 1HG GLN 45 1.856 20.152 3.304 9 HE21 GLN 45 1HE2 GLN 45 -0.183 22.020 4.036 10 HE22 GLN 45 2HE2 GLN 45 0.529 23.267 4.940 11 H ASP 46 H ASP 46 5.589 18.860 1.254 12 HA ASP 46 HA ASP 46 7.285 20.615 -0.189 13 HB2 ASP 46 2HB ASP 46 7.485 17.620 0.249 14 HB3 ASP 46 1HB ASP 46 8.787 18.609 -0.410 15 H LEU 47 H LEU 47 5.448 17.777 -1.268 16 HA LEU 47 HA LEU 47 6.269 18.248 -4.062 17 HB2 LEU 47 2HB LEU 47 4.505 16.159 -2.753 18 HB3 LEU 47 1HB LEU 47 4.815 16.228 -4.485 19 HG LEU 47 HG LEU 47 7.203 15.905 -4.121 20 HD11 LEU 47 1HD1 LEU 47 7.858 15.304 -1.670 21 HD12 LEU 47 2HD1 LEU 47 6.416 16.211 -1.226 22 HD13 LEU 47 3HD1 LEU 47 7.725 17.006 -2.105 23 HD21 LEU 47 1HD2 LEU 47 5.735 13.908 -4.201 24 HD22 LEU 47 2HD2 LEU 47 5.570 13.979 -2.446 25 HD23 LEU 47 3HD2 LEU 47 7.142 13.639 -3.173 26 H GLN 48 H GLN 48 4.831 19.054 -5.638 27 HA GLN 48 HA GLN 48 2.611 20.629 -4.625 28 HB2 GLN 48 2HB GLN 48 4.081 21.208 -6.638 29 HB3 GLN 48 1HB GLN 48 3.158 19.996 -7.531 30 HG2 GLN 48 2HG GLN 48 2.050 22.071 -7.938 31 HG3 GLN 48 1HG GLN 48 1.056 21.225 -6.748 32 HE21 GLN 48 1HE2 GLN 48 1.191 21.967 -4.475 33 HE22 GLN 48 2HE2 GLN 48 1.785 23.515 -4.109 34 H ALA 49 H ALA 49 0.429 20.144 -4.711 35 HA ALA 49 HA ALA 49 -0.390 17.422 -4.813 36 HB1 ALA 49 1HB ALA 49 -2.713 18.406 -4.987 37 HB2 ALA 49 2HB ALA 49 -1.953 19.996 -5.076 38 HB3 ALA 49 3HB ALA 49 -1.756 19.001 -3.634 39 H THR 50 H THR 50 -1.114 16.147 -6.448 40 HA THR 50 HA THR 50 -2.156 17.031 -8.949 41 HB THR 50 HB THR 50 0.714 16.058 -9.063 42 HG1 THR 50 1HG THR 50 0.420 18.412 -10.185 43 HG21 THR 50 1HG2 THR 50 -0.825 15.395 -10.946 44 HG22 THR 50 2HG2 THR 50 0.528 16.412 -11.446 45 HG23 THR 50 3HG2 THR 50 -1.078 17.112 -11.262 46 H GLU 51 H GLU 51 0.095 14.502 -7.826 47 HA GLU 51 HA GLU 51 -1.895 12.475 -8.734 48 HB2 GLU 51 2HB GLU 51 1.104 12.199 -8.470 49 HB3 GLU 51 1HB GLU 51 -0.000 10.974 -9.094 50 HG2 GLU 51 2HG GLU 51 -0.674 12.570 -10.899 51 HG3 GLU 51 1HG GLU 51 0.550 13.695 -10.309 52 H ALA 52 H ALA 52 -2.523 10.920 -7.333 53 HA ALA 52 HA ALA 52 -1.049 10.394 -4.845 54 HB1 ALA 52 1HB ALA 52 -2.433 12.066 -3.916 55 HB2 ALA 52 2HB ALA 52 -3.365 10.592 -3.634 56 HB3 ALA 52 3HB ALA 52 -3.783 11.656 -4.977 57 H ASN 53 H ASN 53 -0.894 8.157 -5.198 58 HA ASN 53 HA ASN 53 -3.311 6.841 -6.292 59 HB2 ASN 53 2HB ASN 53 -0.454 5.899 -6.148 60 HB3 ASN 53 1HB ASN 53 -1.787 4.892 -6.709 61 HD21 ASN 53 1HD2 ASN 53 -3.247 7.106 -8.037 62 HD22 ASN 53 2HD2 ASN 53 -2.344 7.522 -9.411 63 H CYS 54 H CYS 54 -4.436 5.301 -5.240 64 HA CYS 54 HA CYS 54 -3.463 4.523 -2.524 65 HB2 CYS 54 2HB CYS 54 -6.353 4.714 -2.724 66 HB3 CYS 54 1HB CYS 54 -5.280 5.489 -1.566 67 H THR 55 H THR 55 -2.939 2.388 -3.123 68 HA THR 55 HA THR 55 -5.197 0.864 -4.343 69 HB THR 55 HB THR 55 -3.876 0.283 -6.060 70 HG1 THR 55 1HG THR 55 -1.576 -0.438 -5.082 71 HG21 THR 55 1HG2 THR 55 -2.918 2.580 -5.643 72 HG22 THR 55 2HG2 THR 55 -1.793 1.468 -6.416 73 HG23 THR 55 3HG2 THR 55 -1.646 1.814 -4.696 74 H VAL 56 H VAL 56 -5.447 -1.281 -3.798 75 HA VAL 56 HA VAL 56 -4.177 -2.074 -1.229 76 HB VAL 56 HB VAL 56 -6.682 -3.021 -2.655 77 HG11 VAL 56 1HG1 VAL 56 -5.142 -4.196 -0.342 78 HG12 VAL 56 2HG1 VAL 56 -5.791 -5.018 -1.760 79 HG13 VAL 56 3HG1 VAL 56 -6.881 -4.446 -0.498 80 HG21 VAL 56 1HG2 VAL 56 -7.776 -1.682 -1.200 81 HG22 VAL 56 2HG2 VAL 56 -6.208 -0.981 -0.797 82 HG23 VAL 56 3HG2 VAL 56 -6.853 -2.311 0.164 83 H LEU 57 H LEU 57 -2.463 -3.398 -1.510 84 HA LEU 57 HA LEU 57 -1.648 -4.485 -3.972 85 HB2 LEU 57 2HB LEU 57 -0.366 -4.274 -1.724 86 HB3 LEU 57 1HB LEU 57 -1.055 -5.852 -1.361 87 HG LEU 57 HG LEU 57 -0.136 -6.639 -3.604 88 HD11 LEU 57 1HD1 LEU 57 0.522 -3.860 -3.765 89 HD12 LEU 57 2HD1 LEU 57 0.832 -5.123 -4.954 90 HD13 LEU 57 3HD1 LEU 57 2.028 -4.774 -3.706 91 HD21 LEU 57 1HD2 LEU 57 1.486 -5.862 -1.206 92 HD22 LEU 57 2HD2 LEU 57 2.322 -6.517 -2.614 93 HD23 LEU 57 3HD2 LEU 57 1.077 -7.470 -1.805 94 H SER 58 H SER 58 -1.580 -6.803 -4.608 95 HA SER 58 HA SER 58 -4.199 -8.072 -4.071 96 HB2 SER 58 2HB SER 58 -3.761 -9.408 -6.033 97 HB3 SER 58 1HB SER 58 -3.322 -7.749 -6.435 98 HG SER 58 HG SER 58 -1.148 -8.555 -5.543 99 H VAL 59 H VAL 59 -4.214 -10.392 -3.433 100 HA VAL 59 HA VAL 59 -1.872 -10.975 -1.719 101 HB VAL 59 HB VAL 59 -4.309 -12.720 -1.809 102 HG11 VAL 59 1HG1 VAL 59 -3.699 -13.235 0.378 103 HG12 VAL 59 2HG1 VAL 59 -2.914 -11.677 0.634 104 HG13 VAL 59 3HG1 VAL 59 -2.119 -12.917 -0.337 105 HG21 VAL 59 1HG2 VAL 59 -4.195 -9.848 -1.044 106 HG22 VAL 59 2HG2 VAL 59 -5.007 -10.920 0.094 107 HG23 VAL 59 3HG2 VAL 59 -5.570 -10.814 -1.573 108 H GLN 60 H GLN 60 -0.284 -11.965 -2.850 109 HA GLN 60 HA GLN 60 -0.924 -14.539 -4.158 110 HB2 GLN 60 2HB GLN 60 0.657 -12.314 -5.485 111 HB3 GLN 60 1HB GLN 60 0.520 -13.961 -6.104 112 HG2 GLN 60 2HG GLN 60 -1.937 -13.697 -6.241 113 HG3 GLN 60 1HG GLN 60 -1.787 -12.042 -5.652 114 HE21 GLN 60 1HE2 GLN 60 -2.950 -12.226 -8.115 115 HE22 GLN 60 2HE2 GLN 60 -1.867 -11.786 -9.346 116 H GLN 61 H GLN 61 1.003 -15.929 -4.296 117 HA GLN 61 HA GLN 61 2.934 -15.248 -2.155 118 HB2 GLN 61 2HB GLN 61 2.623 -17.829 -3.706 119 HB3 GLN 61 1HB GLN 61 3.556 -17.600 -2.229 120 HG2 GLN 61 2HG GLN 61 0.552 -17.335 -2.532 121 HG3 GLN 61 1HG GLN 61 1.413 -18.610 -1.667 122 HE21 GLN 61 1HE2 GLN 61 -0.196 -15.721 -1.179 123 HE22 GLN 61 2HE2 GLN 61 0.526 -15.257 0.281 124 H ILE 62 H ILE 62 4.714 -14.157 -2.812 125 HA ILE 62 HA ILE 62 6.506 -13.444 -4.157 126 HB ILE 62 HB ILE 62 6.491 -16.395 -4.865 127 HG12 ILE 62 2HG1 ILE 62 7.953 -14.902 -2.664 128 HG13 ILE 62 1HG1 ILE 62 6.504 -15.876 -2.416 129 HG21 ILE 62 1HG2 ILE 62 8.498 -14.164 -5.173 130 HG22 ILE 62 2HG2 ILE 62 8.003 -15.372 -6.359 131 HG23 ILE 62 3HG2 ILE 62 9.036 -15.834 -5.010 132 HD11 ILE 62 1HD1 ILE 62 9.223 -16.753 -2.542 133 HD12 ILE 62 2HD1 ILE 62 8.352 -17.450 -3.908 134 HD13 ILE 62 3HD1 ILE 62 7.775 -17.720 -2.264 135 H GLY 63 H GLY 63 7.370 -13.538 -6.537 136 HA2 GLY 63 2HA GLY 63 6.889 -13.722 -8.894 137 HA3 GLY 63 1HA GLY 63 5.197 -14.016 -8.496 138 H GLU 64 H GLU 64 6.056 -11.556 -6.528 139 HA GLU 64 HA GLU 64 5.469 -9.455 -8.562 140 HB2 GLU 64 2HB GLU 64 4.268 -9.711 -5.791 141 HB3 GLU 64 1HB GLU 64 4.047 -8.326 -6.861 142 HG2 GLU 64 2HG GLU 64 3.051 -9.825 -8.570 143 HG3 GLU 64 1HG GLU 64 3.221 -11.181 -7.456 144 H VAL 65 H VAL 65 6.587 -7.528 -8.276 145 HA VAL 65 HA VAL 65 8.468 -7.423 -5.955 146 HB VAL 65 HB VAL 65 8.943 -6.351 -8.753 147 HG11 VAL 65 1HG1 VAL 65 11.338 -6.683 -7.303 148 HG12 VAL 65 2HG1 VAL 65 10.207 -5.920 -6.185 149 HG13 VAL 65 3HG1 VAL 65 10.561 -5.159 -7.737 150 HG21 VAL 65 1HG2 VAL 65 10.722 -8.458 -7.813 151 HG22 VAL 65 2HG2 VAL 65 9.811 -8.361 -9.319 152 HG23 VAL 65 3HG2 VAL 65 9.047 -9.008 -7.867 153 H PHE 66 H PHE 66 8.386 -5.540 -4.778 154 HA PHE 66 HA PHE 66 6.909 -3.239 -5.968 155 HB2 PHE 66 2HB PHE 66 6.640 -4.286 -3.138 156 HB3 PHE 66 1HB PHE 66 5.836 -2.854 -3.787 157 HD1 PHE 66 1HD PHE 66 4.242 -3.113 -5.736 158 HD2 PHE 66 2HD PHE 66 5.773 -6.464 -3.528 159 HE1 PHE 66 1HE PHE 66 2.434 -4.540 -6.647 160 HE2 PHE 66 2HE PHE 66 3.965 -7.890 -4.438 161 HZ PHE 66 HZ PHE 66 2.292 -6.929 -5.999 162 H GLU 67 H GLU 67 7.511 -1.165 -5.098 163 HA GLU 67 HA GLU 67 10.191 -1.186 -3.765 164 HB2 GLU 67 2HB GLU 67 10.756 0.801 -4.982 165 HB3 GLU 67 1HB GLU 67 10.075 -0.321 -6.161 166 HG2 GLU 67 2HG GLU 67 7.846 0.809 -5.836 167 HG3 GLU 67 1HG GLU 67 8.662 2.014 -4.838 168 H CYS 68 H CYS 68 10.543 0.505 -2.191 169 HA CYS 68 HA CYS 68 7.993 1.509 -0.997 170 HB2 CYS 68 2HB CYS 68 9.643 -0.022 0.308 171 HB3 CYS 68 1HB CYS 68 10.663 1.413 0.408 172 H THR 69 H THR 69 7.757 3.738 -0.729 173 HA THR 69 HA THR 69 10.058 5.420 -1.628 174 HB THR 69 HB THR 69 8.683 6.668 -3.003 175 HG1 THR 69 1HG THR 69 6.254 6.363 -2.524 176 HG21 THR 69 1HG2 THR 69 8.639 4.198 -3.638 177 HG22 THR 69 2HG2 THR 69 7.329 5.179 -4.293 178 HG23 THR 69 3HG2 THR 69 7.037 4.134 -2.901 179 H PHE 70 H PHE 70 10.263 7.467 -0.639 180 HA PHE 70 HA PHE 70 8.431 8.236 1.524 181 HB2 PHE 70 2HB PHE 70 10.132 8.234 3.269 182 HB3 PHE 70 1HB PHE 70 10.020 6.610 2.593 183 HD1 PHE 70 1HD PHE 70 11.741 5.791 0.993 184 HD2 PHE 70 2HD PHE 70 12.106 9.582 2.978 185 HE1 PHE 70 1HE PHE 70 14.147 5.873 0.394 186 HE2 PHE 70 2HE PHE 70 14.512 9.664 2.378 187 HZ PHE 70 HZ PHE 70 15.532 7.809 1.086 188 H THR 71 H THR 71 8.977 10.453 2.297 189 HA THR 71 HA THR 71 10.927 11.868 0.558 190 HB THR 71 HB THR 71 8.655 12.118 -0.428 191 HG1 THR 71 1HG THR 71 10.408 13.852 -0.172 192 HG21 THR 71 1HG2 THR 71 6.845 12.926 0.739 193 HG22 THR 71 2HG2 THR 71 7.845 13.879 1.835 194 HG23 THR 71 3HG2 THR 71 7.694 12.138 2.069 195 H CYS 72 H CYS 72 11.757 13.803 1.463 196 HA CYS 72 HA CYS 72 11.133 14.221 4.356 197 HB2 CYS 72 2HB CYS 72 13.298 13.911 4.963 198 HB3 CYS 72 1HB CYS 72 13.481 13.106 3.406 199 H GLY 73 H GLY 73 12.035 16.459 5.061 200 HA2 GLY 73 2HA GLY 73 11.080 18.413 3.092 201 HA3 GLY 73 1HA GLY 73 11.563 18.768 4.753 202 H ALA 74 H ALA 74 12.532 20.555 3.061 203 HA ALA 74 HA ALA 74 14.615 21.545 2.534 204 HB1 ALA 74 1HB ALA 74 16.136 19.020 2.939 205 HB2 ALA 74 2HB ALA 74 15.362 19.709 4.367 206 HB3 ALA 74 3HB ALA 74 16.529 20.663 3.449 207 H ASP 75 H ASP 75 12.856 19.821 0.786 208 HA ASP 75 HA ASP 75 12.849 19.031 -1.413 209 HB2 ASP 75 2HB ASP 75 15.422 20.636 -1.495 210 HB3 ASP 75 1HB ASP 75 14.602 19.983 -2.912 211 H CYS 76 H CYS 76 13.737 17.153 0.411 212 HA CYS 76 HA CYS 76 15.856 15.755 -1.170 213 HB2 CYS 76 2HB CYS 76 17.175 15.532 0.642 214 HB3 CYS 76 1HB CYS 76 16.117 16.670 1.474 215 H ARG 77 H ARG 77 15.032 13.929 -2.016 216 HA ARG 77 HA ARG 77 13.020 12.401 -0.429 217 HB2 ARG 77 2HB ARG 77 12.081 11.872 -2.857 218 HB3 ARG 77 1HB ARG 77 11.557 13.310 -1.980 219 HG2 ARG 77 2HG ARG 77 14.028 13.575 -3.620 220 HG3 ARG 77 1HG ARG 77 12.508 13.420 -4.499 221 HD2 ARG 77 2HD ARG 77 11.567 15.283 -3.127 222 HD3 ARG 77 1HD ARG 77 13.143 15.480 -2.363 223 HE ARG 77 HE ARG 77 13.886 16.565 -4.322 224 HH11 ARG 77 1HH1 ARG 77 13.611 17.327 -6.432 225 HH12 ARG 77 2HH1 ARG 77 12.261 16.775 -7.368 226 HH21 ARG 77 1HH2 ARG 77 11.018 14.731 -4.860 227 HH22 ARG 77 2HH2 ARG 77 10.794 15.306 -6.477 228 H GLY 78 H GLY 78 13.024 10.096 -0.905 229 HA2 GLY 78 2HA GLY 78 15.124 9.088 -2.712 230 HA3 GLY 78 1HA GLY 78 15.349 8.725 -0.999 231 H THR 79 H THR 79 14.881 6.783 -3.118 232 HA THR 79 HA THR 79 12.333 5.619 -2.092 233 HB THR 79 HB THR 79 12.387 4.520 -4.529 234 HG1 THR 79 1HG THR 79 12.970 6.416 -5.911 235 HG21 THR 79 1HG2 THR 79 10.413 5.590 -4.035 236 HG22 THR 79 2HG2 THR 79 11.061 6.735 -5.209 237 HG23 THR 79 3HG2 THR 79 11.221 7.057 -3.483 238 H SER 80 H SER 80 12.290 3.266 -2.131 239 HA SER 80 HA SER 80 15.003 2.014 -2.287 240 HB2 SER 80 2HB SER 80 12.862 1.453 -0.211 241 HB3 SER 80 1HB SER 80 14.421 0.643 -0.330 242 HG SER 80 HG SER 80 14.744 3.312 -0.346 243 H GLN 81 H GLN 81 14.954 -0.259 -2.881 244 HA GLN 81 HA GLN 81 12.421 -1.036 -4.261 245 HB2 GLN 81 2HB GLN 81 14.682 -0.637 -5.551 246 HB3 GLN 81 1HB GLN 81 15.087 -2.238 -4.937 247 HG2 GLN 81 2HG GLN 81 12.903 -1.435 -6.836 248 HG3 GLN 81 1HG GLN 81 14.061 -2.758 -6.970 249 HE21 GLN 81 1HE2 GLN 81 10.844 -2.059 -6.177 250 HE22 GLN 81 2HE2 GLN 81 10.483 -3.479 -5.326 251 H TYR 82 H TYR 82 11.400 -2.757 -3.386 252 HA TYR 82 HA TYR 82 13.021 -4.713 -1.803 253 HB2 TYR 82 2HB TYR 82 10.665 -3.127 -1.060 254 HB3 TYR 82 1HB TYR 82 10.468 -4.851 -0.748 255 HD1 TYR 82 1HD TYR 82 13.385 -2.487 -0.561 256 HD2 TYR 82 2HD TYR 82 10.925 -5.361 1.472 257 HE1 TYR 82 1HE TYR 82 14.817 -2.290 1.452 258 HE2 TYR 82 2HE TYR 82 12.358 -5.163 3.485 259 HH TYR 82 HH TYR 82 15.247 -4.165 3.592 260 HA PRO 83 HA PRO 83 11.081 -7.833 -4.272 261 HB2 PRO 83 2HB PRO 83 10.908 -9.916 -2.518 262 HB3 PRO 83 1HB PRO 83 12.453 -9.337 -3.162 263 HG2 PRO 83 2HG PRO 83 11.185 -8.808 -0.522 264 HG3 PRO 83 1HG PRO 83 12.881 -9.133 -0.918 265 HD2 PRO 83 2HD PRO 83 11.900 -6.608 -0.449 266 HD3 PRO 83 1HD PRO 83 13.310 -6.939 -1.480 267 H CYS 84 H CYS 84 9.286 -9.901 -3.112 268 HA CYS 84 HA CYS 84 6.786 -8.495 -3.393 269 HB2 CYS 84 2HB CYS 84 5.934 -10.583 -3.585 270 HB3 CYS 84 1HB CYS 84 7.602 -11.152 -3.486 271 H VAL 85 H VAL 85 5.253 -7.981 -1.776 272 HA VAL 85 HA VAL 85 6.211 -8.211 1.046 273 HB VAL 85 HB VAL 85 5.029 -5.971 1.404 274 HG11 VAL 85 1HG1 VAL 85 6.996 -4.705 0.604 275 HG12 VAL 85 2HG1 VAL 85 7.474 -6.087 -0.383 276 HG13 VAL 85 3HG1 VAL 85 7.474 -6.218 1.376 277 HG21 VAL 85 1HG2 VAL 85 4.053 -4.944 -0.353 278 HG22 VAL 85 2HG2 VAL 85 4.341 -6.406 -1.296 279 HG23 VAL 85 3HG2 VAL 85 5.522 -5.097 -1.315 280 H GLN 86 H GLN 86 4.404 -8.024 2.633 281 HA GLN 86 HA GLN 86 2.312 -9.844 2.049 282 HB2 GLN 86 2HB GLN 86 2.360 -7.687 4.178 283 HB3 GLN 86 1HB GLN 86 1.338 -9.125 4.176 284 HG2 GLN 86 2HG GLN 86 4.372 -9.128 4.205 285 HG3 GLN 86 1HG GLN 86 3.343 -9.470 5.591 286 HE21 GLN 86 1HE2 GLN 86 5.230 -11.124 3.577 287 HE22 GLN 86 2HE2 GLN 86 4.322 -12.539 3.352 288 H VAL 87 H VAL 87 -0.001 -8.375 3.078 289 HA VAL 87 HA VAL 87 -0.542 -6.655 0.688 290 HB VAL 87 HB VAL 87 -1.733 -8.800 0.556 291 HG11 VAL 87 1HG1 VAL 87 -3.183 -9.565 2.247 292 HG12 VAL 87 2HG1 VAL 87 -3.284 -7.976 3.005 293 HG13 VAL 87 3HG1 VAL 87 -1.813 -8.934 3.159 294 HG21 VAL 87 1HG2 VAL 87 -2.745 -6.344 0.083 295 HG22 VAL 87 2HG2 VAL 87 -3.896 -6.892 1.297 296 HG23 VAL 87 3HG2 VAL 87 -3.677 -7.815 -0.187 297 H TYR 88 H TYR 88 -1.781 -4.821 0.955 298 HA TYR 88 HA TYR 88 -3.238 -4.113 3.277 299 HB2 TYR 88 2HB TYR 88 -0.973 -4.044 4.291 300 HB3 TYR 88 1HB TYR 88 -0.507 -2.836 3.119 301 HD1 TYR 88 1HD TYR 88 0.057 -1.815 5.515 302 HD2 TYR 88 2HD TYR 88 -3.933 -2.200 3.937 303 HE1 TYR 88 1HE TYR 88 -0.737 -0.049 7.049 304 HE2 TYR 88 2HE TYR 88 -4.703 -0.442 5.467 305 HH TYR 88 HH TYR 88 -4.066 0.591 7.557 306 H VAL 89 H VAL 89 -1.804 -1.271 2.809 307 HA VAL 89 HA VAL 89 -3.093 -0.713 0.187 308 HB VAL 89 HB VAL 89 -4.686 -0.140 2.021 309 HG11 VAL 89 1HG1 VAL 89 -4.090 1.141 3.809 310 HG12 VAL 89 2HG1 VAL 89 -3.063 2.193 2.834 311 HG13 VAL 89 3HG1 VAL 89 -2.453 0.635 3.390 312 HG21 VAL 89 1HG2 VAL 89 -3.495 2.234 0.550 313 HG22 VAL 89 2HG2 VAL 89 -5.115 2.167 1.248 314 HG23 VAL 89 3HG2 VAL 89 -4.695 1.121 -0.109 315 H ASN 90 H ASN 90 -1.894 0.639 -1.074 316 HA ASN 90 HA ASN 90 0.629 1.668 0.065 317 HB2 ASN 90 2HB ASN 90 -0.428 1.606 -2.779 318 HB3 ASN 90 1HB ASN 90 1.176 2.154 -2.307 319 HD21 ASN 90 1HD2 ASN 90 0.316 -0.334 -0.222 320 HD22 ASN 90 2HD2 ASN 90 1.053 -1.627 -1.036 321 H ASN 91 H ASN 91 0.613 3.730 0.859 322 HA ASN 91 HA ASN 91 -1.514 5.575 -0.060 323 HB2 ASN 91 2HB ASN 91 0.515 5.796 2.186 324 HB3 ASN 91 1HB ASN 91 -0.708 7.013 1.819 325 HD21 ASN 91 1HD2 ASN 91 -0.688 5.662 4.343 326 HD22 ASN 91 2HD2 ASN 91 -2.064 4.673 4.434 327 H SER 92 H SER 92 -0.616 5.991 -2.158 328 HA SER 92 HA SER 92 2.047 7.253 -2.273 329 HB2 SER 92 2HB SER 92 0.588 7.354 -4.757 330 HB3 SER 92 1HB SER 92 2.064 6.475 -4.379 331 HG SER 92 HG SER 92 0.717 4.857 -3.424 332 H GLU 93 H GLU 93 -0.330 8.505 -0.922 333 HA GLU 93 HA GLU 93 -1.405 10.637 -2.458 334 HB2 GLU 93 2HB GLU 93 -0.632 10.788 0.472 335 HB3 GLU 93 1HB GLU 93 -1.921 11.677 -0.343 336 HG2 GLU 93 2HG GLU 93 -3.046 9.503 -0.843 337 HG3 GLU 93 1HG GLU 93 -1.799 8.682 0.101 338 H SER 94 H SER 94 1.743 9.967 -1.471 339 HA SER 94 HA SER 94 2.762 12.449 -2.622 340 HB2 SER 94 2HB SER 94 3.616 13.448 -0.727 341 HB3 SER 94 1HB SER 94 2.221 12.668 0.009 342 HG SER 94 HG SER 94 4.905 11.759 -0.089 343 H ASN 95 H ASN 95 3.494 9.561 -0.670 344 HA ASN 95 HA ASN 95 5.037 8.176 -2.499 345 HB2 ASN 95 2HB ASN 95 7.398 8.857 -1.492 346 HB3 ASN 95 1HB ASN 95 6.703 9.760 -2.835 347 HD21 ASN 95 1HD2 ASN 95 6.601 11.984 -2.509 348 HD22 ASN 95 2HD2 ASN 95 6.590 12.748 -0.994 349 H SER 96 H SER 96 3.384 7.524 -0.330 350 HA SER 96 HA SER 96 5.336 6.176 1.508 351 HB2 SER 96 2HB SER 96 3.591 6.312 3.266 352 HB3 SER 96 1HB SER 96 4.111 7.907 2.727 353 HG SER 96 HG SER 96 2.270 7.897 1.326 354 H ARG 97 H ARG 97 4.878 4.020 2.051 355 HA ARG 97 HA ARG 97 2.537 2.779 0.687 356 HB2 ARG 97 2HB ARG 97 4.650 2.363 -0.601 357 HB3 ARG 97 1HB ARG 97 5.317 1.576 0.829 358 HG2 ARG 97 2HG ARG 97 2.648 0.591 0.075 359 HG3 ARG 97 1HG ARG 97 3.887 0.293 -1.143 360 HD2 ARG 97 2HD ARG 97 4.248 -0.374 1.787 361 HD3 ARG 97 1HD ARG 97 3.659 -1.533 0.595 362 HE ARG 97 HE ARG 97 6.415 -0.558 0.835 363 HH11 ARG 97 1HH1 ARG 97 7.892 -1.562 -0.551 364 HH12 ARG 97 2HH1 ARG 97 7.307 -2.533 -1.861 365 HH21 ARG 97 1HH2 ARG 97 3.964 -2.010 -1.104 366 HH22 ARG 97 2HH2 ARG 97 5.084 -2.786 -2.174 367 H ALA 98 H ALA 98 1.316 1.715 2.173 368 HA ALA 98 HA ALA 98 2.577 1.001 4.767 369 HB1 ALA 98 1HB ALA 98 0.265 2.323 4.312 370 HB2 ALA 98 2HB ALA 98 0.532 1.335 5.748 371 HB3 ALA 98 3HB ALA 98 -0.349 0.672 4.372 372 H LEU 99 H LEU 99 2.963 -1.109 5.257 373 HA LEU 99 HA LEU 99 1.688 -3.203 3.537 374 HB2 LEU 99 2HB LEU 99 3.727 -4.570 4.011 375 HB3 LEU 99 1HB LEU 99 4.080 -3.092 3.114 376 HG LEU 99 HG LEU 99 4.249 -2.269 5.755 377 HD11 LEU 99 1HD1 LEU 99 4.127 -4.765 6.312 378 HD12 LEU 99 2HD1 LEU 99 5.511 -3.890 6.968 379 HD13 LEU 99 3HD1 LEU 99 5.707 -4.910 5.541 380 HD21 LEU 99 1HD2 LEU 99 6.687 -2.226 5.309 381 HD22 LEU 99 2HD2 LEU 99 5.771 -1.667 3.909 382 HD23 LEU 99 3HD2 LEU 99 6.446 -3.296 3.927 383 H LEU 100 H LEU 100 0.560 -4.778 4.586 384 HA LEU 100 HA LEU 100 0.811 -4.932 7.565 385 HB2 LEU 100 2HB LEU 100 -1.335 -3.862 6.746 386 HB3 LEU 100 1HB LEU 100 -1.716 -5.391 5.954 387 HG LEU 100 HG LEU 100 -1.479 -6.534 8.176 388 HD11 LEU 100 1HD1 LEU 100 -0.221 -5.204 9.588 389 HD12 LEU 100 2HD1 LEU 100 -1.837 -4.714 10.092 390 HD13 LEU 100 3HD1 LEU 100 -0.921 -3.707 8.973 391 HD21 LEU 100 1HD2 LEU 100 -3.677 -5.976 8.876 392 HD22 LEU 100 2HD2 LEU 100 -3.663 -5.613 7.150 393 HD23 LEU 100 3HD2 LEU 100 -3.516 -4.309 8.328 394 H HIS 101 H HIS 101 0.815 -7.037 8.435 395 HA HIS 101 HA HIS 101 1.278 -9.175 6.445 396 HB2 HIS 101 2HB HIS 101 1.440 -9.401 9.456 397 HB3 HIS 101 1HB HIS 101 2.191 -10.451 8.255 398 HD1 HIS 101 1HD HIS 101 3.159 -7.958 6.446 399 HD2 HIS 101 2HD HIS 101 3.951 -8.540 10.499 400 HE1 HIS 101 1HE HIS 101 5.260 -6.641 6.963 401 HE2 HIS 101 2HE HIS 101 5.747 -6.980 9.430 402 H SER 102 H SER 102 -0.423 -10.393 5.811 403 HA SER 102 HA SER 102 -2.986 -10.314 7.092 404 HB2 SER 102 2HB SER 102 -2.547 -10.983 4.690 405 HB3 SER 102 1HB SER 102 -1.926 -12.515 5.295 406 HG SER 102 HG SER 102 -4.112 -12.726 4.811 407 H ASP 103 H ASP 103 -0.243 -12.539 7.291 408 HA ASP 103 HA ASP 103 -0.901 -13.351 9.964 409 HB2 ASP 103 2HB ASP 103 -2.679 -14.561 8.525 410 HB3 ASP 103 1HB ASP 103 -1.341 -15.555 7.950 411 H GLU 104 H GLU 104 0.696 -14.874 10.789 412 HA GLU 104 HA GLU 104 3.283 -14.578 9.574 413 HB2 GLU 104 2HB GLU 104 2.303 -16.452 11.752 414 HB3 GLU 104 1HB GLU 104 3.997 -16.208 11.330 415 HG2 GLU 104 2HG GLU 104 3.755 -13.786 11.828 416 HG3 GLU 104 1HG GLU 104 2.084 -14.074 12.317 417 H HIS 105 H HIS 105 0.810 -17.087 9.452 418 HA HIS 105 HA HIS 105 2.365 -19.204 8.393 419 HB2 HIS 105 2HB HIS 105 0.055 -19.529 9.124 420 HB3 HIS 105 1HB HIS 105 -0.522 -18.463 7.843 421 HD1 HIS 105 1HD HIS 105 1.349 -21.761 8.240 422 HD2 HIS 105 2HD HIS 105 -0.959 -19.725 5.431 423 HE1 HIS 105 1HE HIS 105 0.985 -23.369 6.314 424 HE2 HIS 105 2HE HIS 105 -0.422 -22.140 4.596 425 H GLN 106 H GLN 106 0.791 -16.459 6.779 426 HA GLN 106 HA GLN 106 1.308 -17.269 4.099 427 HB2 GLN 106 2HB GLN 106 -0.146 -15.326 4.793 428 HB3 GLN 106 1HB GLN 106 1.329 -14.423 5.143 429 HG2 GLN 106 2HG GLN 106 2.071 -14.712 2.811 430 HG3 GLN 106 1HG GLN 106 0.604 -15.625 2.454 431 HE21 GLN 106 1HE2 GLN 106 0.924 -13.381 0.920 432 HE22 GLN 106 2HE2 GLN 106 -0.102 -12.132 1.435 433 H LEU 107 H LEU 107 3.276 -15.497 6.444 434 HA LEU 107 HA LEU 107 5.443 -14.810 4.755 435 HB2 LEU 107 2HB LEU 107 5.203 -13.983 7.077 436 HB3 LEU 107 1HB LEU 107 5.519 -15.608 7.684 437 HG LEU 107 HG LEU 107 7.745 -15.556 6.550 438 HD11 LEU 107 1HD1 LEU 107 6.611 -13.016 5.560 439 HD12 LEU 107 2HD1 LEU 107 7.871 -14.035 4.861 440 HD13 LEU 107 3HD1 LEU 107 8.271 -12.894 6.146 441 HD21 LEU 107 1HD2 LEU 107 8.432 -14.868 8.581 442 HD22 LEU 107 2HD2 LEU 107 6.869 -14.097 8.861 443 HD23 LEU 107 3HD2 LEU 107 8.172 -13.194 8.086 444 H LEU 108 H LEU 108 4.879 -17.781 6.663 445 HA LEU 108 HA LEU 108 7.289 -19.108 5.877 446 HB2 LEU 108 2HB LEU 108 5.712 -19.867 7.707 447 HB3 LEU 108 1HB LEU 108 4.596 -20.390 6.447 448 HG LEU 108 HG LEU 108 6.442 -21.820 5.505 449 HD11 LEU 108 1HD1 LEU 108 8.521 -21.350 6.255 450 HD12 LEU 108 2HD1 LEU 108 8.068 -22.190 7.736 451 HD13 LEU 108 3HD1 LEU 108 7.899 -20.438 7.629 452 HD21 LEU 108 1HD2 LEU 108 4.876 -22.192 7.906 453 HD22 LEU 108 2HD2 LEU 108 6.387 -23.094 8.026 454 HD23 LEU 108 3HD2 LEU 108 5.299 -23.375 6.668 455 H THR 109 H THR 109 4.115 -18.761 4.432 456 HA THR 109 HA THR 109 4.565 -20.568 2.219 457 HB THR 109 HB THR 109 2.591 -18.283 2.506 458 HG1 THR 109 1HG THR 109 1.791 -19.509 3.991 459 HG21 THR 109 1HG2 THR 109 3.182 -19.860 0.313 460 HG22 THR 109 2HG2 THR 109 1.680 -18.977 0.575 461 HG23 THR 109 3HG2 THR 109 1.799 -20.673 1.039 462 H ASN 110 H ASN 110 5.228 -17.206 2.894 463 HA ASN 110 HA ASN 110 6.365 -16.906 0.147 464 HB2 ASN 110 2HB ASN 110 4.211 -15.586 0.621 465 HB3 ASN 110 1HB ASN 110 5.184 -14.629 1.738 466 HD21 ASN 110 1HD2 ASN 110 4.002 -13.572 -0.719 467 HD22 ASN 110 2HD2 ASN 110 5.283 -13.103 -1.727 468 HA PRO 111 HA PRO 111 9.480 -16.075 3.488 469 HB2 PRO 111 2HB PRO 111 11.338 -17.882 2.653 470 HB3 PRO 111 1HB PRO 111 10.032 -18.290 3.778 471 HG2 PRO 111 2HG PRO 111 10.284 -18.862 0.879 472 HG3 PRO 111 1HG PRO 111 9.561 -19.838 2.168 473 HD2 PRO 111 2HD PRO 111 8.111 -18.318 0.369 474 HD3 PRO 111 1HD PRO 111 7.521 -18.811 1.966 475 H LYS 112 H LYS 112 11.514 -15.019 3.198 476 HA LYS 112 HA LYS 112 13.074 -13.668 2.102 477 HB2 LYS 112 2HB LYS 112 13.445 -15.847 0.815 478 HB3 LYS 112 1HB LYS 112 12.390 -15.175 -0.428 479 HG2 LYS 112 2HG LYS 112 13.865 -13.202 -0.614 480 HG3 LYS 112 1HG LYS 112 14.938 -13.900 0.601 481 HD2 LYS 112 2HD LYS 112 15.211 -15.906 -0.872 482 HD3 LYS 112 1HD LYS 112 14.271 -15.073 -2.111 483 HE2 LYS 112 2HE LYS 112 15.926 -13.446 -2.458 484 HE3 LYS 112 1HE LYS 112 16.674 -13.737 -0.888 485 HZ1 LYS 112 1HZ LYS 112 16.862 -16.142 -2.107 486 HZ2 LYS 112 2HZ LYS 112 18.104 -14.986 -2.029 487 HZ3 LYS 112 3HZ LYS 112 17.103 -15.070 -3.400 488 H CYS 113 H CYS 113 10.735 -12.460 2.510 489 HA CYS 113 HA CYS 113 10.341 -10.918 -0.005 490 HB2 CYS 113 2HB CYS 113 8.317 -12.437 1.542 491 HB3 CYS 113 1HB CYS 113 7.841 -10.811 1.052 492 H SER 114 H SER 114 8.457 -10.531 2.941 493 HA SER 114 HA SER 114 9.495 -7.790 3.203 494 HB2 SER 114 2HB SER 114 7.373 -9.322 4.727 495 HB3 SER 114 1HB SER 114 7.793 -7.643 5.047 496 HG SER 114 HG SER 114 7.452 -7.883 2.445 497 H TYR 115 H TYR 115 10.822 -10.591 4.115 498 HA TYR 115 HA TYR 115 11.239 -10.334 6.923 499 HB2 TYR 115 2HB TYR 115 12.920 -11.971 6.697 500 HB3 TYR 115 1HB TYR 115 11.807 -12.323 5.378 501 HD1 TYR 115 1HD TYR 115 12.340 -11.414 3.056 502 HD2 TYR 115 2HD TYR 115 15.180 -11.417 6.276 503 HE1 TYR 115 1HE TYR 115 14.190 -11.160 1.423 504 HE2 TYR 115 2HE TYR 115 17.031 -11.157 4.645 505 HH TYR 115 HH TYR 115 17.526 -11.462 2.367 506 H ILE 116 H ILE 116 12.861 -8.815 4.177 507 HA ILE 116 HA ILE 116 15.010 -7.693 5.791 508 HB ILE 116 HB ILE 116 14.869 -6.047 3.610 509 HG12 ILE 116 2HG1 ILE 116 13.839 -8.743 2.685 510 HG13 ILE 116 1HG1 ILE 116 12.816 -7.316 2.862 511 HG21 ILE 116 1HG2 ILE 116 16.908 -7.110 3.940 512 HG22 ILE 116 2HG2 ILE 116 16.324 -7.983 2.527 513 HG23 ILE 116 3HG2 ILE 116 16.170 -8.697 4.129 514 HD11 ILE 116 1HD1 ILE 116 14.158 -7.968 0.567 515 HD12 ILE 116 2HD1 ILE 116 15.299 -6.863 1.332 516 HD13 ILE 116 3HD1 ILE 116 13.654 -6.332 0.989 517 HA PRO 117 HA PRO 117 13.464 -4.140 7.848 518 HB2 PRO 117 2HB PRO 117 14.866 -2.541 5.731 519 HB3 PRO 117 1HB PRO 117 14.861 -2.316 7.491 520 HG2 PRO 117 2HG PRO 117 16.890 -3.512 6.180 521 HG3 PRO 117 1HG PRO 117 16.435 -3.926 7.840 522 HD2 PRO 117 2HD PRO 117 16.174 -5.547 5.415 523 HD3 PRO 117 1HD PRO 117 15.989 -6.040 7.112 524 HA PRO 118 HA PRO 118 10.127 -3.347 4.778 525 HB2 PRO 118 2HB PRO 118 8.038 -3.867 6.413 526 HB3 PRO 118 1HB PRO 118 8.974 -5.163 5.641 527 HG2 PRO 118 2HG PRO 118 9.018 -4.210 8.443 528 HG3 PRO 118 1HG PRO 118 9.283 -5.836 7.793 529 HD2 PRO 118 2HD PRO 118 11.293 -4.024 8.595 530 HD3 PRO 118 1HD PRO 118 11.536 -5.508 7.651 531 H CYS 119 H CYS 119 8.771 -1.485 4.555 532 HA CYS 119 HA CYS 119 9.159 0.556 6.684 533 HB2 CYS 119 2HB CYS 119 7.951 1.891 4.625 534 HB3 CYS 119 1HB CYS 119 9.698 1.740 4.808 535 H LYS 120 H LYS 120 7.522 0.535 8.138 536 HA LYS 120 HA LYS 120 4.727 0.436 7.093 537 HB2 LYS 120 2HB LYS 120 4.146 -0.908 9.150 538 HB3 LYS 120 1HB LYS 120 5.165 -1.764 7.991 539 HG2 LYS 120 2HG LYS 120 7.172 -1.012 9.328 540 HG3 LYS 120 1HG LYS 120 6.053 -0.401 10.547 541 HD2 LYS 120 2HD LYS 120 5.100 -2.655 10.817 542 HD3 LYS 120 1HD LYS 120 6.200 -3.273 9.585 543 HE2 LYS 120 2HE LYS 120 7.493 -1.767 11.778 544 HE3 LYS 120 1HE LYS 120 6.759 -3.298 12.251 545 HZ1 LYS 120 1HZ LYS 120 8.516 -4.310 11.400 546 HZ2 LYS 120 2HZ LYS 120 9.145 -2.847 10.811 547 HZ3 LYS 120 3HZ LYS 120 8.071 -3.757 9.860 548 H ARG 121 H ARG 121 3.281 1.792 8.176 549 HA ARG 121 HA ARG 121 4.346 4.066 9.529 550 HB2 ARG 121 2HB ARG 121 1.513 3.002 9.385 551 HB3 ARG 121 1HB ARG 121 1.952 4.594 9.995 552 HG2 ARG 121 2HG ARG 121 3.028 5.098 7.798 553 HG3 ARG 121 1HG ARG 121 2.445 3.546 7.196 554 HD2 ARG 121 2HD ARG 121 0.724 5.825 8.216 555 HD3 ARG 121 1HD ARG 121 0.895 5.321 6.535 556 HE ARG 121 HE ARG 121 0.032 3.018 7.730 557 HH11 ARG 121 1HH1 ARG 121 -2.138 2.502 8.096 558 HH12 ARG 121 2HH1 ARG 121 -3.298 3.776 8.276 559 HH21 ARG 121 1HH2 ARG 121 -0.973 6.314 7.859 560 HH22 ARG 121 2HH2 ARG 121 -2.639 5.933 8.141 561 H GLU 122 H GLU 122 2.895 1.069 10.740 562 HA GLU 122 HA GLU 122 3.620 1.951 13.494 563 HB2 GLU 122 2HB GLU 122 1.285 0.236 12.623 564 HB3 GLU 122 1HB GLU 122 1.737 0.547 14.301 565 HG2 GLU 122 2HG GLU 122 1.013 2.680 12.271 566 HG3 GLU 122 1HG GLU 122 -0.053 2.072 13.533 567 H ASN 123 H ASN 123 4.458 0.305 14.872 568 HA ASN 123 HA ASN 123 6.190 -1.579 13.645 569 HB2 ASN 123 2HB ASN 123 5.032 -1.733 16.435 570 HB3 ASN 123 1HB ASN 123 6.550 -2.440 15.879 571 HD21 ASN 123 1HD2 ASN 123 4.940 0.612 16.681 572 HD22 ASN 123 2HD2 ASN 123 6.357 1.546 16.753 573 H GLN 124 H GLN 124 2.936 -1.952 15.007 574 HA GLN 124 HA GLN 124 2.373 -4.209 13.282 575 HB2 GLN 124 2HB GLN 124 3.838 -5.286 15.007 576 HB3 GLN 124 1HB GLN 124 2.663 -4.817 16.238 577 HG2 GLN 124 2HG GLN 124 2.142 -7.078 15.619 578 HG3 GLN 124 1HG GLN 124 0.910 -6.055 14.880 579 HE21 GLN 124 1HE2 GLN 124 0.460 -7.100 12.911 580 HE22 GLN 124 2HE2 GLN 124 1.639 -7.527 11.766 581 H LYS 125 H LYS 125 0.152 -4.601 13.214 582 HA LYS 125 HA LYS 125 -1.502 -2.815 14.923 583 HB2 LYS 125 2HB LYS 125 -2.127 -4.195 12.298 584 HB3 LYS 125 1HB LYS 125 -3.265 -3.192 13.197 585 HG2 LYS 125 2HG LYS 125 -1.638 -1.298 13.052 586 HG3 LYS 125 1HG LYS 125 -0.612 -2.306 12.030 587 HD2 LYS 125 2HD LYS 125 -2.512 -2.553 10.431 588 HD3 LYS 125 1HD LYS 125 -3.455 -1.444 11.425 589 HE2 LYS 125 2HE LYS 125 -1.135 -0.027 11.096 590 HE3 LYS 125 1HE LYS 125 -1.248 -0.874 9.553 591 HZ1 LYS 125 1HZ LYS 125 -2.549 1.403 10.156 592 HZ2 LYS 125 2HZ LYS 125 -3.742 0.236 10.480 593 HZ3 LYS 125 3HZ LYS 125 -3.022 0.313 8.943 594 H ASN 126 H ASN 126 -3.517 -3.707 15.800 595 HA ASN 126 HA ASN 126 -3.178 -6.221 17.092 596 HB2 ASN 126 2HB ASN 126 -4.714 -4.416 17.877 597 HB3 ASN 126 1HB ASN 126 -5.788 -4.780 16.526 598 HD21 ASN 126 1HD2 ASN 126 -4.237 -6.378 19.361 599 HD22 ASN 126 2HD2 ASN 126 -5.498 -7.488 19.611 600 H LEU 127 H LEU 127 -4.157 -8.268 16.667 601 HA LEU 127 HA LEU 127 -4.223 -9.112 13.968 602 HB2 LEU 127 2HB LEU 127 -5.583 -10.319 16.397 603 HB3 LEU 127 1HB LEU 127 -5.425 -11.130 14.841 604 HG LEU 127 HG LEU 127 -2.922 -10.791 15.020 605 HD11 LEU 127 1HD1 LEU 127 -2.294 -10.560 17.582 606 HD12 LEU 127 2HD1 LEU 127 -3.822 -9.686 17.660 607 HD13 LEU 127 3HD1 LEU 127 -2.538 -9.123 16.591 608 HD21 LEU 127 1HD2 LEU 127 -2.701 -12.579 16.848 609 HD22 LEU 127 2HD2 LEU 127 -3.761 -12.972 15.493 610 HD23 LEU 127 3HD2 LEU 127 -4.450 -12.453 17.032 611 H GLU 128 H GLU 128 -6.813 -7.932 16.063 612 HA GLU 128 HA GLU 128 -9.031 -8.587 14.438 613 HB2 GLU 128 2HB GLU 128 -9.173 -7.597 16.736 614 HB3 GLU 128 1HB GLU 128 -8.668 -6.047 16.060 615 HG2 GLU 128 2HG GLU 128 -11.077 -6.025 16.183 616 HG3 GLU 128 1HG GLU 128 -10.638 -6.195 14.483 617 H SER 129 H SER 129 -6.628 -6.049 14.145 618 HA SER 129 HA SER 129 -7.930 -4.368 12.270 619 HB2 SER 129 2HB SER 129 -4.977 -5.034 12.379 620 HB3 SER 129 1HB SER 129 -5.699 -3.604 11.651 621 HG SER 129 HG SER 129 -6.070 -2.790 13.590 622 H VAL 130 H VAL 130 -6.219 -7.428 11.838 623 HA VAL 130 HA VAL 130 -5.983 -7.352 9.003 624 HB VAL 130 HB VAL 130 -6.342 -9.686 10.902 625 HG11 VAL 130 1HG1 VAL 130 -6.855 -10.844 9.012 626 HG12 VAL 130 2HG1 VAL 130 -5.139 -10.676 8.638 627 HG13 VAL 130 3HG1 VAL 130 -6.304 -9.541 7.956 628 HG21 VAL 130 1HG2 VAL 130 -3.873 -9.956 10.242 629 HG22 VAL 130 2HG2 VAL 130 -4.257 -8.587 11.283 630 HG23 VAL 130 3HG2 VAL 130 -3.991 -8.336 9.558 631 H MET 131 H MET 131 -8.673 -8.472 11.077 632 HA MET 131 HA MET 131 -10.320 -9.454 8.984 633 HB2 MET 131 2HB MET 131 -10.909 -8.267 11.689 634 HB3 MET 131 1HB MET 131 -12.219 -8.713 10.603 635 HG2 MET 131 2HG MET 131 -10.015 -10.580 11.531 636 HG3 MET 131 1HG MET 131 -11.653 -10.547 12.183 637 HE1 MET 131 1HE MET 131 -13.635 -10.502 10.803 638 HE2 MET 131 2HE MET 131 -13.952 -11.651 9.506 639 HE3 MET 131 3HE MET 131 -13.340 -10.043 9.118 640 H ASN 132 H ASN 132 -9.850 -6.193 10.257 641 HA ASN 132 HA ASN 132 -11.930 -4.927 8.782 642 HB2 ASN 132 2HB ASN 132 -9.270 -3.883 9.758 643 HB3 ASN 132 1HB ASN 132 -10.542 -2.866 9.094 644 HD21 ASN 132 1HD2 ASN 132 -9.668 -2.547 11.803 645 HD22 ASN 132 2HD2 ASN 132 -10.928 -3.024 12.835 646 H TRP 133 H TRP 133 -8.531 -5.594 7.960 647 HA TRP 133 HA TRP 133 -8.572 -4.214 5.447 648 HB2 TRP 133 2HB TRP 133 -6.413 -4.663 6.169 649 HB3 TRP 133 1HB TRP 133 -6.820 -6.295 6.698 650 HD1 TRP 133 HD TRP 133 -6.153 -4.278 3.493 651 HE1 TRP 133 1HE TRP 133 -5.461 -5.913 1.630 652 HE3 TRP 133 3HE TRP 133 -6.874 -8.714 5.906 653 HZ2 TRP 133 2HZ TRP 133 -5.233 -8.736 1.217 654 HZ3 TRP 133 3HZ TRP 133 -6.401 -10.861 4.759 655 HH2 TRP 133 HH TRP 133 -5.584 -10.875 2.418 656 H GLN 134 H GLN 134 -8.941 -7.711 6.158 657 HA GLN 134 HA GLN 134 -9.517 -8.336 3.389 658 HB2 GLN 134 2HB GLN 134 -10.443 -10.508 4.475 659 HB3 GLN 134 1HB GLN 134 -8.721 -10.178 4.608 660 HG2 GLN 134 2HG GLN 134 -8.833 -10.014 6.854 661 HG3 GLN 134 1HG GLN 134 -10.230 -8.944 6.774 662 HE21 GLN 134 1HE2 GLN 134 -12.207 -10.474 5.639 663 HE22 GLN 134 2HE2 GLN 134 -12.504 -11.866 6.565 664 H GLN 135 H GLN 135 -11.583 -8.012 6.283 665 HA GLN 135 HA GLN 135 -14.032 -8.557 4.931 666 HB2 GLN 135 2HB GLN 135 -13.673 -8.538 7.427 667 HB3 GLN 135 1HB GLN 135 -13.667 -6.779 7.355 668 HG2 GLN 135 2HG GLN 135 -15.928 -6.819 6.345 669 HG3 GLN 135 1HG GLN 135 -15.934 -8.581 6.462 670 HE21 GLN 135 1HE2 GLN 135 -17.961 -7.352 7.840 671 HE22 GLN 135 2HE2 GLN 135 -17.653 -7.352 9.509 672 H TYR 136 H TYR 136 -12.287 -5.515 5.487 673 HA TYR 136 HA TYR 136 -14.375 -3.834 4.434 674 HB2 TYR 136 2HB TYR 136 -12.582 -2.954 5.872 675 HB3 TYR 136 1HB TYR 136 -11.399 -3.324 4.615 676 HD1 TYR 136 1HD TYR 136 -11.230 -2.034 2.609 677 HD2 TYR 136 2HD TYR 136 -14.249 -1.159 5.528 678 HE1 TYR 136 1HE TYR 136 -11.687 0.123 1.482 679 HE2 TYR 136 2HE TYR 136 -14.710 1.006 4.406 680 HH TYR 136 HH TYR 136 -13.496 2.596 2.915 681 H TRP 137 H TRP 137 -11.287 -4.895 2.953 682 HA TRP 137 HA TRP 137 -12.036 -3.795 0.383 683 HB2 TRP 137 2HB TRP 137 -9.789 -5.634 1.226 684 HB3 TRP 137 1HB TRP 137 -9.957 -4.963 -0.393 685 HD1 TRP 137 HD TRP 137 -8.293 -4.266 2.732 686 HE1 TRP 137 1HE TRP 137 -7.618 -1.788 2.938 687 HE3 TRP 137 3HE TRP 137 -11.093 -2.284 -1.036 688 HZ2 TRP 137 2HZ TRP 137 -8.195 0.708 1.668 689 HZ3 TRP 137 3HZ TRP 137 -11.018 0.146 -1.520 690 HH2 TRP 137 HH TRP 137 -9.573 1.643 -0.173 691 H LYS 138 H LYS 138 -11.923 -7.113 1.698 692 HA LYS 138 HA LYS 138 -12.527 -8.445 -0.733 693 HB2 LYS 138 2HB LYS 138 -11.864 -9.549 1.445 694 HB3 LYS 138 1HB LYS 138 -13.520 -9.288 1.998 695 HG2 LYS 138 2HG LYS 138 -14.360 -10.564 0.047 696 HG3 LYS 138 1HG LYS 138 -12.696 -10.868 -0.455 697 HD2 LYS 138 2HD LYS 138 -12.287 -11.960 1.768 698 HD3 LYS 138 1HD LYS 138 -14.004 -11.778 2.123 699 HE2 LYS 138 2HE LYS 138 -14.645 -13.299 0.458 700 HE3 LYS 138 1HE LYS 138 -13.129 -13.115 -0.425 701 HZ1 LYS 138 1HZ LYS 138 -12.256 -14.780 0.716 702 HZ2 LYS 138 2HZ LYS 138 -13.761 -15.046 1.457 703 HZ3 LYS 138 3HZ LYS 138 -12.616 -14.033 2.195 704 H ASP 139 H ASP 139 -14.653 -6.981 1.678 705 HA ASP 139 HA ASP 139 -17.112 -7.867 0.475 706 HB2 ASP 139 2HB ASP 139 -16.846 -7.070 2.846 707 HB3 ASP 139 1HB ASP 139 -16.695 -5.428 2.217 708 H GLU 140 H GLU 140 -15.048 -5.052 -0.094 709 HA GLU 140 HA GLU 140 -17.124 -3.938 -1.899 710 HB2 GLU 140 2HB GLU 140 -14.543 -2.707 -0.905 711 HB3 GLU 140 1HB GLU 140 -15.775 -1.889 -1.869 712 HG2 GLU 140 2HG GLU 140 -17.432 -2.320 -0.062 713 HG3 GLU 140 1HG GLU 140 -16.150 -3.040 0.912 714 H ILE 141 H ILE 141 -13.569 -3.851 -2.101 715 HA ILE 141 HA ILE 141 -13.745 -4.055 -4.988 716 HB ILE 141 HB ILE 141 -11.361 -3.770 -5.006 717 HG12 ILE 141 2HG1 ILE 141 -11.426 -4.317 -2.017 718 HG13 ILE 141 1HG1 ILE 141 -10.838 -5.455 -3.229 719 HG21 ILE 141 1HG2 ILE 141 -12.640 -1.774 -4.428 720 HG22 ILE 141 2HG2 ILE 141 -11.127 -1.781 -3.523 721 HG23 ILE 141 3HG2 ILE 141 -12.634 -2.232 -2.725 722 HD11 ILE 141 1HD1 ILE 141 -9.354 -3.424 -1.965 723 HD12 ILE 141 2HD1 ILE 141 -9.608 -2.869 -3.619 724 HD13 ILE 141 3HD1 ILE 141 -8.843 -4.430 -3.321 725 H GLY 142 H GLY 142 -13.579 -6.387 -2.498 726 HA2 GLY 142 2HA GLY 142 -13.540 -8.746 -2.719 727 HA3 GLY 142 1HA GLY 142 -13.468 -8.528 -4.466 728 H SER 143 H SER 143 -11.200 -6.988 -4.742 729 HA SER 143 HA SER 143 -8.863 -7.467 -3.401 730 HB2 SER 143 2HB SER 143 -8.091 -9.578 -4.865 731 HB3 SER 143 1HB SER 143 -8.863 -9.772 -3.293 732 HG SER 143 HG SER 143 -9.846 -11.040 -4.948 733 H GLN 144 H GLN 144 -9.259 -5.432 -4.903 734 HA GLN 144 HA GLN 144 -7.615 -5.884 -7.329 735 HB2 GLN 144 2HB GLN 144 -10.419 -4.883 -7.237 736 HB3 GLN 144 1HB GLN 144 -9.316 -4.130 -8.389 737 HG2 GLN 144 2HG GLN 144 -8.755 -6.338 -9.318 738 HG3 GLN 144 1HG GLN 144 -9.834 -7.108 -8.154 739 HE21 GLN 144 1HE2 GLN 144 -10.627 -4.013 -9.696 740 HE22 GLN 144 2HE2 GLN 144 -11.910 -4.611 -10.635 741 HA PRO 145 HA PRO 145 -5.753 -2.286 -5.183 742 HB2 PRO 145 2HB PRO 145 -4.109 -2.198 -7.644 743 HB3 PRO 145 1HB PRO 145 -3.599 -2.286 -5.953 744 HG2 PRO 145 2HG PRO 145 -3.460 -4.368 -7.681 745 HG3 PRO 145 1HG PRO 145 -3.614 -4.547 -5.930 746 HD2 PRO 145 2HD PRO 145 -5.617 -5.051 -8.036 747 HD3 PRO 145 1HD PRO 145 -5.552 -5.666 -6.373 748 H PHE 146 H PHE 146 -5.694 0.070 -5.715 749 HA PHE 146 HA PHE 146 -6.892 0.780 -8.315 750 HB2 PHE 146 2HB PHE 146 -8.521 2.301 -7.226 751 HB3 PHE 146 1HB PHE 146 -8.827 0.608 -6.861 752 HD1 PHE 146 1HD PHE 146 -7.488 -0.240 -4.641 753 HD2 PHE 146 2HD PHE 146 -8.643 3.806 -5.509 754 HE1 PHE 146 1HE PHE 146 -7.409 0.308 -2.227 755 HE2 PHE 146 2HE PHE 146 -8.564 4.347 -3.096 756 HZ PHE 146 HZ PHE 146 -7.943 2.600 -1.452 757 H THR 147 H THR 147 -6.513 2.943 -8.959 758 HA THR 147 HA THR 147 -4.354 4.291 -7.403 759 HB THR 147 HB THR 147 -3.517 5.160 -9.521 760 HG1 THR 147 1HG THR 147 -4.550 4.795 -11.391 761 HG21 THR 147 1HG2 THR 147 -2.388 3.195 -9.242 762 HG22 THR 147 2HG2 THR 147 -3.299 2.735 -10.681 763 HG23 THR 147 3HG2 THR 147 -3.868 2.248 -9.084 764 H CYS 148 H CYS 148 -4.417 6.623 -7.482 765 HA CYS 148 HA CYS 148 -7.015 7.779 -8.277 766 HB2 CYS 148 2HB CYS 148 -5.986 8.774 -5.699 767 HB3 CYS 148 1HB CYS 148 -7.623 8.314 -6.145 768 H TYR 149 H TYR 149 -6.895 10.122 -8.512 769 HA TYR 149 HA TYR 149 -4.125 11.247 -8.537 770 HB2 TYR 149 2HB TYR 149 -6.091 11.333 -10.845 771 HB3 TYR 149 1HB TYR 149 -4.661 12.350 -10.737 772 HD1 TYR 149 1HD TYR 149 -2.615 11.575 -11.551 773 HD2 TYR 149 2HD TYR 149 -5.697 8.746 -10.586 774 HE1 TYR 149 1HE TYR 149 -1.217 9.742 -12.463 775 HE2 TYR 149 2HE TYR 149 -4.302 6.914 -11.500 776 HH TYR 149 HH TYR 149 -2.144 7.051 -13.464 777 H PHE 150 H PHE 150 -4.124 13.313 -7.677 778 HA PHE 150 HA PHE 150 -6.679 14.791 -7.685 779 HB2 PHE 150 2HB PHE 150 -7.135 14.427 -5.509 780 HB3 PHE 150 1HB PHE 150 -5.774 13.309 -5.447 781 HD1 PHE 150 1HD PHE 150 -7.029 16.536 -4.457 782 HD2 PHE 150 2HD PHE 150 -3.456 14.225 -5.004 783 HE1 PHE 150 1HE PHE 150 -5.792 18.135 -3.027 784 HE2 PHE 150 2HE PHE 150 -2.202 15.808 -3.582 785 HZ PHE 150 HZ PHE 150 -3.368 17.772 -2.580 786 H ASN 151 H ASN 151 -6.445 17.048 -7.412 787 HA ASN 151 HA ASN 151 -3.683 18.066 -7.055 788 HB2 ASN 151 2HB ASN 151 -3.603 19.198 -9.105 789 HB3 ASN 151 1HB ASN 151 -4.261 17.624 -9.527 790 HD21 ASN 151 1HD2 ASN 151 -6.370 17.559 -10.422 791 HD22 ASN 151 2HD2 ASN 151 -7.345 18.932 -10.628 792 H GLN 152 H GLN 152 -3.801 19.646 -5.595 793 HA GLN 152 HA GLN 152 -6.316 21.127 -5.150 794 HB2 GLN 152 2HB GLN 152 -5.115 20.283 -3.181 795 HB3 GLN 152 1HB GLN 152 -3.666 21.159 -3.669 796 HG2 GLN 152 2HG GLN 152 -4.837 23.293 -3.429 797 HG3 GLN 152 1HG GLN 152 -6.331 22.450 -3.022 798 HE21 GLN 152 1HE2 GLN 152 -5.449 24.211 -1.106 799 HE22 GLN 152 2HE2 GLN 152 -4.759 23.386 0.207 800 H HIS 153 H HIS 153 -3.215 21.520 -6.655 801 HA HIS 153 HA HIS 153 -2.827 24.294 -6.470 802 HB2 HIS 153 2HB HIS 153 -1.426 24.110 -8.390 803 HB3 HIS 153 1HB HIS 153 -1.279 22.582 -7.529 804 HD1 HIS 153 1HD HIS 153 -3.455 24.025 -10.326 805 HD2 HIS 153 2HD HIS 153 -1.697 20.418 -9.173 806 HE1 HIS 153 1HE HIS 153 -3.952 22.363 -12.174 807 HE2 HIS 153 2HE HIS 153 -2.878 20.169 -11.487 808 H GLN 154 H GLN 154 -5.243 22.542 -8.302 809 HA GLN 154 HA GLN 154 -5.849 24.683 -10.145 810 HB2 GLN 154 2HB GLN 154 -6.629 22.309 -10.432 811 HB3 GLN 154 1HB GLN 154 -7.735 22.556 -9.081 812 HG2 GLN 154 2HG GLN 154 -8.842 24.382 -10.290 813 HG3 GLN 154 1HG GLN 154 -7.710 24.200 -11.630 814 HE21 GLN 154 1HE2 GLN 154 -10.372 23.889 -12.285 815 HE22 GLN 154 2HE2 GLN 154 -10.740 22.252 -12.542 816 H ARG 155 H ARG 155 -7.686 23.559 -7.292 817 HA ARG 155 HA ARG 155 -7.835 26.181 -6.139 818 HB2 ARG 155 2HB ARG 155 -9.691 25.817 -8.212 819 HB3 ARG 155 1HB ARG 155 -10.614 25.570 -6.732 820 HG2 ARG 155 2HG ARG 155 -10.737 27.901 -7.109 821 HG3 ARG 155 1HG ARG 155 -9.513 27.710 -5.856 822 HD2 ARG 155 2HD ARG 155 -8.928 29.299 -7.769 823 HD3 ARG 155 1HD ARG 155 -7.732 28.061 -7.403 824 HE ARG 155 HE ARG 155 -8.119 27.165 -9.548 825 HH11 ARG 155 1HH1 ARG 155 -9.220 27.031 -11.517 826 HH12 ARG 155 2HH1 ARG 155 -10.731 27.858 -11.707 827 HH21 ARG 155 1HH2 ARG 155 -10.730 29.153 -8.490 828 HH22 ARG 155 2HH2 ARG 155 -11.586 29.059 -9.994 829 HA PRO 156 HA PRO 156 -10.093 23.076 -3.451 830 HB2 PRO 156 2HB PRO 156 -11.804 21.316 -4.476 831 HB3 PRO 156 1HB PRO 156 -12.114 23.051 -4.657 832 HG2 PRO 156 2HG PRO 156 -11.253 21.094 -6.687 833 HG3 PRO 156 1HG PRO 156 -12.098 22.638 -6.891 834 HD2 PRO 156 2HD PRO 156 -9.219 22.098 -7.076 835 HD3 PRO 156 1HD PRO 156 -10.098 23.577 -7.509 836 H ASP 157 H ASP 157 -10.650 20.219 -5.161 837 HA ASP 157 HA ASP 157 -8.010 19.019 -4.874 838 HB2 ASP 157 2HB ASP 157 -10.261 18.176 -3.017 839 HB3 ASP 157 1HB ASP 157 -8.710 17.358 -3.172 840 H ASP 158 H ASP 158 -8.829 18.793 -7.216 841 HA ASP 158 HA ASP 158 -11.073 17.190 -7.900 842 HB2 ASP 158 2HB ASP 158 -8.378 17.430 -9.278 843 HB3 ASP 158 1HB ASP 158 -9.788 16.650 -9.993 844 H VAL 159 H VAL 159 -11.202 14.852 -8.289 845 HA VAL 159 HA VAL 159 -8.931 13.293 -7.145 846 HB VAL 159 HB VAL 159 -10.481 11.942 -5.806 847 HG11 VAL 159 1HG1 VAL 159 -11.230 14.746 -5.085 848 HG12 VAL 159 2HG1 VAL 159 -9.515 14.338 -5.130 849 HG13 VAL 159 3HG1 VAL 159 -10.605 13.453 -4.062 850 HG21 VAL 159 1HG2 VAL 159 -12.835 13.293 -5.621 851 HG22 VAL 159 2HG2 VAL 159 -12.592 11.916 -6.696 852 HG23 VAL 159 3HG2 VAL 159 -12.456 13.559 -7.324 853 H LEU 160 H LEU 160 -8.724 11.186 -7.932 854 HA LEU 160 HA LEU 160 -10.599 10.370 -10.119 855 HB2 LEU 160 2HB LEU 160 -8.333 11.207 -10.950 856 HB3 LEU 160 1HB LEU 160 -7.622 9.837 -10.104 857 HG LEU 160 HG LEU 160 -9.138 8.315 -11.398 858 HD11 LEU 160 1HD1 LEU 160 -10.927 9.385 -12.309 859 HD12 LEU 160 2HD1 LEU 160 -9.820 9.754 -13.630 860 HD13 LEU 160 3HD1 LEU 160 -10.096 10.940 -12.354 861 HD21 LEU 160 1HD2 LEU 160 -7.218 8.150 -12.581 862 HD22 LEU 160 2HD2 LEU 160 -6.879 9.870 -12.396 863 HD23 LEU 160 3HD2 LEU 160 -7.918 9.312 -13.707 864 H LEU 161 H LEU 161 -10.960 8.052 -10.200 865 HA LEU 161 HA LEU 161 -9.680 6.502 -7.992 866 HB2 LEU 161 2HB LEU 161 -11.963 7.351 -7.321 867 HB3 LEU 161 1HB LEU 161 -12.635 6.352 -8.610 868 HG LEU 161 HG LEU 161 -11.061 4.516 -7.411 869 HD11 LEU 161 1HD1 LEU 161 -10.497 6.391 -5.703 870 HD12 LEU 161 2HD1 LEU 161 -10.912 4.795 -5.079 871 HD13 LEU 161 3HD1 LEU 161 -12.112 6.088 -5.063 872 HD21 LEU 161 1HD2 LEU 161 -13.436 4.226 -7.874 873 HD22 LEU 161 2HD2 LEU 161 -13.858 5.355 -6.587 874 HD23 LEU 161 3HD2 LEU 161 -13.128 3.800 -6.191 875 H HIS 162 H HIS 162 -8.579 5.914 -10.259 876 HA HIS 162 HA HIS 162 -10.082 4.088 -11.953 877 HB2 HIS 162 2HB HIS 162 -7.115 4.622 -11.641 878 HB3 HIS 162 1HB HIS 162 -7.768 3.474 -12.810 879 HD1 HIS 162 1HD HIS 162 -6.339 5.703 -14.111 880 HD2 HIS 162 2HD HIS 162 -10.335 6.105 -12.978 881 HE1 HIS 162 1HE HIS 162 -7.298 7.583 -15.514 882 HE2 HIS 162 2HE HIS 162 -9.729 7.834 -14.833 883 H ARG 163 H ARG 163 -9.713 1.733 -12.043 884 HA ARG 163 HA ARG 163 -8.899 0.630 -9.379 885 HB2 ARG 163 2HB ARG 163 -10.947 -0.400 -11.359 886 HB3 ARG 163 1HB ARG 163 -10.483 -1.225 -9.870 887 HG2 ARG 163 2HG ARG 163 -11.178 0.793 -8.577 888 HG3 ARG 163 1HG ARG 163 -11.735 1.528 -10.081 889 HD2 ARG 163 2HD ARG 163 -13.230 -0.479 -10.411 890 HD3 ARG 163 1HD ARG 163 -12.780 -1.004 -8.788 891 HE ARG 163 HE ARG 163 -13.698 1.692 -8.644 892 HH11 ARG 163 1HH1 ARG 163 -15.802 2.074 -7.907 893 HH12 ARG 163 2HH1 ARG 163 -16.966 0.792 -7.952 894 HH21 ARG 163 1HH2 ARG 163 -14.763 -1.520 -9.304 895 HH22 ARG 163 2HH2 ARG 163 -16.378 -1.242 -8.742 896 H THR 164 H THR 164 -7.891 -1.501 -9.400 897 HA THR 164 HA THR 164 -6.324 -1.972 -11.894 898 HB THR 164 HB THR 164 -5.736 -3.059 -9.135 899 HG1 THR 164 1HG THR 164 -4.047 -1.258 -9.476 900 HG21 THR 164 1HG2 THR 164 -3.507 -3.408 -10.053 901 HG22 THR 164 2HG2 THR 164 -3.981 -2.640 -11.568 902 HG23 THR 164 3HG2 THR 164 -4.694 -4.185 -11.100 903 H HIS 165 H HIS 165 -6.407 -3.974 -12.899 904 HA HIS 165 HA HIS 165 -8.345 -5.940 -11.737 905 HB2 HIS 165 2HB HIS 165 -7.591 -5.453 -14.636 906 HB3 HIS 165 1HB HIS 165 -8.731 -6.675 -14.069 907 HD1 HIS 165 1HD HIS 165 -10.803 -5.610 -12.571 908 HD2 HIS 165 2HD HIS 165 -8.799 -3.021 -15.158 909 HE1 HIS 165 1HE HIS 165 -12.325 -3.610 -12.907 910 HE2 HIS 165 2HE HIS 165 -11.114 -2.029 -14.479 911 H ASP 166 H ASP 166 -7.657 -8.053 -11.492 912 HA ASP 166 HA ASP 166 -6.083 -9.776 -11.220 913 HB2 ASP 166 2HB ASP 166 -6.495 -9.849 -13.693 914 HB3 ASP 166 1HB ASP 166 -5.114 -8.775 -13.913 Start of MODEL 6 1 H1 GLN 45 1HT GLN 45 4.649 14.067 -0.359 2 H2 GLN 45 2HT GLN 45 5.154 15.592 -0.912 3 H3 GLN 45 3HT GLN 45 6.110 14.218 -1.207 4 HA GLN 45 HA GLN 45 4.380 13.290 -2.619 5 HB2 GLN 45 2HB GLN 45 2.496 14.439 -1.450 6 HB3 GLN 45 1HB GLN 45 3.022 15.963 -2.160 7 HG2 GLN 45 2HG GLN 45 2.747 14.959 -4.428 8 HG3 GLN 45 1HG GLN 45 2.115 13.496 -3.672 9 HE21 GLN 45 1HE2 GLN 45 -0.126 13.456 -3.505 10 HE22 GLN 45 2HE2 GLN 45 -1.125 14.826 -3.435 11 H ASP 46 H ASP 46 4.237 16.780 -3.150 12 HA ASP 46 HA ASP 46 6.583 16.732 -4.912 13 HB2 ASP 46 2HB ASP 46 4.637 15.827 -6.279 14 HB3 ASP 46 1HB ASP 46 3.876 17.407 -6.091 15 H LEU 47 H LEU 47 6.873 19.001 -5.896 16 HA LEU 47 HA LEU 47 6.810 20.965 -3.872 17 HB2 LEU 47 2HB LEU 47 6.744 21.440 -6.868 18 HB3 LEU 47 1HB LEU 47 7.295 22.584 -5.645 19 HG LEU 47 HG LEU 47 8.539 19.884 -6.241 20 HD11 LEU 47 1HD1 LEU 47 9.091 21.496 -7.960 21 HD12 LEU 47 2HD1 LEU 47 10.492 21.332 -6.902 22 HD13 LEU 47 3HD1 LEU 47 9.434 22.735 -6.753 23 HD21 LEU 47 1HD2 LEU 47 8.940 21.932 -4.082 24 HD22 LEU 47 2HD2 LEU 47 10.336 21.028 -4.671 25 HD23 LEU 47 3HD2 LEU 47 8.964 20.171 -3.968 26 H GLN 48 H GLN 48 4.440 20.186 -6.372 27 HA GLN 48 HA GLN 48 2.494 21.931 -4.933 28 HB2 GLN 48 2HB GLN 48 2.700 21.650 -7.946 29 HB3 GLN 48 1HB GLN 48 1.541 22.648 -7.067 30 HG2 GLN 48 2HG GLN 48 4.531 23.000 -6.779 31 HG3 GLN 48 1HG GLN 48 3.587 23.871 -7.988 32 HE21 GLN 48 1HE2 GLN 48 1.525 23.390 -5.406 33 HE22 GLN 48 2HE2 GLN 48 1.782 24.847 -4.575 34 H ALA 49 H ALA 49 0.264 21.207 -5.155 35 HA ALA 49 HA ALA 49 -0.057 18.376 -4.978 36 HB1 ALA 49 1HB ALA 49 -2.012 20.638 -5.414 37 HB2 ALA 49 2HB ALA 49 -1.695 19.751 -3.922 38 HB3 ALA 49 3HB ALA 49 -2.530 18.958 -5.258 39 H THR 50 H THR 50 -0.831 16.867 -6.508 40 HA THR 50 HA THR 50 -1.752 17.560 -9.130 41 HB THR 50 HB THR 50 1.088 16.517 -9.036 42 HG1 THR 50 1HG THR 50 1.172 18.774 -10.179 43 HG21 THR 50 1HG2 THR 50 -0.464 15.919 -10.977 44 HG22 THR 50 2HG2 THR 50 1.044 16.724 -11.409 45 HG23 THR 50 3HG2 THR 50 -0.464 17.638 -11.373 46 H GLU 51 H GLU 51 0.465 15.035 -7.921 47 HA GLU 51 HA GLU 51 -1.585 13.030 -8.741 48 HB2 GLU 51 2HB GLU 51 1.403 12.686 -8.485 49 HB3 GLU 51 1HB GLU 51 0.265 11.498 -9.118 50 HG2 GLU 51 2HG GLU 51 -0.364 13.133 -10.912 51 HG3 GLU 51 1HG GLU 51 0.897 14.210 -10.316 52 H ALA 52 H ALA 52 -2.217 11.479 -7.357 53 HA ALA 52 HA ALA 52 -0.768 10.916 -4.859 54 HB1 ALA 52 1HB ALA 52 -3.639 11.910 -4.902 55 HB2 ALA 52 2HB ALA 52 -2.267 12.758 -4.184 56 HB3 ALA 52 3HB ALA 52 -2.827 11.237 -3.489 57 H ASN 53 H ASN 53 -0.640 8.666 -5.226 58 HA ASN 53 HA ASN 53 -3.070 7.420 -6.392 59 HB2 ASN 53 2HB ASN 53 -0.235 6.420 -6.242 60 HB3 ASN 53 1HB ASN 53 -1.582 5.434 -6.806 61 HD21 ASN 53 1HD2 ASN 53 -3.044 7.557 -8.169 62 HD22 ASN 53 2HD2 ASN 53 -2.130 8.016 -9.523 63 H CYS 54 H CYS 54 -4.235 5.853 -5.421 64 HA CYS 54 HA CYS 54 -3.352 4.982 -2.704 65 HB2 CYS 54 2HB CYS 54 -6.234 5.236 -2.972 66 HB3 CYS 54 1HB CYS 54 -5.176 5.946 -1.759 67 H THR 55 H THR 55 -2.854 2.847 -3.367 68 HA THR 55 HA THR 55 -5.124 1.411 -4.664 69 HB THR 55 HB THR 55 -3.807 0.879 -6.400 70 HG1 THR 55 1HG THR 55 -1.980 -0.379 -6.018 71 HG21 THR 55 1HG2 THR 55 -1.694 2.017 -6.698 72 HG22 THR 55 2HG2 THR 55 -1.539 2.284 -4.964 73 HG23 THR 55 3HG2 THR 55 -2.784 3.129 -5.877 74 H VAL 56 H VAL 56 -5.406 -0.754 -4.211 75 HA VAL 56 HA VAL 56 -4.182 -1.666 -1.659 76 HB VAL 56 HB VAL 56 -6.677 -2.525 -3.153 77 HG11 VAL 56 1HG1 VAL 56 -4.999 -3.951 -1.201 78 HG12 VAL 56 2HG1 VAL 56 -6.252 -4.575 -2.274 79 HG13 VAL 56 3HG1 VAL 56 -6.695 -3.841 -0.733 80 HG21 VAL 56 1HG2 VAL 56 -6.891 -1.907 -0.321 81 HG22 VAL 56 2HG2 VAL 56 -7.773 -1.216 -1.681 82 HG23 VAL 56 3HG2 VAL 56 -6.204 -0.554 -1.220 83 H LEU 57 H LEU 57 -2.533 -3.053 -1.922 84 HA LEU 57 HA LEU 57 -1.649 -4.055 -4.400 85 HB2 LEU 57 2HB LEU 57 -0.464 -3.948 -2.081 86 HB3 LEU 57 1HB LEU 57 -1.173 -5.541 -1.834 87 HG LEU 57 HG LEU 57 -0.159 -6.188 -4.092 88 HD11 LEU 57 1HD1 LEU 57 0.958 -4.631 -5.270 89 HD12 LEU 57 2HD1 LEU 57 2.014 -4.309 -3.894 90 HD13 LEU 57 3HD1 LEU 57 0.498 -3.427 -4.067 91 HD21 LEU 57 1HD2 LEU 57 0.822 -7.049 -2.077 92 HD22 LEU 57 2HD2 LEU 57 1.549 -5.490 -1.691 93 HD23 LEU 57 3HD2 LEU 57 2.153 -6.430 -3.056 94 H SER 58 H SER 58 -1.574 -6.357 -5.094 95 HA SER 58 HA SER 58 -4.224 -7.618 -4.720 96 HB2 SER 58 2HB SER 58 -3.663 -8.924 -6.693 97 HB3 SER 58 1HB SER 58 -3.277 -7.239 -7.032 98 HG SER 58 HG SER 58 -1.650 -9.008 -7.485 99 H VAL 59 H VAL 59 -4.267 -9.980 -4.203 100 HA VAL 59 HA VAL 59 -2.015 -10.634 -2.384 101 HB VAL 59 HB VAL 59 -4.646 -12.105 -2.661 102 HG11 VAL 59 1HG1 VAL 59 -3.419 -11.985 -0.036 103 HG12 VAL 59 2HG1 VAL 59 -2.285 -12.627 -1.224 104 HG13 VAL 59 3HG1 VAL 59 -3.853 -13.400 -0.996 105 HG21 VAL 59 1HG2 VAL 59 -5.551 -10.715 -0.925 106 HG22 VAL 59 2HG2 VAL 59 -4.883 -9.609 -2.123 107 HG23 VAL 59 3HG2 VAL 59 -3.994 -9.942 -0.637 108 H GLN 60 H GLN 60 -0.423 -11.777 -3.301 109 HA GLN 60 HA GLN 60 -1.105 -14.227 -4.809 110 HB2 GLN 60 2HB GLN 60 0.779 -12.083 -5.842 111 HB3 GLN 60 1HB GLN 60 0.589 -13.686 -6.555 112 HG2 GLN 60 2HG GLN 60 -1.819 -13.216 -6.927 113 HG3 GLN 60 1HG GLN 60 -1.592 -11.598 -6.268 114 HE21 GLN 60 1HE2 GLN 60 -2.486 -11.423 -8.767 115 HE22 GLN 60 2HE2 GLN 60 -1.254 -11.128 -9.897 116 H GLN 61 H GLN 61 0.724 -15.763 -4.806 117 HA GLN 61 HA GLN 61 2.433 -15.336 -2.427 118 HB2 GLN 61 2HB GLN 61 2.094 -17.789 -4.170 119 HB3 GLN 61 1HB GLN 61 2.949 -17.728 -2.632 120 HG2 GLN 61 2HG GLN 61 -0.002 -17.182 -3.062 121 HG3 GLN 61 1HG GLN 61 0.690 -18.615 -2.301 122 HE21 GLN 61 1HE2 GLN 61 -0.630 -15.606 -1.602 123 HE22 GLN 61 2HE2 GLN 61 0.033 -15.387 -0.060 124 H ILE 62 H ILE 62 4.293 -14.251 -2.852 125 HA ILE 62 HA ILE 62 6.260 -13.579 -3.943 126 HB ILE 62 HB ILE 62 6.234 -16.530 -4.643 127 HG12 ILE 62 2HG1 ILE 62 7.543 -15.045 -2.341 128 HG13 ILE 62 1HG1 ILE 62 6.037 -15.952 -2.207 129 HG21 ILE 62 1HG2 ILE 62 7.909 -15.568 -6.007 130 HG22 ILE 62 2HG2 ILE 62 8.791 -16.081 -4.572 131 HG23 ILE 62 3HG2 ILE 62 8.356 -14.387 -4.775 132 HD11 ILE 62 1HD1 ILE 62 8.829 -16.951 -2.568 133 HD12 ILE 62 2HD1 ILE 62 7.524 -17.871 -3.317 134 HD13 ILE 62 3HD1 ILE 62 7.524 -17.600 -1.576 135 H GLY 63 H GLY 63 7.429 -13.622 -6.169 136 HA2 GLY 63 2HA GLY 63 7.280 -13.738 -8.573 137 HA3 GLY 63 1HA GLY 63 5.546 -14.025 -8.424 138 H GLU 64 H GLU 64 6.318 -11.613 -6.292 139 HA GLU 64 HA GLU 64 5.858 -9.469 -8.315 140 HB2 GLU 64 2HB GLU 64 4.546 -9.747 -5.597 141 HB3 GLU 64 1HB GLU 64 4.383 -8.347 -6.657 142 HG2 GLU 64 2HG GLU 64 3.427 -9.805 -8.417 143 HG3 GLU 64 1HG GLU 64 3.552 -11.185 -7.326 144 H VAL 65 H VAL 65 6.978 -7.556 -7.941 145 HA VAL 65 HA VAL 65 8.760 -7.506 -5.541 146 HB VAL 65 HB VAL 65 10.440 -6.363 -6.932 147 HG11 VAL 65 1HG1 VAL 65 10.857 -8.661 -6.932 148 HG12 VAL 65 2HG1 VAL 65 10.725 -8.325 -8.658 149 HG13 VAL 65 3HG1 VAL 65 9.362 -9.033 -7.791 150 HG21 VAL 65 1HG2 VAL 65 9.792 -6.673 -9.534 151 HG22 VAL 65 2HG2 VAL 65 9.431 -5.198 -8.639 152 HG23 VAL 65 3HG2 VAL 65 8.179 -6.417 -8.870 153 H PHE 66 H PHE 66 8.658 -5.614 -4.357 154 HA PHE 66 HA PHE 66 7.212 -3.314 -5.593 155 HB2 PHE 66 2HB PHE 66 6.848 -4.382 -2.783 156 HB3 PHE 66 1HB PHE 66 6.066 -2.945 -3.445 157 HD1 PHE 66 1HD PHE 66 5.912 -6.525 -3.126 158 HD2 PHE 66 2HD PHE 66 4.629 -3.219 -5.551 159 HE1 PHE 66 1HE PHE 66 4.136 -7.939 -4.117 160 HE2 PHE 66 2HE PHE 66 2.854 -4.633 -6.542 161 HZ PHE 66 HZ PHE 66 2.604 -6.996 -5.826 162 H GLU 67 H GLU 67 7.710 -1.240 -4.620 163 HA GLU 67 HA GLU 67 10.404 -1.212 -3.311 164 HB2 GLU 67 2HB GLU 67 9.084 1.000 -4.918 165 HB3 GLU 67 1HB GLU 67 10.741 0.976 -4.313 166 HG2 GLU 67 2HG GLU 67 11.174 -1.044 -5.718 167 HG3 GLU 67 1HG GLU 67 9.551 -0.869 -6.386 168 H CYS 68 H CYS 68 10.694 0.409 -1.644 169 HA CYS 68 HA CYS 68 8.115 1.196 -0.345 170 HB2 CYS 68 2HB CYS 68 9.829 -0.301 0.889 171 HB3 CYS 68 1HB CYS 68 10.832 1.147 0.985 172 H THR 69 H THR 69 7.774 3.410 -0.049 173 HA THR 69 HA THR 69 10.027 5.204 -0.825 174 HB THR 69 HB THR 69 8.680 6.405 -2.302 175 HG1 THR 69 1HG THR 69 6.385 5.156 -1.220 176 HG21 THR 69 1HG2 THR 69 8.996 3.845 -2.844 177 HG22 THR 69 2HG2 THR 69 7.919 4.823 -3.843 178 HG23 THR 69 3HG2 THR 69 7.252 3.777 -2.588 179 H PHE 70 H PHE 70 10.037 7.267 0.141 180 HA PHE 70 HA PHE 70 8.000 7.847 2.204 181 HB2 PHE 70 2HB PHE 70 9.671 8.223 3.944 182 HB3 PHE 70 1HB PHE 70 9.778 6.557 3.373 183 HD1 PHE 70 1HD PHE 70 11.443 9.804 3.560 184 HD2 PHE 70 2HD PHE 70 11.620 5.867 1.851 185 HE1 PHE 70 1HE PHE 70 13.824 10.166 2.975 186 HE2 PHE 70 2HE PHE 70 14.003 6.230 1.265 187 HZ PHE 70 HZ PHE 70 15.106 8.378 1.828 188 H THR 71 H THR 71 8.393 10.107 3.097 189 HA THR 71 HA THR 71 9.795 11.820 1.100 190 HB THR 71 HB THR 71 7.105 12.429 2.357 191 HG1 THR 71 1HG THR 71 7.861 11.066 0.085 192 HG21 THR 71 1HG2 THR 71 9.069 13.973 0.881 193 HG22 THR 71 2HG2 THR 71 7.601 14.518 1.692 194 HG23 THR 71 3HG2 THR 71 7.524 13.928 0.032 195 H CYS 72 H CYS 72 10.768 13.679 1.968 196 HA CYS 72 HA CYS 72 10.603 13.973 4.935 197 HB2 CYS 72 2HB CYS 72 12.746 13.204 4.934 198 HB3 CYS 72 1HB CYS 72 12.957 13.506 3.215 199 H GLY 73 H GLY 73 11.388 16.218 5.601 200 HA2 GLY 73 2HA GLY 73 10.044 18.173 3.879 201 HA3 GLY 73 1HA GLY 73 10.678 18.482 5.495 202 H ALA 74 H ALA 74 11.003 19.675 2.639 203 HA ALA 74 HA ALA 74 12.733 21.254 2.048 204 HB1 ALA 74 1HB ALA 74 14.991 21.001 2.680 205 HB2 ALA 74 2HB ALA 74 14.803 19.283 3.011 206 HB3 ALA 74 3HB ALA 74 14.086 20.479 4.097 207 H ASP 75 H ASP 75 11.398 19.262 0.560 208 HA ASP 75 HA ASP 75 11.538 18.138 -1.482 209 HB2 ASP 75 2HB ASP 75 14.027 19.859 -1.702 210 HB3 ASP 75 1HB ASP 75 13.319 18.949 -3.035 211 H CYS 76 H CYS 76 12.528 16.738 0.750 212 HA CYS 76 HA CYS 76 14.870 15.273 -0.413 213 HB2 CYS 76 2HB CYS 76 14.763 14.392 2.144 214 HB3 CYS 76 1HB CYS 76 15.683 15.821 1.670 215 H ARG 77 H ARG 77 14.056 13.517 -1.471 216 HA ARG 77 HA ARG 77 12.027 11.867 -0.033 217 HB2 ARG 77 2HB ARG 77 12.014 12.709 -2.950 218 HB3 ARG 77 1HB ARG 77 11.004 11.411 -2.311 219 HG2 ARG 77 2HG ARG 77 9.673 12.853 -1.086 220 HG3 ARG 77 1HG ARG 77 10.954 14.038 -0.883 221 HD2 ARG 77 2HD ARG 77 9.335 14.985 -2.390 222 HD3 ARG 77 1HD ARG 77 10.755 14.560 -3.344 223 HE ARG 77 HE ARG 77 9.049 12.320 -3.431 224 HH11 ARG 77 1HH1 ARG 77 7.644 12.029 -5.177 225 HH12 ARG 77 2HH1 ARG 77 7.173 13.396 -6.131 226 HH21 ARG 77 1HH2 ARG 77 9.042 15.659 -4.284 227 HH22 ARG 77 2HH2 ARG 77 7.964 15.453 -5.625 228 H GLY 78 H GLY 78 12.353 9.593 -0.300 229 HA2 GLY 78 2HA GLY 78 14.535 8.768 -2.137 230 HA3 GLY 78 1HA GLY 78 14.738 8.408 -0.423 231 H THR 79 H THR 79 14.547 6.475 -2.573 232 HA THR 79 HA THR 79 12.130 5.010 -1.640 233 HB THR 79 HB THR 79 12.002 4.034 -3.981 234 HG1 THR 79 1HG THR 79 13.870 4.562 -4.912 235 HG21 THR 79 1HG2 THR 79 11.301 6.772 -3.117 236 HG22 THR 79 2HG2 THR 79 10.275 5.495 -3.768 237 HG23 THR 79 3HG2 THR 79 11.238 6.493 -4.858 238 H SER 80 H SER 80 12.353 2.641 -1.856 239 HA SER 80 HA SER 80 15.181 1.718 -2.050 240 HB2 SER 80 2HB SER 80 14.946 0.385 -0.042 241 HB3 SER 80 1HB SER 80 14.510 2.044 0.357 242 HG SER 80 HG SER 80 12.283 1.203 -0.296 243 H GLN 81 H GLN 81 15.272 -0.704 -2.339 244 HA GLN 81 HA GLN 81 12.866 -1.651 -3.837 245 HB2 GLN 81 2HB GLN 81 14.914 -1.325 -5.218 246 HB3 GLN 81 1HB GLN 81 15.754 -2.481 -4.193 247 HG2 GLN 81 2HG GLN 81 14.975 -3.665 -6.147 248 HG3 GLN 81 1HG GLN 81 13.991 -4.178 -4.776 249 HE21 GLN 81 1HE2 GLN 81 11.757 -3.905 -4.965 250 HE22 GLN 81 2HE2 GLN 81 11.006 -2.998 -6.184 251 H TYR 82 H TYR 82 11.857 -3.418 -3.013 252 HA TYR 82 HA TYR 82 13.423 -5.268 -1.287 253 HB2 TYR 82 2HB TYR 82 10.844 -3.850 -0.599 254 HB3 TYR 82 1HB TYR 82 11.298 -5.355 0.194 255 HD1 TYR 82 1HD TYR 82 13.945 -5.355 0.919 256 HD2 TYR 82 2HD TYR 82 11.419 -1.904 0.522 257 HE1 TYR 82 1HE TYR 82 15.432 -4.092 2.446 258 HE2 TYR 82 2HE TYR 82 12.907 -0.642 2.052 259 HH TYR 82 HH TYR 82 14.687 -1.573 4.067 260 HA PRO 83 HA PRO 83 11.523 -8.498 -3.623 261 HB2 PRO 83 2HB PRO 83 10.783 -10.213 -1.502 262 HB3 PRO 83 1HB PRO 83 12.326 -10.214 -2.368 263 HG2 PRO 83 2HG PRO 83 11.628 -9.050 0.254 264 HG3 PRO 83 1HG PRO 83 13.164 -9.719 -0.319 265 HD2 PRO 83 2HD PRO 83 12.762 -7.052 -0.044 266 HD3 PRO 83 1HD PRO 83 13.824 -7.723 -1.299 267 H CYS 84 H CYS 84 9.364 -10.195 -2.555 268 HA CYS 84 HA CYS 84 7.116 -8.566 -3.316 269 HB2 CYS 84 2HB CYS 84 6.295 -10.636 -3.651 270 HB3 CYS 84 1HB CYS 84 7.638 -11.345 -2.757 271 H VAL 85 H VAL 85 5.383 -7.827 -1.989 272 HA VAL 85 HA VAL 85 6.030 -7.660 0.932 273 HB VAL 85 HB VAL 85 6.351 -5.496 -0.276 274 HG11 VAL 85 1HG1 VAL 85 4.831 -4.743 -1.763 275 HG12 VAL 85 2HG1 VAL 85 3.514 -4.944 -0.607 276 HG13 VAL 85 3HG1 VAL 85 4.021 -6.302 -1.612 277 HG21 VAL 85 1HG2 VAL 85 5.688 -4.493 1.634 278 HG22 VAL 85 2HG2 VAL 85 4.915 -6.012 2.091 279 HG23 VAL 85 3HG2 VAL 85 3.990 -4.770 1.248 280 H GLN 86 H GLN 86 4.215 -7.738 2.355 281 HA GLN 86 HA GLN 86 2.142 -9.511 1.668 282 HB2 GLN 86 2HB GLN 86 1.993 -7.348 3.783 283 HB3 GLN 86 1HB GLN 86 1.075 -8.853 3.741 284 HG2 GLN 86 2HG GLN 86 4.089 -8.614 3.985 285 HG3 GLN 86 1HG GLN 86 2.977 -9.079 5.273 286 HE21 GLN 86 1HE2 GLN 86 5.162 -10.501 3.354 287 HE22 GLN 86 2HE2 GLN 86 4.407 -11.990 3.048 288 H VAL 87 H VAL 87 -0.251 -8.203 2.533 289 HA VAL 87 HA VAL 87 -0.728 -6.388 0.204 290 HB VAL 87 HB VAL 87 -2.578 -8.428 1.455 291 HG11 VAL 87 1HG1 VAL 87 -3.035 -6.292 -0.646 292 HG12 VAL 87 2HG1 VAL 87 -3.906 -6.506 0.872 293 HG13 VAL 87 3HG1 VAL 87 -4.108 -7.676 -0.434 294 HG21 VAL 87 1HG2 VAL 87 -0.668 -8.512 -0.678 295 HG22 VAL 87 2HG2 VAL 87 -2.281 -8.620 -1.379 296 HG23 VAL 87 3HG2 VAL 87 -1.772 -9.784 -0.157 297 H TYR 88 H TYR 88 -1.910 -4.550 0.519 298 HA TYR 88 HA TYR 88 -3.570 -3.980 2.745 299 HB2 TYR 88 2HB TYR 88 -1.296 -4.051 3.883 300 HB3 TYR 88 1HB TYR 88 -0.890 -2.612 2.965 301 HD1 TYR 88 1HD TYR 88 -3.831 -3.870 4.962 302 HD2 TYR 88 2HD TYR 88 -1.160 -0.627 4.100 303 HE1 TYR 88 1HE TYR 88 -4.990 -2.471 6.640 304 HE2 TYR 88 2HE TYR 88 -2.310 0.774 5.782 305 HH TYR 88 HH TYR 88 -5.185 -0.422 7.509 306 H VAL 89 H VAL 89 -2.055 -1.117 2.583 307 HA VAL 89 HA VAL 89 -3.246 -0.410 -0.058 308 HB VAL 89 HB VAL 89 -4.809 0.161 1.829 309 HG11 VAL 89 1HG1 VAL 89 -4.165 1.483 3.575 310 HG12 VAL 89 2HG1 VAL 89 -3.123 2.481 2.561 311 HG13 VAL 89 3HG1 VAL 89 -2.549 0.924 3.150 312 HG21 VAL 89 1HG2 VAL 89 -3.589 2.335 0.112 313 HG22 VAL 89 2HG2 VAL 89 -5.035 2.599 1.089 314 HG23 VAL 89 3HG2 VAL 89 -5.050 1.398 -0.203 315 H ASN 90 H ASN 90 -2.037 0.941 -1.271 316 HA ASN 90 HA ASN 90 0.529 1.834 -0.128 317 HB2 ASN 90 2HB ASN 90 -0.538 1.875 -2.964 318 HB3 ASN 90 1HB ASN 90 1.083 2.368 -2.490 319 HD21 ASN 90 1HD2 ASN 90 0.172 -0.142 -0.455 320 HD22 ASN 90 2HD2 ASN 90 0.865 -1.437 -1.304 321 H ASN 91 H ASN 91 0.530 3.818 0.797 322 HA ASN 91 HA ASN 91 -1.471 5.802 -0.088 323 HB2 ASN 91 2HB ASN 91 0.538 5.803 2.183 324 HB3 ASN 91 1HB ASN 91 -0.567 7.135 1.845 325 HD21 ASN 91 1HD2 ASN 91 -0.710 5.707 4.318 326 HD22 ASN 91 2HD2 ASN 91 -2.166 4.833 4.353 327 H SER 92 H SER 92 -0.552 6.255 -2.167 328 HA SER 92 HA SER 92 2.181 7.351 -2.248 329 HB2 SER 92 2HB SER 92 0.726 7.716 -4.697 330 HB3 SER 92 1HB SER 92 2.121 6.688 -4.391 331 HG SER 92 HG SER 92 0.544 5.199 -3.424 332 H GLU 93 H GLU 93 -0.255 8.610 -0.887 333 HA GLU 93 HA GLU 93 -0.847 11.036 -2.367 334 HB2 GLU 93 2HB GLU 93 -1.030 10.666 0.634 335 HB3 GLU 93 1HB GLU 93 -2.020 11.704 -0.394 336 HG2 GLU 93 2HG GLU 93 -2.905 9.665 -1.531 337 HG3 GLU 93 1HG GLU 93 -1.994 8.675 -0.386 338 H SER 94 H SER 94 1.770 9.858 -0.612 339 HA SER 94 HA SER 94 3.248 12.366 -0.859 340 HB2 SER 94 2HB SER 94 3.588 11.414 1.866 341 HB3 SER 94 1HB SER 94 3.207 13.037 1.300 342 HG SER 94 HG SER 94 1.458 12.351 2.454 343 H ASN 95 H ASN 95 3.333 9.660 -1.897 344 HA ASN 95 HA ASN 95 4.896 7.989 -2.345 345 HB2 ASN 95 2HB ASN 95 6.829 9.838 -0.917 346 HB3 ASN 95 1HB ASN 95 7.248 8.528 -2.016 347 HD21 ASN 95 1HD2 ASN 95 7.459 11.667 -2.148 348 HD22 ASN 95 2HD2 ASN 95 6.857 12.015 -3.696 349 H SER 96 H SER 96 3.302 7.511 -0.113 350 HA SER 96 HA SER 96 5.263 6.302 1.811 351 HB2 SER 96 2HB SER 96 3.303 6.329 3.429 352 HB3 SER 96 1HB SER 96 3.952 7.912 3.007 353 HG SER 96 HG SER 96 1.508 7.282 2.849 354 H ARG 97 H ARG 97 4.966 4.121 2.352 355 HA ARG 97 HA ARG 97 2.867 2.667 0.801 356 HB2 ARG 97 2HB ARG 97 5.081 2.295 -0.185 357 HB3 ARG 97 1HB ARG 97 5.724 1.831 1.387 358 HG2 ARG 97 2HG ARG 97 5.279 -0.197 0.163 359 HG3 ARG 97 1HG ARG 97 4.044 -0.070 1.411 360 HD2 ARG 97 2HD ARG 97 2.409 0.666 -0.151 361 HD3 ARG 97 1HD ARG 97 3.613 0.952 -1.404 362 HE ARG 97 HE ARG 97 2.484 -1.657 -0.636 363 HH11 ARG 97 1HH1 ARG 97 3.055 -3.353 -2.016 364 HH12 ARG 97 2HH1 ARG 97 4.323 -3.120 -3.173 365 HH21 ARG 97 1HH2 ARG 97 4.945 0.158 -2.234 366 HH22 ARG 97 2HH2 ARG 97 5.392 -1.134 -3.297 367 H ALA 98 H ALA 98 1.469 1.648 2.140 368 HA ALA 98 HA ALA 98 2.412 0.901 4.870 369 HB1 ALA 98 1HB ALA 98 -0.051 0.843 5.419 370 HB2 ALA 98 2HB ALA 98 -0.366 1.474 3.802 371 HB3 ALA 98 3HB ALA 98 0.547 2.437 4.960 372 H LEU 99 H LEU 99 2.657 -1.243 5.247 373 HA LEU 99 HA LEU 99 1.281 -3.169 3.410 374 HB2 LEU 99 2HB LEU 99 3.224 -4.674 3.831 375 HB3 LEU 99 1HB LEU 99 3.688 -3.166 3.041 376 HG LEU 99 HG LEU 99 3.856 -2.485 5.700 377 HD11 LEU 99 1HD1 LEU 99 4.954 -4.264 6.884 378 HD12 LEU 99 2HD1 LEU 99 4.997 -5.275 5.439 379 HD13 LEU 99 3HD1 LEU 99 3.458 -4.928 6.227 380 HD21 LEU 99 1HD2 LEU 99 5.947 -3.601 3.813 381 HD22 LEU 99 2HD2 LEU 99 6.340 -2.811 5.340 382 HD23 LEU 99 3HD2 LEU 99 5.528 -1.906 4.063 383 H LEU 100 H LEU 100 0.151 -4.836 4.330 384 HA LEU 100 HA LEU 100 0.326 -5.170 7.296 385 HB2 LEU 100 2HB LEU 100 -1.744 -3.934 6.574 386 HB3 LEU 100 1HB LEU 100 -2.204 -5.351 5.635 387 HG LEU 100 HG LEU 100 -1.889 -6.652 7.866 388 HD11 LEU 100 1HD1 LEU 100 -1.094 -4.140 8.745 389 HD12 LEU 100 2HD1 LEU 100 -1.557 -5.491 9.779 390 HD13 LEU 100 3HD1 LEU 100 -2.750 -4.271 9.335 391 HD21 LEU 100 1HD2 LEU 100 -4.228 -5.998 8.560 392 HD22 LEU 100 2HD2 LEU 100 -4.063 -6.390 6.848 393 HD23 LEU 100 3HD2 LEU 100 -4.155 -4.706 7.361 394 H HIS 101 H HIS 101 0.077 -7.355 8.016 395 HA HIS 101 HA HIS 101 0.607 -9.354 5.900 396 HB2 HIS 101 2HB HIS 101 0.542 -9.654 8.919 397 HB3 HIS 101 1HB HIS 101 1.104 -10.871 7.773 398 HD1 HIS 101 1HD HIS 101 1.978 -7.435 6.819 399 HD2 HIS 101 2HD HIS 101 3.726 -10.472 9.083 400 HE1 HIS 101 1HE HIS 101 4.416 -6.809 7.098 401 HE2 HIS 101 2HE HIS 101 5.490 -8.647 8.477 402 H SER 102 H SER 102 -1.080 -10.444 5.021 403 HA SER 102 HA SER 102 -3.763 -10.262 5.988 404 HB2 SER 102 2HB SER 102 -4.282 -11.969 4.330 405 HB3 SER 102 1HB SER 102 -3.117 -10.846 3.637 406 HG SER 102 HG SER 102 -2.380 -12.899 3.236 407 H ASP 103 H ASP 103 -1.194 -12.612 6.531 408 HA ASP 103 HA ASP 103 -2.429 -13.535 8.973 409 HB2 ASP 103 2HB ASP 103 -3.716 -14.722 7.050 410 HB3 ASP 103 1HB ASP 103 -2.232 -15.652 6.837 411 H GLU 104 H GLU 104 -0.988 -15.007 10.112 412 HA GLU 104 HA GLU 104 1.786 -14.514 9.580 413 HB2 GLU 104 2HB GLU 104 0.834 -15.055 11.838 414 HB3 GLU 104 1HB GLU 104 0.596 -16.717 11.294 415 HG2 GLU 104 2HG GLU 104 3.035 -16.873 10.805 416 HG3 GLU 104 1HG GLU 104 3.244 -15.249 11.464 417 H HIS 105 H HIS 105 -0.356 -17.242 8.837 418 HA HIS 105 HA HIS 105 1.596 -19.109 7.999 419 HB2 HIS 105 2HB HIS 105 -1.174 -18.617 6.862 420 HB3 HIS 105 1HB HIS 105 -0.200 -20.056 6.559 421 HD1 HIS 105 1HD HIS 105 0.616 -21.302 8.914 422 HD2 HIS 105 2HD HIS 105 -2.781 -18.889 9.092 423 HE1 HIS 105 1HE HIS 105 -0.631 -21.973 11.016 424 HE2 HIS 105 2HE HIS 105 -2.700 -20.509 11.135 425 H GLN 106 H GLN 106 0.109 -16.409 6.236 426 HA GLN 106 HA GLN 106 1.279 -16.972 3.692 427 HB2 GLN 106 2HB GLN 106 -0.538 -15.280 4.133 428 HB3 GLN 106 1HB GLN 106 0.688 -14.231 4.844 429 HG2 GLN 106 2HG GLN 106 1.961 -14.329 2.697 430 HG3 GLN 106 1HG GLN 106 0.642 -15.268 1.996 431 HE21 GLN 106 1HE2 GLN 106 -0.676 -13.939 0.753 432 HE22 GLN 106 2HE2 GLN 106 -1.096 -12.341 1.139 433 H LEU 107 H LEU 107 2.444 -15.131 6.483 434 HA LEU 107 HA LEU 107 4.860 -14.172 5.281 435 HB2 LEU 107 2HB LEU 107 3.942 -13.312 7.432 436 HB3 LEU 107 1HB LEU 107 4.342 -14.852 8.193 437 HG LEU 107 HG LEU 107 6.735 -14.496 7.546 438 HD11 LEU 107 1HD1 LEU 107 7.028 -12.986 5.876 439 HD12 LEU 107 2HD1 LEU 107 6.931 -11.778 7.157 440 HD13 LEU 107 3HD1 LEU 107 5.496 -12.179 6.214 441 HD21 LEU 107 1HD2 LEU 107 5.224 -13.276 9.603 442 HD22 LEU 107 2HD2 LEU 107 6.357 -12.048 9.034 443 HD23 LEU 107 3HD2 LEU 107 6.958 -13.605 9.604 444 H LEU 108 H LEU 108 4.116 -17.109 7.145 445 HA LEU 108 HA LEU 108 6.785 -18.176 7.079 446 HB2 LEU 108 2HB LEU 108 4.145 -19.673 7.227 447 HB3 LEU 108 1HB LEU 108 5.726 -20.311 7.674 448 HG LEU 108 HG LEU 108 4.292 -17.989 8.995 449 HD11 LEU 108 1HD1 LEU 108 3.900 -19.427 10.808 450 HD12 LEU 108 2HD1 LEU 108 5.154 -20.559 10.303 451 HD13 LEU 108 3HD1 LEU 108 3.628 -20.483 9.422 452 HD21 LEU 108 1HD2 LEU 108 6.527 -17.394 9.246 453 HD22 LEU 108 2HD2 LEU 108 7.086 -19.065 9.183 454 HD23 LEU 108 3HD2 LEU 108 6.317 -18.447 10.645 455 H THR 109 H THR 109 4.103 -18.143 4.846 456 HA THR 109 HA THR 109 5.078 -20.203 3.084 457 HB THR 109 HB THR 109 3.244 -17.866 2.478 458 HG1 THR 109 1HG THR 109 1.691 -18.989 3.391 459 HG21 THR 109 1HG2 THR 109 3.326 -20.613 1.239 460 HG22 THR 109 2HG2 THR 109 4.198 -19.235 0.570 461 HG23 THR 109 3HG2 THR 109 2.439 -19.198 0.676 462 H ASN 110 H ASN 110 5.365 -16.657 3.162 463 HA ASN 110 HA ASN 110 7.622 -16.907 1.223 464 HB2 ASN 110 2HB ASN 110 5.823 -14.505 1.147 465 HB3 ASN 110 1HB ASN 110 6.837 -15.179 -0.129 466 HD21 ASN 110 1HD2 ASN 110 6.099 -17.698 -0.542 467 HD22 ASN 110 2HD2 ASN 110 4.427 -17.872 -0.786 468 HA PRO 111 HA PRO 111 8.642 -14.549 5.205 469 HB2 PRO 111 2HB PRO 111 11.147 -16.097 4.849 470 HB3 PRO 111 1HB PRO 111 10.178 -15.848 6.311 471 HG2 PRO 111 2HG PRO 111 10.225 -18.185 5.000 472 HG3 PRO 111 1HG PRO 111 8.786 -17.597 5.849 473 HD2 PRO 111 2HD PRO 111 9.329 -17.700 2.916 474 HD3 PRO 111 1HD PRO 111 7.790 -17.833 3.790 475 H LYS 112 H LYS 112 10.429 -15.285 2.260 476 HA LYS 112 HA LYS 112 12.430 -13.275 2.414 477 HB2 LYS 112 2HB LYS 112 12.353 -15.119 0.719 478 HB3 LYS 112 1HB LYS 112 11.038 -14.268 -0.091 479 HG2 LYS 112 2HG LYS 112 12.518 -12.291 -0.369 480 HG3 LYS 112 1HG LYS 112 13.837 -13.195 0.375 481 HD2 LYS 112 2HD LYS 112 13.575 -14.934 -1.418 482 HD3 LYS 112 1HD LYS 112 12.397 -13.880 -2.203 483 HE2 LYS 112 2HE LYS 112 14.073 -12.754 -3.189 484 HE3 LYS 112 1HE LYS 112 14.689 -12.297 -1.599 485 HZ1 LYS 112 1HZ LYS 112 16.435 -13.454 -2.552 486 HZ2 LYS 112 2HZ LYS 112 15.424 -14.616 -3.269 487 HZ3 LYS 112 3HZ LYS 112 15.690 -14.636 -1.592 488 H CYS 113 H CYS 113 9.026 -13.080 1.657 489 HA CYS 113 HA CYS 113 8.979 -10.633 0.243 490 HB2 CYS 113 2HB CYS 113 6.995 -11.880 2.149 491 HB3 CYS 113 1HB CYS 113 6.656 -10.394 1.264 492 H SER 114 H SER 114 9.226 -11.224 3.746 493 HA SER 114 HA SER 114 9.827 -8.318 4.047 494 HB2 SER 114 2HB SER 114 8.323 -8.015 5.826 495 HB3 SER 114 1HB SER 114 7.402 -8.985 4.680 496 HG SER 114 HG SER 114 8.646 -9.733 7.094 497 H TYR 115 H TYR 115 11.425 -10.951 4.162 498 HA TYR 115 HA TYR 115 12.169 -11.326 6.920 499 HB2 TYR 115 2HB TYR 115 13.813 -12.780 6.145 500 HB3 TYR 115 1HB TYR 115 12.670 -12.817 4.805 501 HD1 TYR 115 1HD TYR 115 13.050 -11.128 2.886 502 HD2 TYR 115 2HD TYR 115 16.047 -12.150 5.778 503 HE1 TYR 115 1HE TYR 115 14.809 -10.321 1.339 504 HE2 TYR 115 2HE TYR 115 17.813 -11.339 4.237 505 HH TYR 115 HH TYR 115 17.900 -11.088 1.515 506 H ILE 116 H ILE 116 12.909 -8.908 4.583 507 HA ILE 116 HA ILE 116 15.242 -7.948 6.158 508 HB ILE 116 HB ILE 116 15.065 -6.144 4.173 509 HG12 ILE 116 2HG1 ILE 116 14.311 -7.266 2.104 510 HG13 ILE 116 1HG1 ILE 116 13.790 -8.658 3.047 511 HG21 ILE 116 1HG2 ILE 116 16.383 -8.031 2.800 512 HG22 ILE 116 2HG2 ILE 116 16.324 -8.838 4.367 513 HG23 ILE 116 3HG2 ILE 116 17.079 -7.252 4.221 514 HD11 ILE 116 1HD1 ILE 116 12.766 -5.964 3.841 515 HD12 ILE 116 2HD1 ILE 116 11.983 -7.539 3.965 516 HD13 ILE 116 3HD1 ILE 116 12.080 -6.724 2.404 517 HA PRO 117 HA PRO 117 13.341 -4.751 8.507 518 HB2 PRO 117 2HB PRO 117 14.779 -2.841 6.699 519 HB3 PRO 117 1HB PRO 117 14.667 -2.848 8.470 520 HG2 PRO 117 2HG PRO 117 16.830 -3.753 7.150 521 HG3 PRO 117 1HG PRO 117 16.303 -4.416 8.705 522 HD2 PRO 117 2HD PRO 117 16.252 -5.681 6.055 523 HD3 PRO 117 1HD PRO 117 16.059 -6.425 7.655 524 HA PRO 118 HA PRO 118 10.176 -3.787 5.308 525 HB2 PRO 118 2HB PRO 118 7.998 -4.362 6.814 526 HB3 PRO 118 1HB PRO 118 8.960 -5.623 6.018 527 HG2 PRO 118 2HG PRO 118 8.888 -4.814 8.865 528 HG3 PRO 118 1HG PRO 118 9.152 -6.410 8.146 529 HD2 PRO 118 2HD PRO 118 11.157 -4.711 9.137 530 HD3 PRO 118 1HD PRO 118 11.416 -6.114 8.079 531 H CYS 119 H CYS 119 8.853 -1.914 5.075 532 HA CYS 119 HA CYS 119 9.085 0.036 7.309 533 HB2 CYS 119 2HB CYS 119 8.090 1.477 5.214 534 HB3 CYS 119 1HB CYS 119 9.811 1.286 5.542 535 H LYS 120 H LYS 120 7.295 0.237 8.554 536 HA LYS 120 HA LYS 120 4.631 -0.069 7.237 537 HB2 LYS 120 2HB LYS 120 5.402 -2.067 8.676 538 HB3 LYS 120 1HB LYS 120 5.188 -0.989 10.057 539 HG2 LYS 120 2HG LYS 120 2.846 -0.572 9.331 540 HG3 LYS 120 1HG LYS 120 3.072 -1.726 8.017 541 HD2 LYS 120 2HD LYS 120 3.656 -3.468 9.730 542 HD3 LYS 120 1HD LYS 120 3.228 -2.307 10.988 543 HE2 LYS 120 2HE LYS 120 1.131 -2.431 9.003 544 HE3 LYS 120 1HE LYS 120 1.480 -4.048 9.618 545 HZ1 LYS 120 1HZ LYS 120 1.479 -2.176 11.736 546 HZ2 LYS 120 2HZ LYS 120 0.498 -3.547 11.521 547 HZ3 LYS 120 3HZ LYS 120 0.028 -2.051 10.866 548 H ARG 121 H ARG 121 3.051 1.383 7.963 549 HA ARG 121 HA ARG 121 3.934 3.852 9.079 550 HB2 ARG 121 2HB ARG 121 1.149 2.682 8.835 551 HB3 ARG 121 1HB ARG 121 1.494 4.355 9.263 552 HG2 ARG 121 2HG ARG 121 2.759 4.600 7.121 553 HG3 ARG 121 1HG ARG 121 2.257 2.968 6.682 554 HD2 ARG 121 2HD ARG 121 0.415 5.310 7.247 555 HD3 ARG 121 1HD ARG 121 0.742 4.604 5.664 556 HE ARG 121 HE ARG 121 -0.185 2.441 7.032 557 HH11 ARG 121 1HH1 ARG 121 -2.367 1.921 7.324 558 HH12 ARG 121 2HH1 ARG 121 -3.553 3.183 7.307 559 HH21 ARG 121 1HH2 ARG 121 -1.243 5.713 6.773 560 HH22 ARG 121 2HH2 ARG 121 -2.917 5.328 6.995 561 H GLU 122 H GLU 122 2.523 0.973 10.566 562 HA GLU 122 HA GLU 122 2.742 2.323 13.216 563 HB2 GLU 122 2HB GLU 122 1.029 -0.029 12.367 564 HB3 GLU 122 1HB GLU 122 1.129 0.606 14.011 565 HG2 GLU 122 2HG GLU 122 0.345 2.808 13.202 566 HG3 GLU 122 1HG GLU 122 0.214 2.153 11.573 567 H ASN 123 H ASN 123 4.383 1.635 14.435 568 HA ASN 123 HA ASN 123 6.147 -0.481 13.676 569 HB2 ASN 123 2HB ASN 123 5.764 0.678 16.446 570 HB3 ASN 123 1HB ASN 123 7.211 -0.109 15.816 571 HD21 ASN 123 1HD2 ASN 123 5.170 2.792 15.466 572 HD22 ASN 123 2HD2 ASN 123 6.365 3.749 14.730 573 H GLN 124 H GLN 124 3.351 -0.358 15.817 574 HA GLN 124 HA GLN 124 3.761 -3.215 16.521 575 HB2 GLN 124 2HB GLN 124 1.826 -1.153 17.614 576 HB3 GLN 124 1HB GLN 124 1.958 -2.817 18.186 577 HG2 GLN 124 2HG GLN 124 4.298 -2.437 18.821 578 HG3 GLN 124 1HG GLN 124 4.208 -0.784 18.211 579 HE21 GLN 124 1HE2 GLN 124 4.834 -1.261 20.947 580 HE22 GLN 124 2HE2 GLN 124 3.537 -0.730 21.905 581 H LYS 125 H LYS 125 2.089 -4.756 16.150 582 HA LYS 125 HA LYS 125 -0.077 -3.896 14.292 583 HB2 LYS 125 2HB LYS 125 1.791 -4.980 13.032 584 HB3 LYS 125 1HB LYS 125 1.572 -6.426 14.019 585 HG2 LYS 125 2HG LYS 125 -0.728 -6.665 13.215 586 HG3 LYS 125 1HG LYS 125 -0.576 -5.176 12.282 587 HD2 LYS 125 2HD LYS 125 -0.223 -7.054 10.784 588 HD3 LYS 125 1HD LYS 125 1.319 -6.228 11.017 589 HE2 LYS 125 2HE LYS 125 0.596 -8.486 12.854 590 HE3 LYS 125 1HE LYS 125 1.172 -8.860 11.230 591 HZ1 LYS 125 1HZ LYS 125 2.794 -8.455 13.281 592 HZ2 LYS 125 2HZ LYS 125 2.681 -6.861 12.706 593 HZ3 LYS 125 3HZ LYS 125 3.229 -8.101 11.681 594 H ASN 126 H ASN 126 -2.066 -4.772 14.799 595 HA ASN 126 HA ASN 126 -2.140 -6.618 17.136 596 HB2 ASN 126 2HB ASN 126 -4.400 -5.062 15.857 597 HB3 ASN 126 1HB ASN 126 -4.456 -5.921 17.396 598 HD21 ASN 126 1HD2 ASN 126 -1.952 -5.131 18.496 599 HD22 ASN 126 2HD2 ASN 126 -1.980 -3.457 18.773 600 H LEU 127 H LEU 127 -2.934 -8.680 16.924 601 HA LEU 127 HA LEU 127 -3.182 -9.858 14.325 602 HB2 LEU 127 2HB LEU 127 -4.318 -10.972 16.899 603 HB3 LEU 127 1HB LEU 127 -3.781 -11.874 15.482 604 HG LEU 127 HG LEU 127 -2.090 -10.339 17.460 605 HD11 LEU 127 1HD1 LEU 127 -2.835 -12.824 17.712 606 HD12 LEU 127 2HD1 LEU 127 -1.134 -12.421 17.955 607 HD13 LEU 127 3HD1 LEU 127 -1.663 -13.133 16.431 608 HD21 LEU 127 1HD2 LEU 127 -0.189 -11.075 15.886 609 HD22 LEU 127 2HD2 LEU 127 -1.165 -9.699 15.369 610 HD23 LEU 127 3HD2 LEU 127 -1.444 -11.294 14.666 611 H GLU 128 H GLU 128 -5.577 -8.655 16.634 612 HA GLU 128 HA GLU 128 -7.890 -9.690 15.359 613 HB2 GLU 128 2HB GLU 128 -7.865 -8.566 17.598 614 HB3 GLU 128 1HB GLU 128 -7.645 -7.019 16.779 615 HG2 GLU 128 2HG GLU 128 -9.759 -7.425 15.519 616 HG3 GLU 128 1HG GLU 128 -9.996 -8.905 16.448 617 H SER 129 H SER 129 -5.942 -6.825 14.681 618 HA SER 129 HA SER 129 -7.706 -5.582 12.816 619 HB2 SER 129 2HB SER 129 -5.758 -4.359 12.050 620 HB3 SER 129 1HB SER 129 -5.638 -4.540 13.798 621 HG SER 129 HG SER 129 -4.541 -6.677 12.738 622 H VAL 130 H VAL 130 -5.391 -8.221 12.475 623 HA VAL 130 HA VAL 130 -5.283 -8.308 9.634 624 HB VAL 130 HB VAL 130 -5.068 -10.522 11.689 625 HG11 VAL 130 1HG1 VAL 130 -3.750 -11.481 9.545 626 HG12 VAL 130 2HG1 VAL 130 -4.985 -10.538 8.711 627 HG13 VAL 130 3HG1 VAL 130 -5.458 -11.817 9.830 628 HG21 VAL 130 1HG2 VAL 130 -2.659 -9.923 10.259 629 HG22 VAL 130 2HG2 VAL 130 -2.986 -9.711 11.980 630 HG23 VAL 130 3HG2 VAL 130 -3.339 -8.406 10.847 631 H MET 131 H MET 131 -7.571 -9.858 11.907 632 HA MET 131 HA MET 131 -9.030 -11.316 9.944 633 HB2 MET 131 2HB MET 131 -9.293 -11.533 12.449 634 HB3 MET 131 1HB MET 131 -10.204 -10.022 12.421 635 HG2 MET 131 2HG MET 131 -11.226 -11.755 10.372 636 HG3 MET 131 1HG MET 131 -11.176 -12.642 11.895 637 HE1 MET 131 1HE MET 131 -13.401 -11.328 9.815 638 HE2 MET 131 2HE MET 131 -12.758 -9.690 9.876 639 HE3 MET 131 3HE MET 131 -14.367 -10.023 10.514 640 H ASN 132 H ASN 132 -9.357 -7.989 11.120 641 HA ASN 132 HA ASN 132 -11.709 -7.306 9.664 642 HB2 ASN 132 2HB ASN 132 -10.548 -5.935 11.480 643 HB3 ASN 132 1HB ASN 132 -9.409 -5.421 10.234 644 HD21 ASN 132 1HD2 ASN 132 -10.735 -3.308 11.172 645 HD22 ASN 132 2HD2 ASN 132 -12.023 -2.837 10.172 646 H TRP 133 H TRP 133 -8.282 -7.308 8.751 647 HA TRP 133 HA TRP 133 -8.536 -5.968 6.262 648 HB2 TRP 133 2HB TRP 133 -6.331 -6.372 7.080 649 HB3 TRP 133 1HB TRP 133 -6.620 -8.107 7.207 650 HD1 TRP 133 HD TRP 133 -5.752 -5.385 4.716 651 HE1 TRP 133 1HE TRP 133 -5.145 -6.464 2.456 652 HE3 TRP 133 3HE TRP 133 -7.086 -10.224 5.662 653 HZ2 TRP 133 2HZ TRP 133 -5.218 -9.037 1.214 654 HZ3 TRP 133 3HZ TRP 133 -6.809 -11.965 3.922 655 HH2 TRP 133 HH TRP 133 -5.876 -11.380 1.701 656 H GLN 134 H GLN 134 -8.806 -9.449 7.015 657 HA GLN 134 HA GLN 134 -9.235 -10.298 4.328 658 HB2 GLN 134 2HB GLN 134 -8.753 -11.808 6.275 659 HB3 GLN 134 1HB GLN 134 -10.403 -11.535 6.836 660 HG2 GLN 134 2HG GLN 134 -10.795 -12.200 4.191 661 HG3 GLN 134 1HG GLN 134 -9.433 -13.229 4.640 662 HE21 GLN 134 1HE2 GLN 134 -12.700 -12.271 5.797 663 HE22 GLN 134 2HE2 GLN 134 -13.033 -13.752 6.555 664 H GLN 135 H GLN 135 -11.565 -9.389 6.880 665 HA GLN 135 HA GLN 135 -13.883 -9.786 5.212 666 HB2 GLN 135 2HB GLN 135 -13.880 -9.675 7.738 667 HB3 GLN 135 1HB GLN 135 -13.634 -7.935 7.597 668 HG2 GLN 135 2HG GLN 135 -15.716 -7.749 6.280 669 HG3 GLN 135 1HG GLN 135 -15.967 -9.487 6.442 670 HE21 GLN 135 1HE2 GLN 135 -17.998 -7.972 7.472 671 HE22 GLN 135 2HE2 GLN 135 -17.933 -7.927 9.168 672 H TYR 136 H TYR 136 -11.991 -6.914 6.103 673 HA TYR 136 HA TYR 136 -13.568 -5.058 4.565 674 HB2 TYR 136 2HB TYR 136 -12.137 -4.271 6.359 675 HB3 TYR 136 1HB TYR 136 -10.709 -4.926 5.559 676 HD1 TYR 136 1HD TYR 136 -13.037 -2.145 5.738 677 HD2 TYR 136 2HD TYR 136 -9.998 -3.998 3.336 678 HE1 TYR 136 1HE TYR 136 -12.787 -0.047 4.438 679 HE2 TYR 136 2HE TYR 136 -9.746 -1.902 2.036 680 HH TYR 136 HH TYR 136 -11.859 0.894 2.629 681 H TRP 137 H TRP 137 -10.462 -6.672 3.896 682 HA TRP 137 HA TRP 137 -10.083 -5.513 1.311 683 HB2 TRP 137 2HB TRP 137 -8.286 -6.586 2.621 684 HB3 TRP 137 1HB TRP 137 -9.083 -8.145 2.432 685 HD1 TRP 137 HD TRP 137 -6.887 -5.675 0.621 686 HE1 TRP 137 1HE TRP 137 -6.150 -6.701 -1.631 687 HE3 TRP 137 3HE TRP 137 -9.898 -9.771 0.517 688 HZ2 TRP 137 2HZ TRP 137 -6.767 -8.981 -3.256 689 HZ3 TRP 137 3HZ TRP 137 -9.812 -11.364 -1.385 690 HH2 TRP 137 HH TRP 137 -8.250 -10.972 -3.273 691 H LYS 138 H LYS 138 -11.505 -8.644 2.279 692 HA LYS 138 HA LYS 138 -12.061 -9.407 -0.463 693 HB2 LYS 138 2HB LYS 138 -11.773 -11.039 1.407 694 HB3 LYS 138 1HB LYS 138 -13.307 -10.481 2.078 695 HG2 LYS 138 2HG LYS 138 -14.440 -11.105 -0.042 696 HG3 LYS 138 1HG LYS 138 -12.907 -11.722 -0.660 697 HD2 LYS 138 2HD LYS 138 -12.808 -13.277 1.309 698 HD3 LYS 138 1HD LYS 138 -14.427 -12.739 1.755 699 HE2 LYS 138 2HE LYS 138 -14.669 -13.356 -0.947 700 HE3 LYS 138 1HE LYS 138 -13.611 -14.622 -0.323 701 HZ1 LYS 138 1HZ LYS 138 -15.610 -15.520 0.197 702 HZ2 LYS 138 2HZ LYS 138 -16.389 -14.018 0.347 703 HZ3 LYS 138 3HZ LYS 138 -15.394 -14.591 1.599 704 H ASP 139 H ASP 139 -14.055 -8.123 2.175 705 HA ASP 139 HA ASP 139 -16.520 -8.183 0.715 706 HB2 ASP 139 2HB ASP 139 -16.249 -8.054 3.211 707 HB3 ASP 139 1HB ASP 139 -15.825 -6.354 3.006 708 H GLU 140 H GLU 140 -14.177 -5.509 1.209 709 HA GLU 140 HA GLU 140 -15.900 -3.835 -0.530 710 HB2 GLU 140 2HB GLU 140 -13.510 -3.069 1.161 711 HB3 GLU 140 1HB GLU 140 -14.543 -1.952 0.270 712 HG2 GLU 140 2HG GLU 140 -16.498 -2.766 1.596 713 HG3 GLU 140 1HG GLU 140 -15.396 -3.763 2.546 714 H ILE 141 H ILE 141 -12.373 -3.977 -0.120 715 HA ILE 141 HA ILE 141 -12.181 -3.975 -3.095 716 HB ILE 141 HB ILE 141 -11.427 -1.929 -1.770 717 HG12 ILE 141 2HG1 ILE 141 -10.785 -2.311 -4.092 718 HG13 ILE 141 1HG1 ILE 141 -9.435 -1.618 -3.199 719 HG21 ILE 141 1HG2 ILE 141 -9.528 -1.981 -0.454 720 HG22 ILE 141 2HG2 ILE 141 -8.895 -3.434 -1.223 721 HG23 ILE 141 3HG2 ILE 141 -10.231 -3.552 -0.078 722 HD11 ILE 141 1HD1 ILE 141 -8.408 -3.350 -4.392 723 HD12 ILE 141 2HD1 ILE 141 -9.788 -4.428 -4.214 724 HD13 ILE 141 3HD1 ILE 141 -8.727 -4.116 -2.838 725 H GLY 142 H GLY 142 -11.776 -6.039 -3.666 726 HA2 GLY 142 2HA GLY 142 -10.097 -7.801 -2.039 727 HA3 GLY 142 1HA GLY 142 -10.831 -8.210 -3.589 728 H SER 143 H SER 143 -9.308 -8.599 -5.109 729 HA SER 143 HA SER 143 -6.633 -7.361 -4.849 730 HB2 SER 143 2HB SER 143 -5.932 -8.957 -6.511 731 HB3 SER 143 1HB SER 143 -6.961 -9.819 -5.371 732 HG SER 143 HG SER 143 -8.286 -10.192 -6.950 733 H GLN 144 H GLN 144 -8.331 -5.347 -5.409 734 HA GLN 144 HA GLN 144 -7.882 -4.842 -8.317 735 HB2 GLN 144 2HB GLN 144 -10.300 -4.263 -6.616 736 HB3 GLN 144 1HB GLN 144 -9.987 -3.370 -8.104 737 HG2 GLN 144 2HG GLN 144 -9.772 -6.330 -8.274 738 HG3 GLN 144 1HG GLN 144 -11.394 -5.674 -8.057 739 HE21 GLN 144 1HE2 GLN 144 -11.760 -3.611 -9.602 740 HE22 GLN 144 2HE2 GLN 144 -11.245 -3.830 -11.205 741 HA PRO 145 HA PRO 145 -5.644 -1.686 -5.641 742 HB2 PRO 145 2HB PRO 145 -4.017 -1.630 -8.120 743 HB3 PRO 145 1HB PRO 145 -3.494 -1.751 -6.434 744 HG2 PRO 145 2HG PRO 145 -3.462 -3.824 -8.181 745 HG3 PRO 145 1HG PRO 145 -3.594 -4.010 -6.432 746 HD2 PRO 145 2HD PRO 145 -5.643 -4.447 -8.503 747 HD3 PRO 145 1HD PRO 145 -5.594 -5.033 -6.830 748 H PHE 146 H PHE 146 -5.616 0.667 -6.062 749 HA PHE 146 HA PHE 146 -6.736 1.485 -8.672 750 HB2 PHE 146 2HB PHE 146 -8.358 2.998 -7.558 751 HB3 PHE 146 1HB PHE 146 -8.699 1.299 -7.264 752 HD1 PHE 146 1HD PHE 146 -8.482 4.442 -5.788 753 HD2 PHE 146 2HD PHE 146 -7.426 0.341 -5.052 754 HE1 PHE 146 1HE PHE 146 -8.445 4.888 -3.353 755 HE2 PHE 146 2HE PHE 146 -7.376 0.799 -2.621 756 HZ PHE 146 HZ PHE 146 -7.889 3.066 -1.767 757 H THR 147 H THR 147 -6.320 3.657 -9.242 758 HA THR 147 HA THR 147 -4.155 4.922 -7.628 759 HB THR 147 HB THR 147 -3.285 5.828 -9.710 760 HG1 THR 147 1HG THR 147 -5.449 5.927 -10.668 761 HG21 THR 147 1HG2 THR 147 -2.186 3.858 -9.665 762 HG22 THR 147 2HG2 THR 147 -3.291 3.369 -10.949 763 HG23 THR 147 3HG2 THR 147 -3.650 2.955 -9.273 764 H CYS 148 H CYS 148 -4.177 7.254 -7.618 765 HA CYS 148 HA CYS 148 -6.735 8.499 -8.408 766 HB2 CYS 148 2HB CYS 148 -5.720 9.383 -5.783 767 HB3 CYS 148 1HB CYS 148 -7.366 8.999 -6.276 768 H TYR 149 H TYR 149 -6.544 10.864 -8.540 769 HA TYR 149 HA TYR 149 -3.775 11.937 -8.424 770 HB2 TYR 149 2HB TYR 149 -5.517 12.113 -10.903 771 HB3 TYR 149 1HB TYR 149 -3.957 12.896 -10.687 772 HD1 TYR 149 1HD TYR 149 -1.891 11.527 -10.426 773 HD2 TYR 149 2HD TYR 149 -5.676 9.767 -11.433 774 HE1 TYR 149 1HE TYR 149 -0.733 9.465 -11.173 775 HE2 TYR 149 2HE TYR 149 -4.520 7.705 -12.181 776 HH TYR 149 HH TYR 149 -1.028 7.549 -12.438 777 H PHE 150 H PHE 150 -3.823 14.041 -7.652 778 HA PHE 150 HA PHE 150 -6.370 15.516 -7.925 779 HB2 PHE 150 2HB PHE 150 -6.941 15.388 -5.749 780 HB3 PHE 150 1HB PHE 150 -5.714 14.136 -5.591 781 HD1 PHE 150 1HD PHE 150 -3.293 14.882 -5.131 782 HD2 PHE 150 2HD PHE 150 -6.704 17.436 -4.651 783 HE1 PHE 150 1HE PHE 150 -1.967 16.363 -3.658 784 HE2 PHE 150 2HE PHE 150 -5.399 18.928 -3.169 785 HZ PHE 150 HZ PHE 150 -3.020 18.390 -2.666 786 H ASN 151 H ASN 151 -6.169 17.780 -7.741 787 HA ASN 151 HA ASN 151 -3.432 18.849 -7.343 788 HB2 ASN 151 2HB ASN 151 -3.439 20.035 -9.437 789 HB3 ASN 151 1HB ASN 151 -3.770 18.342 -9.781 790 HD21 ASN 151 1HD2 ASN 151 -4.580 20.588 -11.489 791 HD22 ASN 151 2HD2 ASN 151 -6.276 20.580 -11.536 792 H GLN 152 H GLN 152 -3.792 20.279 -5.733 793 HA GLN 152 HA GLN 152 -6.263 21.902 -5.678 794 HB2 GLN 152 2HB GLN 152 -5.720 21.116 -3.521 795 HB3 GLN 152 1HB GLN 152 -3.999 21.435 -3.736 796 HG2 GLN 152 2HG GLN 152 -4.336 23.806 -3.578 797 HG3 GLN 152 1HG GLN 152 -6.087 23.630 -3.685 798 HE21 GLN 152 1HE2 GLN 152 -5.121 24.999 -1.472 799 HE22 GLN 152 2HE2 GLN 152 -5.254 24.040 -0.080 800 H HIS 153 H HIS 153 -3.084 22.113 -6.883 801 HA HIS 153 HA HIS 153 -2.414 24.803 -6.396 802 HB2 HIS 153 2HB HIS 153 -0.918 24.648 -8.250 803 HB3 HIS 153 1HB HIS 153 -0.971 23.048 -7.520 804 HD1 HIS 153 1HD HIS 153 -2.833 24.913 -10.296 805 HD2 HIS 153 2HD HIS 153 -1.424 21.090 -9.391 806 HE1 HIS 153 1HE HIS 153 -3.312 23.472 -12.326 807 HE2 HIS 153 2HE HIS 153 -2.458 21.146 -11.787 808 H GLN 154 H GLN 154 -4.878 23.483 -8.498 809 HA GLN 154 HA GLN 154 -5.185 25.834 -10.149 810 HB2 GLN 154 2HB GLN 154 -7.186 23.686 -9.367 811 HB3 GLN 154 1HB GLN 154 -7.438 24.888 -10.630 812 HG2 GLN 154 2HG GLN 154 -5.475 24.034 -11.850 813 HG3 GLN 154 1HG GLN 154 -5.212 22.835 -10.583 814 HE21 GLN 154 1HE2 GLN 154 -5.694 21.978 -13.245 815 HE22 GLN 154 2HE2 GLN 154 -7.220 21.238 -13.317 816 H ARG 155 H ARG 155 -7.172 24.605 -7.453 817 HA ARG 155 HA ARG 155 -7.215 27.137 -6.108 818 HB2 ARG 155 2HB ARG 155 -9.091 26.820 -8.223 819 HB3 ARG 155 1HB ARG 155 -9.988 26.778 -6.702 820 HG2 ARG 155 2HG ARG 155 -9.070 28.893 -6.014 821 HG3 ARG 155 1HG ARG 155 -7.925 28.897 -7.357 822 HD2 ARG 155 2HD ARG 155 -9.467 30.058 -8.523 823 HD3 ARG 155 1HD ARG 155 -10.404 28.565 -8.586 824 HE ARG 155 HE ARG 155 -10.804 30.150 -6.146 825 HH11 ARG 155 1HH1 ARG 155 -12.904 30.941 -5.875 826 HH12 ARG 155 2HH1 ARG 155 -14.012 30.890 -7.204 827 HH21 ARG 155 1HH2 ARG 155 -11.744 29.434 -9.385 828 HH22 ARG 155 2HH2 ARG 155 -13.356 30.037 -9.192 829 HA PRO 156 HA PRO 156 -9.641 23.945 -3.650 830 HB2 PRO 156 2HB PRO 156 -11.307 22.215 -4.813 831 HB3 PRO 156 1HB PRO 156 -11.657 23.954 -4.847 832 HG2 PRO 156 2HG PRO 156 -10.775 22.185 -7.026 833 HG3 PRO 156 1HG PRO 156 -11.628 23.733 -7.104 834 HD2 PRO 156 2HD PRO 156 -8.758 23.231 -7.368 835 HD3 PRO 156 1HD PRO 156 -9.652 24.737 -7.637 836 H ASP 157 H ASP 157 -10.080 21.248 -5.706 837 HA ASP 157 HA ASP 157 -7.538 19.973 -5.534 838 HB2 ASP 157 2HB ASP 157 -8.562 18.277 -3.697 839 HB3 ASP 157 1HB ASP 157 -7.565 19.663 -3.253 840 H ASP 158 H ASP 158 -8.550 19.577 -7.715 841 HA ASP 158 HA ASP 158 -10.925 17.989 -8.007 842 HB2 ASP 158 2HB ASP 158 -8.480 18.164 -9.802 843 HB3 ASP 158 1HB ASP 158 -10.009 17.417 -10.261 844 H VAL 159 H VAL 159 -11.052 15.620 -8.373 845 HA VAL 159 HA VAL 159 -8.626 14.151 -7.425 846 HB VAL 159 HB VAL 159 -10.007 12.767 -5.958 847 HG11 VAL 159 1HG1 VAL 159 -9.947 14.284 -4.255 848 HG12 VAL 159 2HG1 VAL 159 -10.938 15.452 -5.129 849 HG13 VAL 159 3HG1 VAL 159 -9.212 15.332 -5.469 850 HG21 VAL 159 1HG2 VAL 159 -12.250 14.557 -6.945 851 HG22 VAL 159 2HG2 VAL 159 -12.392 13.460 -5.572 852 HG23 VAL 159 3HG2 VAL 159 -12.104 12.816 -7.188 853 H LEU 160 H LEU 160 -8.380 12.068 -8.220 854 HA LEU 160 HA LEU 160 -10.356 11.158 -10.276 855 HB2 LEU 160 2HB LEU 160 -7.333 10.903 -10.348 856 HB3 LEU 160 1HB LEU 160 -8.424 10.203 -11.535 857 HG LEU 160 HG LEU 160 -8.043 13.159 -10.949 858 HD11 LEU 160 1HD1 LEU 160 -7.762 12.354 -13.701 859 HD12 LEU 160 2HD1 LEU 160 -6.712 11.362 -12.693 860 HD13 LEU 160 3HD1 LEU 160 -6.570 13.119 -12.652 861 HD21 LEU 160 1HD2 LEU 160 -10.302 13.089 -11.511 862 HD22 LEU 160 2HD2 LEU 160 -10.116 11.639 -12.496 863 HD23 LEU 160 3HD2 LEU 160 -9.575 13.200 -13.114 864 H LEU 161 H LEU 161 -10.668 8.841 -10.332 865 HA LEU 161 HA LEU 161 -9.285 7.314 -8.183 866 HB2 LEU 161 2HB LEU 161 -11.483 8.224 -7.335 867 HB3 LEU 161 1HB LEU 161 -12.284 7.235 -8.557 868 HG LEU 161 HG LEU 161 -10.704 5.348 -7.484 869 HD11 LEU 161 1HD1 LEU 161 -9.666 6.859 -5.860 870 HD12 LEU 161 2HD1 LEU 161 -10.652 5.663 -5.020 871 HD13 LEU 161 3HD1 LEU 161 -11.253 7.307 -5.235 872 HD21 LEU 161 1HD2 LEU 161 -13.105 5.138 -7.679 873 HD22 LEU 161 2HD2 LEU 161 -13.361 6.347 -6.422 874 HD23 LEU 161 3HD2 LEU 161 -12.666 4.778 -6.010 875 H HIS 162 H HIS 162 -8.389 6.679 -10.522 876 HA HIS 162 HA HIS 162 -10.057 4.892 -12.090 877 HB2 HIS 162 2HB HIS 162 -7.041 5.229 -11.967 878 HB3 HIS 162 1HB HIS 162 -7.882 4.232 -13.154 879 HD1 HIS 162 1HD HIS 162 -6.250 6.623 -14.157 880 HD2 HIS 162 2HD HIS 162 -10.303 6.873 -13.201 881 HE1 HIS 162 1HE HIS 162 -7.163 8.623 -15.417 882 HE2 HIS 162 2HE HIS 162 -9.627 8.785 -14.841 883 H ARG 163 H ARG 163 -10.065 2.583 -12.020 884 HA ARG 163 HA ARG 163 -8.840 1.428 -9.541 885 HB2 ARG 163 2HB ARG 163 -11.331 1.515 -9.552 886 HB3 ARG 163 1HB ARG 163 -11.329 0.492 -10.989 887 HG2 ARG 163 2HG ARG 163 -10.069 -1.241 -9.713 888 HG3 ARG 163 1HG ARG 163 -10.196 -0.231 -8.271 889 HD2 ARG 163 2HD ARG 163 -12.542 -1.316 -9.859 890 HD3 ARG 163 1HD ARG 163 -11.968 -1.958 -8.319 891 HE ARG 163 HE ARG 163 -13.493 0.522 -8.692 892 HH11 ARG 163 1HH1 ARG 163 -14.114 1.536 -6.769 893 HH12 ARG 163 2HH1 ARG 163 -13.399 1.037 -5.273 894 HH21 ARG 163 1HH2 ARG 163 -11.393 -1.385 -6.732 895 HH22 ARG 163 2HH2 ARG 163 -11.858 -0.618 -5.251 896 H THR 164 H THR 164 -7.937 -0.669 -9.666 897 HA THR 164 HA THR 164 -6.717 -1.347 -12.212 898 HB THR 164 HB THR 164 -6.790 -2.814 -9.570 899 HG1 THR 164 1HG THR 164 -5.587 -0.650 -10.240 900 HG21 THR 164 1HG2 THR 164 -4.551 -3.639 -10.975 901 HG22 THR 164 2HG2 THR 164 -5.802 -3.574 -12.218 902 HG23 THR 164 3HG2 THR 164 -6.037 -4.568 -10.780 903 H HIS 165 H HIS 165 -7.361 -2.908 -13.666 904 HA HIS 165 HA HIS 165 -9.806 -4.487 -12.955 905 HB2 HIS 165 2HB HIS 165 -8.952 -3.411 -15.661 906 HB3 HIS 165 1HB HIS 165 -10.372 -4.414 -15.367 907 HD1 HIS 165 1HD HIS 165 -12.090 -3.334 -13.481 908 HD2 HIS 165 2HD HIS 165 -9.478 -0.709 -15.400 909 HE1 HIS 165 1HE HIS 165 -13.031 -1.006 -13.134 910 HE2 HIS 165 2HE HIS 165 -11.448 0.599 -14.298 911 H ASP 166 H ASP 166 -9.691 -6.688 -13.300 912 HA ASP 166 HA ASP 166 -7.065 -7.746 -14.172 913 HB2 ASP 166 2HB ASP 166 -9.425 -9.055 -12.793 914 HB3 ASP 166 1HB ASP 166 -7.955 -9.912 -13.261 Start of MODEL 7 1 H1 GLN 45 1HT GLN 45 4.426 20.984 -1.994 2 H2 GLN 45 2HT GLN 45 4.198 21.799 -0.520 3 H3 GLN 45 3HT GLN 45 5.059 20.334 -0.561 4 HA GLN 45 HA GLN 45 6.034 22.954 -0.867 5 HB2 GLN 45 2HB GLN 45 7.323 20.211 -0.995 6 HB3 GLN 45 1HB GLN 45 8.209 21.729 -0.842 7 HG2 GLN 45 2HG GLN 45 7.052 22.214 1.269 8 HG3 GLN 45 1HG GLN 45 6.117 20.727 1.113 9 HE21 GLN 45 1HE2 GLN 45 7.820 21.150 3.369 10 HE22 GLN 45 2HE2 GLN 45 9.114 20.053 3.282 11 H ASP 46 H ASP 46 7.214 20.278 -2.864 12 HA ASP 46 HA ASP 46 7.421 22.149 -5.139 13 HB2 ASP 46 2HB ASP 46 8.402 19.308 -4.740 14 HB3 ASP 46 1HB ASP 46 8.662 20.246 -6.211 15 H LEU 47 H LEU 47 6.540 18.700 -5.065 16 HA LEU 47 HA LEU 47 4.609 19.137 -7.228 17 HB2 LEU 47 2HB LEU 47 5.175 16.621 -5.634 18 HB3 LEU 47 1HB LEU 47 4.339 16.720 -7.184 19 HG LEU 47 HG LEU 47 7.221 17.531 -6.697 20 HD11 LEU 47 1HD1 LEU 47 7.154 15.163 -6.631 21 HD12 LEU 47 2HD1 LEU 47 7.578 15.545 -8.299 22 HD13 LEU 47 3HD1 LEU 47 5.927 15.079 -7.895 23 HD21 LEU 47 1HD2 LEU 47 6.690 18.823 -8.523 24 HD22 LEU 47 2HD2 LEU 47 5.317 17.811 -8.969 25 HD23 LEU 47 3HD2 LEU 47 6.956 17.301 -9.377 26 H GLN 48 H GLN 48 4.511 19.738 -4.047 27 HA GLN 48 HA GLN 48 2.785 19.128 -2.358 28 HB2 GLN 48 2HB GLN 48 1.118 21.129 -3.019 29 HB3 GLN 48 1HB GLN 48 2.729 21.417 -2.362 30 HG2 GLN 48 2HG GLN 48 3.647 21.662 -4.609 31 HG3 GLN 48 1HG GLN 48 2.085 21.259 -5.321 32 HE21 GLN 48 1HE2 GLN 48 0.681 22.986 -5.704 33 HE22 GLN 48 2HE2 GLN 48 0.885 24.546 -5.070 34 H ALA 49 H ALA 49 0.604 20.364 -4.808 35 HA ALA 49 HA ALA 49 -1.040 17.915 -4.452 36 HB1 ALA 49 1HB ALA 49 -2.882 19.285 -5.324 37 HB2 ALA 49 2HB ALA 49 -1.761 20.610 -5.635 38 HB3 ALA 49 3HB ALA 49 -2.095 20.109 -3.979 39 H THR 50 H THR 50 -1.022 16.438 -6.063 40 HA THR 50 HA THR 50 -1.265 17.068 -8.842 41 HB THR 50 HB THR 50 1.497 16.109 -8.017 42 HG1 THR 50 1HG THR 50 1.333 18.288 -7.609 43 HG21 THR 50 1HG2 THR 50 0.897 17.108 -10.750 44 HG22 THR 50 2HG2 THR 50 0.215 15.537 -10.333 45 HG23 THR 50 3HG2 THR 50 1.956 15.798 -10.237 46 H GLU 51 H GLU 51 0.712 14.604 -7.207 47 HA GLU 51 HA GLU 51 -1.175 12.557 -8.271 48 HB2 GLU 51 2HB GLU 51 1.751 12.268 -7.554 49 HB3 GLU 51 1HB GLU 51 0.728 11.022 -8.273 50 HG2 GLU 51 2HG GLU 51 0.348 12.523 -10.233 51 HG3 GLU 51 1HG GLU 51 1.474 13.680 -9.526 52 H ALA 52 H ALA 52 -2.006 11.048 -6.921 53 HA ALA 52 HA ALA 52 -0.965 10.706 -4.187 54 HB1 ALA 52 1HB ALA 52 -3.589 10.842 -3.561 55 HB2 ALA 52 2HB ALA 52 -3.555 12.028 -4.866 56 HB3 ALA 52 3HB ALA 52 -2.528 12.247 -3.449 57 H ASN 53 H ASN 53 -0.705 8.484 -4.310 58 HA ASN 53 HA ASN 53 -2.754 6.965 -5.815 59 HB2 ASN 53 2HB ASN 53 0.032 6.238 -4.930 60 HB3 ASN 53 1HB ASN 53 -1.076 5.091 -5.684 61 HD21 ASN 53 1HD2 ASN 53 -2.318 6.939 -7.553 62 HD22 ASN 53 2HD2 ASN 53 -1.146 7.370 -8.703 63 H CYS 54 H CYS 54 -4.003 5.399 -4.934 64 HA CYS 54 HA CYS 54 -3.641 4.804 -2.030 65 HB2 CYS 54 2HB CYS 54 -6.267 4.717 -2.130 66 HB3 CYS 54 1HB CYS 54 -5.480 6.285 -1.969 67 H THR 55 H THR 55 -2.833 2.684 -2.462 68 HA THR 55 HA THR 55 -4.720 1.002 -4.030 69 HB THR 55 HB THR 55 -3.094 0.340 -5.425 70 HG1 THR 55 1HG THR 55 -1.339 0.140 -3.213 71 HG21 THR 55 1HG2 THR 55 -1.283 1.800 -5.764 72 HG22 THR 55 2HG2 THR 55 -1.112 2.145 -4.048 73 HG23 THR 55 3HG2 THR 55 -2.455 2.829 -4.953 74 H VAL 56 H VAL 56 -5.077 -1.077 -3.419 75 HA VAL 56 HA VAL 56 -4.250 -1.770 -0.653 76 HB VAL 56 HB VAL 56 -6.423 -2.751 -2.516 77 HG11 VAL 56 1HG1 VAL 56 -6.870 -4.356 -0.484 78 HG12 VAL 56 2HG1 VAL 56 -5.146 -4.139 -0.177 79 HG13 VAL 56 3HG1 VAL 56 -5.689 -4.817 -1.711 80 HG21 VAL 56 1HG2 VAL 56 -7.774 -1.573 -1.148 81 HG22 VAL 56 2HG2 VAL 56 -6.325 -0.911 -0.389 82 HG23 VAL 56 3HG2 VAL 56 -7.091 -2.352 0.277 83 H LEU 57 H LEU 57 -2.420 -2.956 -0.586 84 HA LEU 57 HA LEU 57 -1.000 -4.006 -2.699 85 HB2 LEU 57 2HB LEU 57 -1.171 -4.603 0.178 86 HB3 LEU 57 1HB LEU 57 -0.476 -5.891 -0.808 87 HG LEU 57 HG LEU 57 0.428 -3.053 -1.197 88 HD11 LEU 57 1HD1 LEU 57 1.242 -4.966 0.995 89 HD12 LEU 57 2HD1 LEU 57 0.754 -3.279 1.149 90 HD13 LEU 57 3HD1 LEU 57 2.312 -3.683 0.429 91 HD21 LEU 57 1HD2 LEU 57 2.032 -5.603 -1.332 92 HD22 LEU 57 2HD2 LEU 57 2.318 -4.075 -2.166 93 HD23 LEU 57 3HD2 LEU 57 0.991 -5.121 -2.671 94 H SER 58 H SER 58 -0.853 -6.044 -3.718 95 HA SER 58 HA SER 58 -3.410 -7.542 -3.772 96 HB2 SER 58 2HB SER 58 -2.371 -6.770 -5.926 97 HB3 SER 58 1HB SER 58 -0.979 -7.791 -5.577 98 HG SER 58 HG SER 58 -2.101 -9.474 -6.155 99 H VAL 59 H VAL 59 -3.425 -9.802 -3.249 100 HA VAL 59 HA VAL 59 -1.073 -10.619 -1.640 101 HB VAL 59 HB VAL 59 -3.683 -12.116 -1.914 102 HG11 VAL 59 1HG1 VAL 59 -1.535 -13.061 -0.797 103 HG12 VAL 59 2HG1 VAL 59 -3.047 -13.158 0.108 104 HG13 VAL 59 3HG1 VAL 59 -1.869 -11.900 0.488 105 HG21 VAL 59 1HG2 VAL 59 -3.173 -9.496 -0.737 106 HG22 VAL 59 2HG2 VAL 59 -3.736 -10.649 0.474 107 HG23 VAL 59 3HG2 VAL 59 -4.707 -10.334 -0.966 108 H GLN 60 H GLN 60 0.455 -11.752 -2.668 109 HA GLN 60 HA GLN 60 -0.349 -13.982 -4.442 110 HB2 GLN 60 2HB GLN 60 1.662 -11.840 -5.214 111 HB3 GLN 60 1HB GLN 60 1.339 -13.312 -6.132 112 HG2 GLN 60 2HG GLN 60 -1.008 -12.622 -6.432 113 HG3 GLN 60 1HG GLN 60 -0.697 -11.153 -5.507 114 HE21 GLN 60 1HE2 GLN 60 -1.591 -10.700 -8.048 115 HE22 GLN 60 2HE2 GLN 60 -0.328 -10.202 -9.066 116 H GLN 61 H GLN 61 1.363 -15.614 -4.585 117 HA GLN 61 HA GLN 61 2.827 -15.941 -2.156 118 HB2 GLN 61 2HB GLN 61 3.317 -17.241 -4.849 119 HB3 GLN 61 1HB GLN 61 3.925 -17.827 -3.303 120 HG2 GLN 61 2HG GLN 61 1.009 -17.552 -4.090 121 HG3 GLN 61 1HG GLN 61 1.906 -19.065 -3.941 122 HE21 GLN 61 1HE2 GLN 61 -0.119 -16.967 -2.244 123 HE22 GLN 61 2HE2 GLN 61 0.256 -17.473 -0.673 124 H ILE 62 H ILE 62 3.860 -14.881 -5.389 125 HA ILE 62 HA ILE 62 5.801 -13.036 -4.449 126 HB ILE 62 HB ILE 62 6.775 -15.512 -3.944 127 HG12 ILE 62 2HG1 ILE 62 8.477 -13.280 -5.090 128 HG13 ILE 62 1HG1 ILE 62 7.826 -13.276 -3.451 129 HG21 ILE 62 1HG2 ILE 62 7.950 -14.898 -6.649 130 HG22 ILE 62 2HG2 ILE 62 6.566 -15.977 -6.469 131 HG23 ILE 62 3HG2 ILE 62 8.100 -16.371 -5.696 132 HD11 ILE 62 1HD1 ILE 62 9.086 -15.810 -3.943 133 HD12 ILE 62 2HD1 ILE 62 9.512 -14.585 -2.748 134 HD13 ILE 62 3HD1 ILE 62 10.211 -14.518 -4.366 135 H GLY 63 H GLY 63 7.514 -12.697 -6.429 136 HA2 GLY 63 2HA GLY 63 7.823 -12.661 -8.819 137 HA3 GLY 63 1HA GLY 63 6.184 -13.281 -9.014 138 H GLU 64 H GLU 64 5.951 -10.938 -6.729 139 HA GLU 64 HA GLU 64 5.220 -8.898 -8.776 140 HB2 GLU 64 2HB GLU 64 3.387 -9.753 -7.292 141 HB3 GLU 64 1HB GLU 64 4.272 -9.116 -5.906 142 HG2 GLU 64 2HG GLU 64 2.629 -7.465 -6.558 143 HG3 GLU 64 1HG GLU 64 4.220 -6.850 -7.008 144 H VAL 65 H VAL 65 6.071 -6.812 -8.581 145 HA VAL 65 HA VAL 65 8.145 -6.461 -6.460 146 HB VAL 65 HB VAL 65 9.315 -4.988 -8.020 147 HG11 VAL 65 1HG1 VAL 65 8.647 -7.784 -8.653 148 HG12 VAL 65 2HG1 VAL 65 10.223 -6.996 -8.564 149 HG13 VAL 65 3HG1 VAL 65 9.255 -6.868 -10.032 150 HG21 VAL 65 1HG2 VAL 65 7.780 -3.891 -9.353 151 HG22 VAL 65 2HG2 VAL 65 6.765 -5.320 -9.541 152 HG23 VAL 65 3HG2 VAL 65 8.255 -5.167 -10.474 153 H PHE 66 H PHE 66 7.990 -4.661 -5.173 154 HA PHE 66 HA PHE 66 5.861 -2.682 -5.846 155 HB2 PHE 66 2HB PHE 66 6.541 -3.960 -3.197 156 HB3 PHE 66 1HB PHE 66 5.579 -2.485 -3.319 157 HD1 PHE 66 1HD PHE 66 3.381 -2.495 -4.378 158 HD2 PHE 66 2HD PHE 66 5.665 -6.113 -3.970 159 HE1 PHE 66 1HE PHE 66 1.361 -3.824 -4.897 160 HE2 PHE 66 2HE PHE 66 3.639 -7.443 -4.486 161 HZ PHE 66 HZ PHE 66 1.486 -6.302 -4.951 162 H GLU 67 H GLU 67 6.245 -0.521 -5.118 163 HA GLU 67 HA GLU 67 9.081 0.041 -4.360 164 HB2 GLU 67 2HB GLU 67 8.623 0.561 -6.764 165 HB3 GLU 67 1HB GLU 67 7.366 1.685 -6.244 166 HG2 GLU 67 2HG GLU 67 9.076 2.930 -4.921 167 HG3 GLU 67 1HG GLU 67 10.315 1.850 -5.562 168 H CYS 68 H CYS 68 9.351 1.637 -2.803 169 HA CYS 68 HA CYS 68 6.837 2.729 -1.608 170 HB2 CYS 68 2HB CYS 68 9.456 1.846 -0.474 171 HB3 CYS 68 1HB CYS 68 8.653 3.202 0.310 172 H THR 69 H THR 69 6.996 5.008 -0.833 173 HA THR 69 HA THR 69 9.010 6.561 -2.404 174 HB THR 69 HB THR 69 7.381 8.088 -3.072 175 HG1 THR 69 1HG THR 69 6.228 7.315 -0.684 176 HG21 THR 69 1HG2 THR 69 5.601 6.817 -4.035 177 HG22 THR 69 2HG2 THR 69 5.691 5.602 -2.761 178 HG23 THR 69 3HG2 THR 69 6.986 5.727 -3.951 179 H PHE 70 H PHE 70 9.783 8.476 -1.444 180 HA PHE 70 HA PHE 70 9.009 8.972 1.386 181 HB2 PHE 70 2HB PHE 70 11.849 8.691 0.350 182 HB3 PHE 70 1HB PHE 70 11.422 9.287 1.954 183 HD1 PHE 70 1HD PHE 70 9.770 7.731 3.323 184 HD2 PHE 70 2HD PHE 70 12.254 6.408 0.079 185 HE1 PHE 70 1HE PHE 70 9.615 5.400 4.154 186 HE2 PHE 70 2HE PHE 70 12.096 4.078 0.907 187 HZ PHE 70 HZ PHE 70 10.776 3.572 2.946 188 H THR 71 H THR 71 9.579 11.198 2.059 189 HA THR 71 HA THR 71 10.129 13.007 -0.247 190 HB THR 71 HB THR 71 8.057 13.495 1.909 191 HG1 THR 71 1HG THR 71 6.605 13.176 0.152 192 HG21 THR 71 1HG2 THR 71 7.588 15.132 -0.296 193 HG22 THR 71 2HG2 THR 71 9.344 15.154 -0.119 194 HG23 THR 71 3HG2 THR 71 8.315 15.633 1.231 195 H CYS 72 H CYS 72 11.629 14.542 0.192 196 HA CYS 72 HA CYS 72 12.193 15.207 3.036 197 HB2 CYS 72 2HB CYS 72 14.701 15.308 1.911 198 HB3 CYS 72 1HB CYS 72 14.094 13.973 2.888 199 H GLY 73 H GLY 73 13.615 17.245 3.106 200 HA2 GLY 73 2HA GLY 73 12.436 19.194 1.250 201 HA3 GLY 73 1HA GLY 73 13.429 19.576 2.658 202 H ALA 74 H ALA 74 14.113 21.023 0.563 203 HA ALA 74 HA ALA 74 15.987 21.594 -0.737 204 HB1 ALA 74 1HB ALA 74 17.081 20.204 1.240 205 HB2 ALA 74 2HB ALA 74 18.024 20.640 -0.184 206 HB3 ALA 74 3HB ALA 74 17.342 19.021 -0.040 207 H ASP 75 H ASP 75 13.764 19.981 -1.776 208 HA ASP 75 HA ASP 75 13.206 18.770 -3.702 209 HB2 ASP 75 2HB ASP 75 15.951 19.771 -4.527 210 HB3 ASP 75 1HB ASP 75 14.785 19.027 -5.619 211 H CYS 76 H CYS 76 14.190 17.249 -1.585 212 HA CYS 76 HA CYS 76 15.964 15.246 -2.913 213 HB2 CYS 76 2HB CYS 76 17.012 15.706 -0.893 214 HB3 CYS 76 1HB CYS 76 15.495 16.049 -0.068 215 H ARG 77 H ARG 77 15.146 13.226 -3.324 216 HA ARG 77 HA ARG 77 12.494 12.537 -2.135 217 HB2 ARG 77 2HB ARG 77 13.206 11.815 -4.982 218 HB3 ARG 77 1HB ARG 77 11.614 11.861 -4.227 219 HG2 ARG 77 2HG ARG 77 13.333 14.310 -4.734 220 HG3 ARG 77 1HG ARG 77 12.022 13.782 -5.784 221 HD2 ARG 77 2HD ARG 77 10.948 13.830 -3.169 222 HD3 ARG 77 1HD ARG 77 11.875 15.323 -3.345 223 HE ARG 77 HE ARG 77 10.104 14.709 -5.605 224 HH11 ARG 77 1HH1 ARG 77 8.458 16.222 -5.940 225 HH12 ARG 77 2HH1 ARG 77 8.119 17.397 -4.714 226 HH21 ARG 77 1HH2 ARG 77 10.577 16.247 -2.557 227 HH22 ARG 77 2HH2 ARG 77 9.320 17.411 -2.799 228 H GLY 78 H GLY 78 12.192 10.200 -1.893 229 HA2 GLY 78 2HA GLY 78 14.601 8.555 -2.465 230 HA3 GLY 78 1HA GLY 78 14.012 8.625 -0.806 231 H THR 79 H THR 79 14.084 6.549 -3.175 232 HA THR 79 HA THR 79 11.363 5.485 -2.589 233 HB THR 79 HB THR 79 11.215 4.645 -4.902 234 HG1 THR 79 1HG THR 79 12.853 5.725 -6.336 235 HG21 THR 79 1HG2 THR 79 10.175 6.574 -5.375 236 HG22 THR 79 2HG2 THR 79 11.726 7.343 -5.710 237 HG23 THR 79 3HG2 THR 79 11.066 7.364 -4.075 238 H SER 80 H SER 80 11.284 3.091 -2.741 239 HA SER 80 HA SER 80 13.983 1.813 -2.601 240 HB2 SER 80 2HB SER 80 11.664 1.305 -0.717 241 HB3 SER 80 1HB SER 80 13.193 0.430 -0.716 242 HG SER 80 HG SER 80 13.361 3.194 -0.646 243 H GLN 81 H GLN 81 14.044 -0.359 -3.331 244 HA GLN 81 HA GLN 81 11.588 -1.252 -4.781 245 HB2 GLN 81 2HB GLN 81 13.565 -0.676 -6.221 246 HB3 GLN 81 1HB GLN 81 14.469 -1.947 -5.404 247 HG2 GLN 81 2HG GLN 81 13.608 -2.930 -7.406 248 HG3 GLN 81 1HG GLN 81 12.615 -3.546 -6.083 249 HE21 GLN 81 1HE2 GLN 81 10.391 -3.137 -6.186 250 HE22 GLN 81 2HE2 GLN 81 9.663 -2.100 -7.311 251 H TYR 82 H TYR 82 10.679 -3.072 -3.926 252 HA TYR 82 HA TYR 82 12.467 -5.086 -2.663 253 HB2 TYR 82 2HB TYR 82 10.522 -5.246 -0.877 254 HB3 TYR 82 1HB TYR 82 11.787 -4.029 -0.695 255 HD1 TYR 82 1HD TYR 82 11.367 -1.709 -1.728 256 HD2 TYR 82 2HD TYR 82 8.265 -4.605 -1.075 257 HE1 TYR 82 1HE TYR 82 9.666 0.079 -1.888 258 HE2 TYR 82 2HE TYR 82 6.560 -2.811 -1.228 259 HH TYR 82 HH TYR 82 7.508 0.592 -1.658 260 HA PRO 83 HA PRO 83 9.909 -7.997 -4.787 261 HB2 PRO 83 2HB PRO 83 9.831 -10.059 -2.933 262 HB3 PRO 83 1HB PRO 83 11.184 -9.744 -4.032 263 HG2 PRO 83 2HG PRO 83 10.872 -9.049 -1.162 264 HG3 PRO 83 1HG PRO 83 12.313 -9.570 -2.053 265 HD2 PRO 83 2HD PRO 83 11.891 -6.972 -1.363 266 HD3 PRO 83 1HD PRO 83 12.772 -7.438 -2.834 267 H CYS 84 H CYS 84 8.147 -9.898 -3.514 268 HA CYS 84 HA CYS 84 5.797 -8.254 -3.208 269 HB2 CYS 84 2HB CYS 84 4.729 -10.212 -3.542 270 HB3 CYS 84 1HB CYS 84 6.323 -10.941 -3.728 271 H VAL 85 H VAL 85 4.615 -7.782 -1.341 272 HA VAL 85 HA VAL 85 5.899 -8.484 1.266 273 HB VAL 85 HB VAL 85 5.146 -6.212 2.072 274 HG11 VAL 85 1HG1 VAL 85 7.003 -5.003 0.864 275 HG12 VAL 85 2HG1 VAL 85 7.158 -6.415 -0.182 276 HG13 VAL 85 3HG1 VAL 85 7.473 -6.560 1.546 277 HG21 VAL 85 1HG2 VAL 85 3.487 -5.648 0.429 278 HG22 VAL 85 2HG2 VAL 85 4.622 -5.898 -0.897 279 HG23 VAL 85 3HG2 VAL 85 4.824 -4.525 0.190 280 H GLN 86 H GLN 86 4.231 -7.978 3.110 281 HA GLN 86 HA GLN 86 2.012 -9.688 2.811 282 HB2 GLN 86 2HB GLN 86 2.168 -7.339 4.712 283 HB3 GLN 86 1HB GLN 86 1.212 -8.806 4.907 284 HG2 GLN 86 2HG GLN 86 4.240 -8.677 4.798 285 HG3 GLN 86 1HG GLN 86 3.273 -8.931 6.252 286 HE21 GLN 86 1HE2 GLN 86 5.165 -10.684 4.312 287 HE22 GLN 86 2HE2 GLN 86 4.318 -12.154 4.263 288 H VAL 87 H VAL 87 -0.238 -8.233 3.738 289 HA VAL 87 HA VAL 87 -0.822 -6.514 1.356 290 HB VAL 87 HB VAL 87 -1.947 -8.727 1.272 291 HG11 VAL 87 1HG1 VAL 87 -3.801 -7.976 3.455 292 HG12 VAL 87 2HG1 VAL 87 -2.188 -8.467 3.972 293 HG13 VAL 87 3HG1 VAL 87 -3.175 -9.563 3.006 294 HG21 VAL 87 1HG2 VAL 87 -4.042 -7.860 0.610 295 HG22 VAL 87 2HG2 VAL 87 -2.955 -6.480 0.446 296 HG23 VAL 87 3HG2 VAL 87 -4.015 -6.607 1.850 297 H TYR 88 H TYR 88 -2.069 -4.677 1.670 298 HA TYR 88 HA TYR 88 -3.544 -4.063 3.998 299 HB2 TYR 88 2HB TYR 88 -1.298 -3.980 5.044 300 HB3 TYR 88 1HB TYR 88 -0.846 -2.708 3.934 301 HD1 TYR 88 1HD TYR 88 -0.375 -1.765 6.392 302 HD2 TYR 88 2HD TYR 88 -4.314 -2.217 4.703 303 HE1 TYR 88 1HE TYR 88 -1.270 -0.100 7.983 304 HE2 TYR 88 2HE TYR 88 -5.178 -0.559 6.287 305 HH TYR 88 HH TYR 88 -4.730 0.729 8.030 306 H VAL 89 H VAL 89 -2.167 -1.181 3.662 307 HA VAL 89 HA VAL 89 -3.484 -0.535 1.069 308 HB VAL 89 HB VAL 89 -5.019 -0.011 2.980 309 HG11 VAL 89 1HG1 VAL 89 -2.999 0.552 4.488 310 HG12 VAL 89 2HG1 VAL 89 -4.416 1.594 4.618 311 HG13 VAL 89 3HG1 VAL 89 -3.011 2.128 3.696 312 HG21 VAL 89 1HG2 VAL 89 -4.663 2.686 2.273 313 HG22 VAL 89 2HG2 VAL 89 -5.706 1.519 1.462 314 HG23 VAL 89 3HG2 VAL 89 -4.054 1.771 0.893 315 H ASN 90 H ASN 90 -2.309 0.857 -0.164 316 HA ASN 90 HA ASN 90 0.215 1.863 0.978 317 HB2 ASN 90 2HB ASN 90 -0.861 1.780 -1.845 318 HB3 ASN 90 1HB ASN 90 0.709 2.442 -1.410 319 HD21 ASN 90 1HD2 ASN 90 0.078 -0.087 0.707 320 HD22 ASN 90 2HD2 ASN 90 0.885 -1.332 -0.118 321 H ASN 91 H ASN 91 -0.040 3.820 2.017 322 HA ASN 91 HA ASN 91 -2.006 5.739 0.915 323 HB2 ASN 91 2HB ASN 91 -0.325 5.824 3.441 324 HB3 ASN 91 1HB ASN 91 -1.491 7.059 2.970 325 HD21 ASN 91 1HD2 ASN 91 -1.786 5.520 5.390 326 HD22 ASN 91 2HD2 ASN 91 -3.168 4.548 5.226 327 H SER 92 H SER 92 -0.844 6.264 -0.998 328 HA SER 92 HA SER 92 1.759 7.644 -0.631 329 HB2 SER 92 2HB SER 92 1.074 7.539 -3.371 330 HB3 SER 92 1HB SER 92 2.287 6.571 -2.536 331 HG SER 92 HG SER 92 0.430 5.206 -1.915 332 H GLU 93 H GLU 93 -1.049 8.685 -0.032 333 HA GLU 93 HA GLU 93 -1.613 10.724 -2.006 334 HB2 GLU 93 2HB GLU 93 -3.169 11.609 -0.379 335 HB3 GLU 93 1HB GLU 93 -3.258 9.850 -0.291 336 HG2 GLU 93 2HG GLU 93 -1.619 9.926 1.613 337 HG3 GLU 93 1HG GLU 93 -1.736 11.685 1.581 338 H SER 94 H SER 94 0.799 10.307 0.273 339 HA SER 94 HA SER 94 2.482 12.350 -0.233 340 HB2 SER 94 2HB SER 94 1.729 14.033 1.689 341 HB3 SER 94 1HB SER 94 1.107 14.197 0.050 342 HG SER 94 HG SER 94 -0.799 13.548 0.711 343 H ASN 95 H ASN 95 0.993 10.270 2.008 344 HA ASN 95 HA ASN 95 2.980 10.716 4.127 345 HB2 ASN 95 2HB ASN 95 0.617 10.211 4.693 346 HB3 ASN 95 1HB ASN 95 0.787 8.636 3.916 347 HD21 ASN 95 1HD2 ASN 95 2.248 10.627 6.539 348 HD22 ASN 95 2HD2 ASN 95 2.701 9.299 7.496 349 H SER 96 H SER 96 2.082 7.447 3.750 350 HA SER 96 HA SER 96 4.406 6.689 2.119 351 HB2 SER 96 2HB SER 96 4.991 7.123 4.713 352 HB3 SER 96 1HB SER 96 4.409 5.463 4.829 353 HG SER 96 HG SER 96 6.179 6.139 2.766 354 H ARG 97 H ARG 97 4.596 4.139 2.273 355 HA ARG 97 HA ARG 97 1.870 3.121 1.855 356 HB2 ARG 97 2HB ARG 97 3.357 2.356 0.191 357 HB3 ARG 97 1HB ARG 97 4.626 2.006 1.365 358 HG2 ARG 97 2HG ARG 97 3.495 0.091 2.189 359 HG3 ARG 97 1HG ARG 97 1.976 0.558 1.431 360 HD2 ARG 97 2HD ARG 97 2.915 -1.198 0.091 361 HD3 ARG 97 1HD ARG 97 3.131 0.305 -0.806 362 HE ARG 97 HE ARG 97 5.458 -0.003 -0.593 363 HH11 ARG 97 1HH1 ARG 97 7.310 -0.959 0.294 364 HH12 ARG 97 2HH1 ARG 97 7.149 -2.055 1.624 365 HH21 ARG 97 1HH2 ARG 97 3.699 -1.767 1.788 366 HH22 ARG 97 2HH2 ARG 97 5.106 -2.512 2.471 367 H ALA 98 H ALA 98 0.780 1.922 3.325 368 HA ALA 98 HA ALA 98 2.188 1.151 5.821 369 HB1 ALA 98 1HB ALA 98 -0.764 0.818 5.474 370 HB2 ALA 98 2HB ALA 98 -0.125 2.459 5.591 371 HB3 ALA 98 3HB ALA 98 0.147 1.311 6.901 372 H LEU 99 H LEU 99 2.546 -0.980 6.310 373 HA LEU 99 HA LEU 99 1.359 -3.030 4.477 374 HB2 LEU 99 2HB LEU 99 3.821 -2.746 4.254 375 HB3 LEU 99 1HB LEU 99 4.000 -3.139 5.963 376 HG LEU 99 HG LEU 99 2.883 -5.334 5.528 377 HD11 LEU 99 1HD1 LEU 99 2.815 -4.162 2.771 378 HD12 LEU 99 2HD1 LEU 99 1.599 -5.131 3.604 379 HD13 LEU 99 3HD1 LEU 99 3.039 -5.903 2.939 380 HD21 LEU 99 1HD2 LEU 99 5.336 -4.744 3.842 381 HD22 LEU 99 2HD2 LEU 99 4.820 -6.347 4.367 382 HD23 LEU 99 3HD2 LEU 99 5.341 -5.154 5.556 383 H LEU 100 H LEU 100 0.219 -4.652 5.402 384 HA LEU 100 HA LEU 100 0.289 -4.902 8.385 385 HB2 LEU 100 2HB LEU 100 -1.828 -3.907 7.384 386 HB3 LEU 100 1HB LEU 100 -2.078 -5.449 6.572 387 HG LEU 100 HG LEU 100 -2.065 -6.594 8.772 388 HD11 LEU 100 1HD1 LEU 100 -0.958 -5.410 10.381 389 HD12 LEU 100 2HD1 LEU 100 -2.530 -4.654 10.637 390 HD13 LEU 100 3HD1 LEU 100 -1.324 -3.859 9.627 391 HD21 LEU 100 1HD2 LEU 100 -4.019 -4.275 8.660 392 HD22 LEU 100 2HD2 LEU 100 -4.273 -5.827 9.453 393 HD23 LEU 100 3HD2 LEU 100 -4.171 -5.743 7.696 394 H HIS 101 H HIS 101 0.408 -7.031 9.181 395 HA HIS 101 HA HIS 101 1.061 -9.074 7.139 396 HB2 HIS 101 2HB HIS 101 1.428 -8.941 10.138 397 HB3 HIS 101 1HB HIS 101 1.748 -10.405 9.207 398 HD1 HIS 101 1HD HIS 101 2.598 -6.720 8.635 399 HD2 HIS 101 2HD HIS 101 4.446 -10.460 8.642 400 HE1 HIS 101 1HE HIS 101 5.010 -6.329 7.970 401 HE2 HIS 101 2HE HIS 101 6.148 -8.596 7.982 402 H SER 102 H SER 102 -0.538 -10.394 6.471 403 HA SER 102 HA SER 102 -3.097 -10.554 7.762 404 HB2 SER 102 2HB SER 102 -1.867 -12.524 5.812 405 HB3 SER 102 1HB SER 102 -3.581 -12.339 6.170 406 HG SER 102 HG SER 102 -2.078 -10.121 5.328 407 H ASP 103 H ASP 103 -0.211 -12.605 7.805 408 HA ASP 103 HA ASP 103 -0.752 -13.583 10.447 409 HB2 ASP 103 2HB ASP 103 -2.489 -14.820 8.960 410 HB3 ASP 103 1HB ASP 103 -1.103 -15.727 8.357 411 H GLU 104 H GLU 104 0.951 -15.085 11.142 412 HA GLU 104 HA GLU 104 3.486 -14.531 9.930 413 HB2 GLU 104 2HB GLU 104 2.663 -16.670 11.919 414 HB3 GLU 104 1HB GLU 104 4.330 -16.277 11.506 415 HG2 GLU 104 2HG GLU 104 3.944 -13.937 12.245 416 HG3 GLU 104 1HG GLU 104 2.303 -14.378 12.720 417 H HIS 105 H HIS 105 1.183 -17.183 9.579 418 HA HIS 105 HA HIS 105 2.828 -19.102 8.339 419 HB2 HIS 105 2HB HIS 105 -0.056 -18.391 7.730 420 HB3 HIS 105 1HB HIS 105 0.753 -19.851 7.158 421 HD1 HIS 105 1HD HIS 105 2.142 -21.019 9.442 422 HD2 HIS 105 2HD HIS 105 -1.496 -19.053 9.985 423 HE1 HIS 105 1HE HIS 105 1.186 -21.867 11.632 424 HE2 HIS 105 2HE HIS 105 -1.026 -20.675 11.972 425 H GLN 106 H GLN 106 1.275 -16.231 6.941 426 HA GLN 106 HA GLN 106 1.960 -16.742 4.224 427 HB2 GLN 106 2HB GLN 106 1.706 -14.089 5.677 428 HB3 GLN 106 1HB GLN 106 1.710 -14.295 3.929 429 HG2 GLN 106 2HG GLN 106 -0.316 -15.500 5.836 430 HG3 GLN 106 1HG GLN 106 -0.597 -14.115 4.781 431 HE21 GLN 106 1HE2 GLN 106 -1.441 -17.228 4.908 432 HE22 GLN 106 2HE2 GLN 106 -1.378 -17.655 3.267 433 H LEU 107 H LEU 107 3.723 -15.187 6.865 434 HA LEU 107 HA LEU 107 5.986 -14.322 5.358 435 HB2 LEU 107 2HB LEU 107 5.536 -13.620 7.698 436 HB3 LEU 107 1HB LEU 107 5.873 -15.262 8.242 437 HG LEU 107 HG LEU 107 8.165 -15.069 7.250 438 HD11 LEU 107 1HD1 LEU 107 7.002 -12.526 6.338 439 HD12 LEU 107 2HD1 LEU 107 8.384 -13.419 5.707 440 HD13 LEU 107 3HD1 LEU 107 8.586 -12.345 7.093 441 HD21 LEU 107 1HD2 LEU 107 8.730 -14.485 9.351 442 HD22 LEU 107 2HD2 LEU 107 7.100 -13.858 9.608 443 HD23 LEU 107 3HD2 LEU 107 8.366 -12.798 8.985 444 H LEU 108 H LEU 108 5.268 -17.378 7.029 445 HA LEU 108 HA LEU 108 7.774 -18.647 6.382 446 HB2 LEU 108 2HB LEU 108 5.066 -19.925 6.900 447 HB3 LEU 108 1HB LEU 108 6.631 -20.735 6.987 448 HG LEU 108 HG LEU 108 5.696 -18.449 8.747 449 HD11 LEU 108 1HD1 LEU 108 6.166 -20.308 10.503 450 HD12 LEU 108 2HD1 LEU 108 6.064 -21.416 9.134 451 HD13 LEU 108 3HD1 LEU 108 4.680 -20.413 9.560 452 HD21 LEU 108 1HD2 LEU 108 8.359 -19.780 8.336 453 HD22 LEU 108 2HD2 LEU 108 7.925 -19.198 9.944 454 HD23 LEU 108 3HD2 LEU 108 7.994 -18.073 8.587 455 H THR 109 H THR 109 4.744 -18.168 4.712 456 HA THR 109 HA THR 109 5.177 -20.102 2.619 457 HB THR 109 HB THR 109 3.485 -17.584 2.601 458 HG1 THR 109 1HG THR 109 2.915 -20.239 3.421 459 HG21 THR 109 1HG2 THR 109 3.749 -18.500 0.394 460 HG22 THR 109 2HG2 THR 109 2.143 -18.941 0.977 461 HG23 THR 109 3HG2 THR 109 3.443 -20.133 0.984 462 H ASN 110 H ASN 110 5.886 -16.656 3.022 463 HA ASN 110 HA ASN 110 7.622 -16.819 0.598 464 HB2 ASN 110 2HB ASN 110 5.858 -14.474 1.367 465 HB3 ASN 110 1HB ASN 110 6.931 -14.552 -0.032 466 HD21 ASN 110 1HD2 ASN 110 3.728 -14.869 0.773 467 HD22 ASN 110 2HD2 ASN 110 3.232 -15.945 -0.441 468 HA PRO 111 HA PRO 111 9.787 -15.396 4.566 469 HB2 PRO 111 2HB PRO 111 11.940 -16.921 3.194 470 HB3 PRO 111 1HB PRO 111 11.457 -16.939 4.899 471 HG2 PRO 111 2HG PRO 111 10.872 -18.948 3.232 472 HG3 PRO 111 1HG PRO 111 9.792 -18.464 4.549 473 HD2 PRO 111 2HD PRO 111 9.498 -18.013 1.619 474 HD3 PRO 111 1HD PRO 111 8.252 -18.193 2.868 475 H LYS 112 H LYS 112 10.459 -15.241 1.136 476 HA LYS 112 HA LYS 112 12.588 -13.238 1.489 477 HB2 LYS 112 2HB LYS 112 11.241 -14.329 -1.000 478 HB3 LYS 112 1HB LYS 112 12.603 -13.209 -1.004 479 HG2 LYS 112 2HG LYS 112 13.924 -14.878 0.305 480 HG3 LYS 112 1HG LYS 112 12.578 -16.008 0.160 481 HD2 LYS 112 2HD LYS 112 12.748 -15.835 -2.325 482 HD3 LYS 112 1HD LYS 112 14.167 -14.804 -2.126 483 HE2 LYS 112 2HE LYS 112 15.506 -16.542 -1.422 484 HE3 LYS 112 1HE LYS 112 14.164 -17.418 -0.689 485 HZ1 LYS 112 1HZ LYS 112 13.539 -17.366 -3.334 486 HZ2 LYS 112 2HZ LYS 112 14.222 -18.680 -2.502 487 HZ3 LYS 112 3HZ LYS 112 15.219 -17.593 -3.346 488 H CYS 113 H CYS 113 9.346 -13.110 1.812 489 HA CYS 113 HA CYS 113 9.081 -10.459 0.463 490 HB2 CYS 113 2HB CYS 113 7.107 -12.570 1.299 491 HB3 CYS 113 1HB CYS 113 6.576 -10.908 1.060 492 H SER 114 H SER 114 10.500 -9.830 2.501 493 HA SER 114 HA SER 114 9.042 -8.172 4.188 494 HB2 SER 114 2HB SER 114 7.861 -9.647 5.451 495 HB3 SER 114 1HB SER 114 8.905 -10.997 5.017 496 HG SER 114 HG SER 114 9.985 -8.993 6.623 497 H TYR 115 H TYR 115 11.753 -10.435 4.046 498 HA TYR 115 HA TYR 115 13.337 -9.198 6.087 499 HB2 TYR 115 2HB TYR 115 14.062 -10.881 3.683 500 HB3 TYR 115 1HB TYR 115 15.267 -10.309 4.840 501 HD1 TYR 115 1HD TYR 115 11.876 -11.935 4.870 502 HD2 TYR 115 2HD TYR 115 15.794 -11.718 6.613 503 HE1 TYR 115 1HE TYR 115 11.291 -13.787 6.400 504 HE2 TYR 115 2HE TYR 115 15.210 -13.576 8.148 505 HH TYR 115 HH TYR 115 13.698 -15.147 8.640 506 H ILE 116 H ILE 116 12.957 -8.543 2.639 507 HA ILE 116 HA ILE 116 15.130 -6.666 2.457 508 HB ILE 116 HB ILE 116 12.583 -6.828 0.807 509 HG12 ILE 116 2HG1 ILE 116 14.172 -8.049 -0.792 510 HG13 ILE 116 1HG1 ILE 116 15.283 -8.183 0.567 511 HG21 ILE 116 1HG2 ILE 116 15.278 -5.692 0.031 512 HG22 ILE 116 2HG2 ILE 116 13.954 -4.699 0.643 513 HG23 ILE 116 3HG2 ILE 116 13.765 -5.585 -0.867 514 HD11 ILE 116 1HD1 ILE 116 13.969 -9.720 1.668 515 HD12 ILE 116 2HD1 ILE 116 13.465 -10.082 0.018 516 HD13 ILE 116 3HD1 ILE 116 12.465 -9.051 1.036 517 HA PRO 117 HA PRO 117 13.773 -3.190 4.913 518 HB2 PRO 117 2HB PRO 117 14.134 -1.773 2.285 519 HB3 PRO 117 1HB PRO 117 14.616 -1.256 3.915 520 HG2 PRO 117 2HG PRO 117 16.343 -2.377 2.175 521 HG3 PRO 117 1HG PRO 117 16.480 -2.571 3.930 522 HD2 PRO 117 2HD PRO 117 15.825 -4.589 1.924 523 HD3 PRO 117 1HD PRO 117 16.192 -4.816 3.646 524 HA PRO 118 HA PRO 118 9.555 -3.284 3.087 525 HB2 PRO 118 2HB PRO 118 8.249 -4.187 5.270 526 HB3 PRO 118 1HB PRO 118 9.174 -5.278 4.220 527 HG2 PRO 118 2HG PRO 118 9.824 -4.250 6.907 528 HG3 PRO 118 1HG PRO 118 10.307 -5.761 6.123 529 HD2 PRO 118 2HD PRO 118 11.862 -3.377 6.364 530 HD3 PRO 118 1HD PRO 118 12.281 -4.841 5.453 531 H CYS 119 H CYS 119 7.860 -1.739 3.337 532 HA CYS 119 HA CYS 119 8.419 0.386 5.345 533 HB2 CYS 119 2HB CYS 119 6.337 0.769 3.251 534 HB3 CYS 119 1HB CYS 119 7.540 1.906 3.859 535 H LYS 120 H LYS 120 7.284 0.023 7.206 536 HA LYS 120 HA LYS 120 4.372 -0.564 6.935 537 HB2 LYS 120 2HB LYS 120 4.481 -2.173 8.761 538 HB3 LYS 120 1HB LYS 120 5.620 -2.660 7.505 539 HG2 LYS 120 2HG LYS 120 7.438 -1.489 8.776 540 HG3 LYS 120 1HG LYS 120 6.280 -1.187 10.071 541 HD2 LYS 120 2HD LYS 120 5.870 -3.691 10.145 542 HD3 LYS 120 1HD LYS 120 7.251 -3.870 9.064 543 HE2 LYS 120 2HE LYS 120 8.432 -3.995 11.013 544 HE3 LYS 120 1HE LYS 120 8.322 -2.236 10.955 545 HZ1 LYS 120 1HZ LYS 120 7.091 -4.075 12.765 546 HZ2 LYS 120 2HZ LYS 120 5.962 -3.014 12.069 547 HZ3 LYS 120 3HZ LYS 120 7.306 -2.399 12.907 548 H ARG 121 H ARG 121 3.098 0.617 8.348 549 HA ARG 121 HA ARG 121 4.244 2.866 9.709 550 HB2 ARG 121 2HB ARG 121 1.507 1.584 9.946 551 HB3 ARG 121 1HB ARG 121 1.946 3.138 10.648 552 HG2 ARG 121 2HG ARG 121 2.566 3.948 8.365 553 HG3 ARG 121 1HG ARG 121 1.967 2.426 7.706 554 HD2 ARG 121 2HD ARG 121 0.361 4.480 9.249 555 HD3 ARG 121 1HD ARG 121 0.205 4.094 7.535 556 HE ARG 121 HE ARG 121 -0.282 1.671 8.660 557 HH11 ARG 121 1HH1 ARG 121 -2.259 0.978 9.506 558 HH12 ARG 121 2HH1 ARG 121 -3.384 2.148 10.110 559 HH21 ARG 121 1HH2 ARG 121 -1.353 4.865 9.396 560 HH22 ARG 121 2HH2 ARG 121 -2.872 4.347 10.048 561 H GLU 122 H GLU 122 3.373 -0.377 10.702 562 HA GLU 122 HA GLU 122 4.140 -1.567 12.597 563 HB2 GLU 122 2HB GLU 122 5.981 0.277 12.703 564 HB3 GLU 122 1HB GLU 122 4.952 1.003 13.944 565 HG2 GLU 122 2HG GLU 122 4.959 -1.130 15.191 566 HG3 GLU 122 1HG GLU 122 6.044 -1.817 13.983 567 H ASN 123 H ASN 123 1.517 -0.479 12.147 568 HA ASN 123 HA ASN 123 0.401 0.757 14.461 569 HB2 ASN 123 2HB ASN 123 -1.761 -0.104 13.617 570 HB3 ASN 123 1HB ASN 123 -0.803 0.608 12.318 571 HD21 ASN 123 1HD2 ASN 123 -0.894 -0.670 10.475 572 HD22 ASN 123 2HD2 ASN 123 -0.934 -2.366 10.463 573 H GLN 124 H GLN 124 1.054 -2.623 13.682 574 HA GLN 124 HA GLN 124 0.976 -4.548 15.012 575 HB2 GLN 124 2HB GLN 124 1.153 -2.510 17.255 576 HB3 GLN 124 1HB GLN 124 1.438 -4.240 17.419 577 HG2 GLN 124 2HG GLN 124 3.264 -4.061 15.725 578 HG3 GLN 124 1HG GLN 124 3.027 -2.314 15.702 579 HE21 GLN 124 1HE2 GLN 124 2.333 -3.169 18.822 580 HE22 GLN 124 2HE2 GLN 124 3.868 -2.985 19.521 581 H LYS 125 H LYS 125 -1.495 -3.865 14.093 582 HA LYS 125 HA LYS 125 -3.417 -3.578 16.264 583 HB2 LYS 125 2HB LYS 125 -3.759 -4.334 13.349 584 HB3 LYS 125 1HB LYS 125 -5.097 -4.073 14.467 585 HG2 LYS 125 2HG LYS 125 -4.230 -1.771 14.903 586 HG3 LYS 125 1HG LYS 125 -2.995 -2.039 13.672 587 HD2 LYS 125 2HD LYS 125 -4.801 -2.490 12.010 588 HD3 LYS 125 1HD LYS 125 -5.996 -2.090 13.245 589 HE2 LYS 125 2HE LYS 125 -5.731 0.111 12.859 590 HE3 LYS 125 1HE LYS 125 -3.991 -0.017 13.116 591 HZ1 LYS 125 1HZ LYS 125 -3.837 0.430 10.953 592 HZ2 LYS 125 2HZ LYS 125 -5.478 0.100 10.661 593 HZ3 LYS 125 3HZ LYS 125 -4.344 -1.166 10.693 594 H ASN 126 H ASN 126 -5.079 -5.276 16.707 595 HA ASN 126 HA ASN 126 -3.901 -7.760 17.428 596 HB2 ASN 126 2HB ASN 126 -6.825 -7.077 16.987 597 HB3 ASN 126 1HB ASN 126 -6.239 -8.520 17.815 598 HD21 ASN 126 1HD2 ASN 126 -7.869 -6.569 19.159 599 HD22 ASN 126 2HD2 ASN 126 -6.924 -5.825 20.356 600 H LEU 127 H LEU 127 -3.992 -9.818 16.449 601 HA LEU 127 HA LEU 127 -3.850 -9.919 13.611 602 HB2 LEU 127 2HB LEU 127 -4.355 -12.122 15.630 603 HB3 LEU 127 1HB LEU 127 -4.020 -12.406 13.923 604 HG LEU 127 HG LEU 127 -1.884 -11.088 14.207 605 HD11 LEU 127 1HD1 LEU 127 -1.171 -11.160 16.753 606 HD12 LEU 127 2HD1 LEU 127 -2.911 -11.083 17.028 607 HD13 LEU 127 3HD1 LEU 127 -2.102 -9.798 16.131 608 HD21 LEU 127 1HD2 LEU 127 -0.712 -12.947 15.397 609 HD22 LEU 127 2HD2 LEU 127 -1.853 -13.531 14.185 610 HD23 LEU 127 3HD2 LEU 127 -2.281 -13.578 15.896 611 H GLU 128 H GLU 128 -6.528 -10.627 15.830 612 HA GLU 128 HA GLU 128 -8.312 -11.656 13.847 613 HB2 GLU 128 2HB GLU 128 -8.892 -10.211 16.450 614 HB3 GLU 128 1HB GLU 128 -10.105 -11.055 15.488 615 HG2 GLU 128 2HG GLU 128 -7.612 -12.335 16.646 616 HG3 GLU 128 1HG GLU 128 -9.231 -12.476 17.330 617 H SER 129 H SER 129 -7.653 -8.366 14.990 618 HA SER 129 HA SER 129 -9.759 -7.057 13.581 619 HB2 SER 129 2HB SER 129 -6.996 -5.973 14.195 620 HB3 SER 129 1HB SER 129 -8.439 -5.023 13.853 621 HG SER 129 HG SER 129 -9.368 -6.134 15.723 622 H VAL 130 H VAL 130 -6.544 -8.113 12.585 623 HA VAL 130 HA VAL 130 -6.452 -6.746 10.083 624 HB VAL 130 HB VAL 130 -5.234 -9.410 10.861 625 HG11 VAL 130 1HG1 VAL 130 -3.573 -8.379 9.004 626 HG12 VAL 130 2HG1 VAL 130 -5.097 -7.699 8.429 627 HG13 VAL 130 3HG1 VAL 130 -4.913 -9.446 8.588 628 HG21 VAL 130 1HG2 VAL 130 -3.957 -8.120 12.208 629 HG22 VAL 130 2HG2 VAL 130 -4.643 -6.637 11.546 630 HG23 VAL 130 3HG2 VAL 130 -3.277 -7.415 10.743 631 H MET 131 H MET 131 -7.764 -9.942 10.974 632 HA MET 131 HA MET 131 -8.394 -10.846 8.371 633 HB2 MET 131 2HB MET 131 -8.983 -11.650 11.026 634 HB3 MET 131 1HB MET 131 -10.526 -11.537 10.178 635 HG2 MET 131 2HG MET 131 -8.090 -13.099 9.269 636 HG3 MET 131 1HG MET 131 -9.601 -13.778 9.878 637 HE1 MET 131 1HE MET 131 -11.781 -11.601 8.264 638 HE2 MET 131 2HE MET 131 -11.780 -13.168 9.068 639 HE3 MET 131 3HE MET 131 -12.233 -13.057 7.369 640 H ASN 132 H ASN 132 -10.229 -8.742 10.563 641 HA ASN 132 HA ASN 132 -12.561 -8.495 8.946 642 HB2 ASN 132 2HB ASN 132 -12.311 -7.661 11.317 643 HB3 ASN 132 1HB ASN 132 -11.346 -6.326 10.683 644 HD21 ASN 132 1HD2 ASN 132 -14.587 -7.852 10.309 645 HD22 ASN 132 2HD2 ASN 132 -15.380 -6.412 9.887 646 H TRP 133 H TRP 133 -9.472 -6.747 8.903 647 HA TRP 133 HA TRP 133 -10.180 -4.762 6.988 648 HB2 TRP 133 2HB TRP 133 -8.091 -4.235 7.731 649 HB3 TRP 133 1HB TRP 133 -7.683 -5.921 8.056 650 HD1 TRP 133 HD TRP 133 -6.785 -7.395 6.002 651 HE1 TRP 133 1HE TRP 133 -5.655 -6.719 3.787 652 HE3 TRP 133 3HE TRP 133 -7.939 -2.423 5.907 653 HZ2 TRP 133 2HZ TRP 133 -5.287 -4.377 2.187 654 HZ3 TRP 133 3HZ TRP 133 -7.181 -0.995 4.031 655 HH2 TRP 133 HH TRP 133 -5.861 -1.964 2.171 656 H GLN 134 H GLN 134 -8.696 -7.968 6.528 657 HA GLN 134 HA GLN 134 -8.606 -7.855 3.674 658 HB2 GLN 134 2HB GLN 134 -7.397 -9.519 5.128 659 HB3 GLN 134 1HB GLN 134 -8.942 -10.325 5.401 660 HG2 GLN 134 2HG GLN 134 -9.031 -10.238 2.732 661 HG3 GLN 134 1HG GLN 134 -7.279 -10.204 2.926 662 HE21 GLN 134 1HE2 GLN 134 -10.117 -12.010 4.236 663 HE22 GLN 134 2HE2 GLN 134 -9.322 -13.510 4.287 664 H GLN 135 H GLN 135 -11.069 -9.090 5.923 665 HA GLN 135 HA GLN 135 -12.838 -10.151 3.963 666 HB2 GLN 135 2HB GLN 135 -12.966 -10.485 6.474 667 HB3 GLN 135 1HB GLN 135 -13.659 -8.867 6.577 668 HG2 GLN 135 2HG GLN 135 -15.486 -9.546 5.064 669 HG3 GLN 135 1HG GLN 135 -14.794 -11.166 4.959 670 HE21 GLN 135 1HE2 GLN 135 -17.359 -11.083 5.935 671 HE22 GLN 135 2HE2 GLN 135 -17.382 -11.324 7.615 672 H TYR 136 H TYR 136 -12.505 -6.885 5.297 673 HA TYR 136 HA TYR 136 -14.840 -5.781 4.066 674 HB2 TYR 136 2HB TYR 136 -13.669 -4.601 5.852 675 HB3 TYR 136 1HB TYR 136 -12.228 -4.456 4.844 676 HD1 TYR 136 1HD TYR 136 -12.218 -3.006 2.850 677 HD2 TYR 136 2HD TYR 136 -15.614 -3.202 5.476 678 HE1 TYR 136 1HE TYR 136 -13.118 -0.928 1.841 679 HE2 TYR 136 2HE TYR 136 -16.514 -1.123 4.466 680 HH TYR 136 HH TYR 136 -14.856 1.004 2.854 681 H TRP 137 H TRP 137 -11.413 -5.646 2.993 682 HA TRP 137 HA TRP 137 -12.160 -4.447 0.467 683 HB2 TRP 137 2HB TRP 137 -9.589 -5.662 1.486 684 HB3 TRP 137 1HB TRP 137 -9.743 -4.965 -0.121 685 HD1 TRP 137 HD TRP 137 -8.675 -4.022 3.174 686 HE1 TRP 137 1HE TRP 137 -8.796 -1.477 3.553 687 HE3 TRP 137 3HE TRP 137 -11.583 -2.670 -0.794 688 HZ2 TRP 137 2HZ TRP 137 -9.963 0.828 2.334 689 HZ3 TRP 137 3HZ TRP 137 -12.184 -0.297 -1.164 690 HH2 TRP 137 HH TRP 137 -11.377 1.454 0.393 691 H LYS 138 H LYS 138 -11.254 -7.735 1.480 692 HA LYS 138 HA LYS 138 -11.217 -8.901 -1.106 693 HB2 LYS 138 2HB LYS 138 -10.460 -10.050 0.971 694 HB3 LYS 138 1HB LYS 138 -12.144 -10.199 1.471 695 HG2 LYS 138 2HG LYS 138 -12.625 -11.468 -0.614 696 HG3 LYS 138 1HG LYS 138 -10.915 -11.376 -1.039 697 HD2 LYS 138 2HD LYS 138 -10.367 -12.527 1.116 698 HD3 LYS 138 1HD LYS 138 -12.095 -12.725 1.405 699 HE2 LYS 138 2HE LYS 138 -11.801 -14.704 0.314 700 HE3 LYS 138 1HE LYS 138 -11.901 -13.698 -1.132 701 HZ1 LYS 138 1HZ LYS 138 -9.948 -14.936 -1.369 702 HZ2 LYS 138 2HZ LYS 138 -9.478 -14.691 0.245 703 HZ3 LYS 138 3HZ LYS 138 -9.418 -13.406 -0.864 704 H ASP 139 H ASP 139 -13.893 -8.285 1.115 705 HA ASP 139 HA ASP 139 -15.896 -9.670 -0.394 706 HB2 ASP 139 2HB ASP 139 -16.111 -8.935 2.001 707 HB3 ASP 139 1HB ASP 139 -16.305 -7.281 1.419 708 H GLU 140 H GLU 140 -14.595 -6.385 -0.631 709 HA GLU 140 HA GLU 140 -16.619 -5.779 -2.718 710 HB2 GLU 140 2HB GLU 140 -14.673 -3.942 -1.303 711 HB3 GLU 140 1HB GLU 140 -15.923 -3.441 -2.441 712 HG2 GLU 140 2HG GLU 140 -16.438 -4.891 0.173 713 HG3 GLU 140 1HG GLU 140 -16.649 -3.158 -0.080 714 H ILE 141 H ILE 141 -13.242 -4.704 -2.341 715 HA ILE 141 HA ILE 141 -12.905 -4.729 -5.209 716 HB ILE 141 HB ILE 141 -10.669 -3.917 -4.801 717 HG12 ILE 141 2HG1 ILE 141 -11.139 -4.623 -1.886 718 HG13 ILE 141 1HG1 ILE 141 -10.095 -5.531 -2.978 719 HG21 ILE 141 1HG2 ILE 141 -12.458 -2.302 -4.457 720 HG22 ILE 141 2HG2 ILE 141 -11.193 -2.018 -3.261 721 HG23 ILE 141 3HG2 ILE 141 -12.676 -2.850 -2.794 722 HD11 ILE 141 1HD1 ILE 141 -9.471 -3.160 -1.490 723 HD12 ILE 141 2HD1 ILE 141 -9.363 -2.794 -3.211 724 HD13 ILE 141 3HD1 ILE 141 -8.414 -4.113 -2.527 725 H GLY 142 H GLY 142 -12.501 -7.156 -2.823 726 HA2 GLY 142 2HA GLY 142 -11.897 -9.424 -3.193 727 HA3 GLY 142 1HA GLY 142 -11.546 -9.011 -4.871 728 H SER 143 H SER 143 -9.545 -7.571 -5.142 729 HA SER 143 HA SER 143 -7.500 -7.344 -3.218 730 HB2 SER 143 2HB SER 143 -7.638 -10.006 -4.591 731 HB3 SER 143 1HB SER 143 -6.055 -9.307 -4.267 732 HG SER 143 HG SER 143 -6.349 -9.604 -2.193 733 H GLN 144 H GLN 144 -8.301 -5.687 -5.194 734 HA GLN 144 HA GLN 144 -6.120 -5.860 -7.226 735 HB2 GLN 144 2HB GLN 144 -8.178 -4.150 -8.160 736 HB3 GLN 144 1HB GLN 144 -7.695 -5.718 -8.809 737 HG2 GLN 144 2HG GLN 144 -9.176 -6.840 -7.168 738 HG3 GLN 144 1HG GLN 144 -9.682 -5.264 -6.563 739 HE21 GLN 144 1HE2 GLN 144 -9.592 -4.095 -9.362 740 HE22 GLN 144 2HE2 GLN 144 -10.988 -4.686 -10.125 741 HA PRO 145 HA PRO 145 -4.949 -2.121 -4.837 742 HB2 PRO 145 2HB PRO 145 -2.949 -1.957 -7.033 743 HB3 PRO 145 1HB PRO 145 -2.705 -1.903 -5.279 744 HG2 PRO 145 2HG PRO 145 -2.083 -4.050 -6.772 745 HG3 PRO 145 1HG PRO 145 -2.606 -4.165 -5.086 746 HD2 PRO 145 2HD PRO 145 -4.086 -4.868 -7.558 747 HD3 PRO 145 1HD PRO 145 -4.288 -5.487 -5.907 748 H PHE 146 H PHE 146 -5.155 0.172 -5.347 749 HA PHE 146 HA PHE 146 -6.008 0.799 -8.113 750 HB2 PHE 146 2HB PHE 146 -7.786 2.278 -7.203 751 HB3 PHE 146 1HB PHE 146 -8.064 0.579 -6.840 752 HD1 PHE 146 1HD PHE 146 -8.098 3.805 -5.531 753 HD2 PHE 146 2HD PHE 146 -6.923 -0.198 -4.493 754 HE1 PHE 146 1HE PHE 146 -8.268 4.378 -3.130 755 HE2 PHE 146 2HE PHE 146 -7.080 0.386 -2.091 756 HZ PHE 146 HZ PHE 146 -7.755 2.671 -1.407 757 H THR 147 H THR 147 -5.728 3.044 -8.716 758 HA THR 147 HA THR 147 -3.759 4.465 -6.971 759 HB THR 147 HB THR 147 -2.637 5.251 -8.960 760 HG1 THR 147 1HG THR 147 -4.512 5.389 -10.267 761 HG21 THR 147 1HG2 THR 147 -2.053 2.987 -10.024 762 HG22 THR 147 2HG2 THR 147 -3.206 2.291 -8.887 763 HG23 THR 147 3HG2 THR 147 -1.785 3.150 -8.289 764 H CYS 148 H CYS 148 -3.819 6.775 -7.119 765 HA CYS 148 HA CYS 148 -6.280 7.923 -8.293 766 HB2 CYS 148 2HB CYS 148 -6.108 9.348 -5.979 767 HB3 CYS 148 1HB CYS 148 -7.138 7.931 -6.168 768 H TYR 149 H TYR 149 -6.116 10.329 -8.446 769 HA TYR 149 HA TYR 149 -3.379 11.443 -8.178 770 HB2 TYR 149 2HB TYR 149 -4.861 11.437 -10.832 771 HB3 TYR 149 1HB TYR 149 -3.353 12.278 -10.499 772 HD1 TYR 149 1HD TYR 149 -4.903 9.075 -11.262 773 HD2 TYR 149 2HD TYR 149 -1.298 10.985 -9.923 774 HE1 TYR 149 1HE TYR 149 -3.622 7.012 -11.770 775 HE2 TYR 149 2HE TYR 149 -0.017 8.921 -10.429 776 HH TYR 149 HH TYR 149 -0.471 6.484 -10.655 777 H PHE 150 H PHE 150 -3.530 13.587 -7.546 778 HA PHE 150 HA PHE 150 -6.084 14.980 -8.110 779 HB2 PHE 150 2HB PHE 150 -6.760 15.045 -5.955 780 HB3 PHE 150 1HB PHE 150 -5.542 13.814 -5.639 781 HD1 PHE 150 1HD PHE 150 -6.358 17.384 -5.438 782 HD2 PHE 150 2HD PHE 150 -3.362 14.401 -4.700 783 HE1 PHE 150 1HE PHE 150 -5.125 18.995 -4.012 784 HE2 PHE 150 2HE PHE 150 -2.111 16.000 -3.284 785 HZ PHE 150 HZ PHE 150 -2.992 18.299 -2.931 786 H ASN 151 H ASN 151 -5.913 17.251 -8.187 787 HA ASN 151 HA ASN 151 -3.233 18.408 -7.651 788 HB2 ASN 151 2HB ASN 151 -3.029 19.362 -9.859 789 HB3 ASN 151 1HB ASN 151 -3.301 17.631 -10.039 790 HD21 ASN 151 1HD2 ASN 151 -3.959 19.583 -12.096 791 HD22 ASN 151 2HD2 ASN 151 -5.644 19.558 -12.302 792 H GLN 152 H GLN 152 -3.437 20.312 -6.671 793 HA GLN 152 HA GLN 152 -6.056 21.680 -6.589 794 HB2 GLN 152 2HB GLN 152 -4.822 21.315 -4.473 795 HB3 GLN 152 1HB GLN 152 -3.456 22.229 -5.112 796 HG2 GLN 152 2HG GLN 152 -4.750 24.257 -5.193 797 HG3 GLN 152 1HG GLN 152 -6.241 23.389 -4.833 798 HE21 GLN 152 1HE2 GLN 152 -5.670 25.442 -3.105 799 HE22 GLN 152 2HE2 GLN 152 -5.090 24.850 -1.623 800 H HIS 153 H HIS 153 -3.317 21.702 -8.480 801 HA HIS 153 HA HIS 153 -2.556 24.342 -8.867 802 HB2 HIS 153 2HB HIS 153 -2.982 22.147 -10.905 803 HB3 HIS 153 1HB HIS 153 -2.188 23.676 -11.275 804 HD1 HIS 153 1HD HIS 153 0.260 23.822 -10.761 805 HD2 HIS 153 2HD HIS 153 -1.568 20.677 -8.714 806 HE1 HIS 153 1HE HIS 153 2.113 22.559 -9.579 807 HE2 HIS 153 2HE HIS 153 1.012 20.643 -8.334 808 H GLN 154 H GLN 154 -5.538 22.781 -9.993 809 HA GLN 154 HA GLN 154 -6.359 25.003 -11.646 810 HB2 GLN 154 2HB GLN 154 -7.969 22.818 -10.289 811 HB3 GLN 154 1HB GLN 154 -8.620 23.950 -11.471 812 HG2 GLN 154 2HG GLN 154 -6.993 23.153 -13.144 813 HG3 GLN 154 1HG GLN 154 -6.337 22.018 -11.962 814 HE21 GLN 154 1HE2 GLN 154 -7.333 20.868 -14.260 815 HE22 GLN 154 2HE2 GLN 154 -8.829 20.122 -13.960 816 H ARG 155 H ARG 155 -7.785 23.904 -8.558 817 HA ARG 155 HA ARG 155 -7.498 26.475 -7.313 818 HB2 ARG 155 2HB ARG 155 -9.734 26.226 -9.066 819 HB3 ARG 155 1HB ARG 155 -10.346 26.264 -7.410 820 HG2 ARG 155 2HG ARG 155 -8.393 28.256 -8.598 821 HG3 ARG 155 1HG ARG 155 -10.115 28.545 -8.347 822 HD2 ARG 155 2HD ARG 155 -9.741 29.100 -6.200 823 HD3 ARG 155 1HD ARG 155 -8.963 27.545 -5.908 824 HE ARG 155 HE ARG 155 -7.155 29.313 -7.279 825 HH11 ARG 155 1HH1 ARG 155 -5.479 30.224 -6.064 826 HH12 ARG 155 2HH1 ARG 155 -5.593 30.247 -4.337 827 HH21 ARG 155 1HH2 ARG 155 -8.684 28.677 -4.255 828 HH22 ARG 155 2HH2 ARG 155 -7.408 29.372 -3.313 829 HA PRO 156 HA PRO 156 -9.755 23.544 -4.403 830 HB2 PRO 156 2HB PRO 156 -11.436 21.660 -5.266 831 HB3 PRO 156 1HB PRO 156 -11.864 23.376 -5.393 832 HG2 PRO 156 2HG PRO 156 -11.027 21.487 -7.506 833 HG3 PRO 156 1HG PRO 156 -12.081 22.905 -7.608 834 HD2 PRO 156 2HD PRO 156 -9.280 22.756 -8.261 835 HD3 PRO 156 1HD PRO 156 -10.335 24.182 -8.307 836 H ASP 157 H ASP 157 -10.246 20.648 -6.161 837 HA ASP 157 HA ASP 157 -7.587 19.548 -5.974 838 HB2 ASP 157 2HB ASP 157 -8.050 17.986 -4.082 839 HB3 ASP 157 1HB ASP 157 -8.032 19.673 -3.572 840 H ASP 158 H ASP 158 -8.482 19.005 -8.168 841 HA ASP 158 HA ASP 158 -10.746 17.285 -8.513 842 HB2 ASP 158 2HB ASP 158 -8.197 17.533 -10.149 843 HB3 ASP 158 1HB ASP 158 -9.613 16.615 -10.662 844 H VAL 159 H VAL 159 -10.820 14.936 -8.585 845 HA VAL 159 HA VAL 159 -8.369 13.604 -7.494 846 HB VAL 159 HB VAL 159 -11.209 13.019 -6.629 847 HG11 VAL 159 1HG1 VAL 159 -9.223 12.113 -4.806 848 HG12 VAL 159 2HG1 VAL 159 -8.731 11.587 -6.416 849 HG13 VAL 159 3HG1 VAL 159 -10.316 11.135 -5.787 850 HG21 VAL 159 1HG2 VAL 159 -10.878 14.991 -5.494 851 HG22 VAL 159 2HG2 VAL 159 -9.122 14.890 -5.625 852 HG23 VAL 159 3HG2 VAL 159 -9.970 13.935 -4.409 853 H LEU 160 H LEU 160 -7.996 11.507 -8.175 854 HA LEU 160 HA LEU 160 -9.834 10.422 -10.274 855 HB2 LEU 160 2HB LEU 160 -6.859 10.701 -10.195 856 HB3 LEU 160 1HB LEU 160 -7.539 9.305 -11.023 857 HG LEU 160 HG LEU 160 -8.981 10.865 -12.355 858 HD11 LEU 160 1HD1 LEU 160 -9.222 12.854 -11.205 859 HD12 LEU 160 2HD1 LEU 160 -7.898 13.304 -12.277 860 HD13 LEU 160 3HD1 LEU 160 -7.562 12.836 -10.612 861 HD21 LEU 160 1HD2 LEU 160 -7.341 10.881 -13.910 862 HD22 LEU 160 2HD2 LEU 160 -6.262 10.278 -12.654 863 HD23 LEU 160 3HD2 LEU 160 -6.370 12.010 -12.966 864 H LEU 161 H LEU 161 -10.114 8.110 -10.208 865 HA LEU 161 HA LEU 161 -8.793 6.704 -7.944 866 HB2 LEU 161 2HB LEU 161 -11.030 7.614 -7.206 867 HB3 LEU 161 1HB LEU 161 -11.779 6.571 -8.415 868 HG LEU 161 HG LEU 161 -10.200 4.754 -7.206 869 HD11 LEU 161 1HD1 LEU 161 -10.907 6.788 -5.071 870 HD12 LEU 161 2HD1 LEU 161 -9.282 6.341 -5.588 871 HD13 LEU 161 3HD1 LEU 161 -10.297 5.165 -4.752 872 HD21 LEU 161 1HD2 LEU 161 -12.208 4.139 -5.867 873 HD22 LEU 161 2HD2 LEU 161 -12.610 4.540 -7.537 874 HD23 LEU 161 3HD2 LEU 161 -12.916 5.709 -6.252 875 H HIS 162 H HIS 162 -7.815 5.994 -10.229 876 HA HIS 162 HA HIS 162 -9.422 4.102 -11.749 877 HB2 HIS 162 2HB HIS 162 -6.425 4.576 -11.652 878 HB3 HIS 162 1HB HIS 162 -7.223 3.496 -12.794 879 HD1 HIS 162 1HD HIS 162 -5.704 5.916 -13.899 880 HD2 HIS 162 2HD HIS 162 -9.761 6.022 -12.934 881 HE1 HIS 162 1HE HIS 162 -6.710 7.822 -15.232 882 HE2 HIS 162 2HE HIS 162 -9.179 7.895 -14.652 883 H ARG 163 H ARG 163 -9.353 1.810 -11.596 884 HA ARG 163 HA ARG 163 -8.050 0.772 -9.108 885 HB2 ARG 163 2HB ARG 163 -10.594 -0.131 -10.479 886 HB3 ARG 163 1HB ARG 163 -9.865 -0.935 -9.089 887 HG2 ARG 163 2HG ARG 163 -10.032 1.213 -7.817 888 HG3 ARG 163 1HG ARG 163 -10.891 1.915 -9.188 889 HD2 ARG 163 2HD ARG 163 -11.777 -0.486 -7.564 890 HD3 ARG 163 1HD ARG 163 -12.506 1.119 -7.533 891 HE ARG 163 HE ARG 163 -12.682 0.427 -10.187 892 HH11 ARG 163 1HH1 ARG 163 -14.408 -0.739 -11.066 893 HH12 ARG 163 2HH1 ARG 163 -15.327 -1.799 -10.049 894 HH21 ARG 163 1HH2 ARG 163 -13.470 -1.108 -7.202 895 HH22 ARG 163 2HH2 ARG 163 -14.797 -2.007 -7.862 896 H THR 164 H THR 164 -7.112 -1.334 -9.200 897 HA THR 164 HA THR 164 -6.009 -2.030 -11.823 898 HB THR 164 HB THR 164 -5.687 -3.379 -9.128 899 HG1 THR 164 1HG THR 164 -4.876 -1.093 -9.756 900 HG21 THR 164 1HG2 THR 164 -3.474 -3.957 -10.651 901 HG22 THR 164 2HG2 THR 164 -4.768 -4.016 -11.846 902 HG23 THR 164 3HG2 THR 164 -4.843 -5.041 -10.414 903 H HIS 165 H HIS 165 -6.619 -3.775 -13.079 904 HA HIS 165 HA HIS 165 -8.910 -5.412 -12.055 905 HB2 HIS 165 2HB HIS 165 -8.222 -4.653 -14.910 906 HB3 HIS 165 1HB HIS 165 -9.588 -5.655 -14.419 907 HD1 HIS 165 1HD HIS 165 -11.271 -4.399 -12.621 908 HD2 HIS 165 2HD HIS 165 -8.831 -1.954 -14.960 909 HE1 HIS 165 1HE HIS 165 -12.282 -2.076 -12.530 910 HE2 HIS 165 2HE HIS 165 -10.805 -0.581 -13.950 911 H ASP 166 H ASP 166 -8.691 -7.631 -12.145 912 HA ASP 166 HA ASP 166 -6.250 -8.923 -12.150 913 HB2 ASP 166 2HB ASP 166 -8.893 -9.975 -13.203 914 HB3 ASP 166 1HB ASP 166 -7.492 -10.990 -12.857 Start of MODEL 8 1 H1 GLN 45 1HT GLN 45 7.496 19.444 -6.105 2 H2 GLN 45 2HT GLN 45 6.562 20.856 -6.229 3 H3 GLN 45 3HT GLN 45 7.208 20.137 -7.625 4 HA GLN 45 HA GLN 45 5.122 19.314 -7.792 5 HB2 GLN 45 2HB GLN 45 6.716 17.411 -7.429 6 HB3 GLN 45 1HB GLN 45 6.283 17.433 -5.718 7 HG2 GLN 45 2HG GLN 45 4.902 15.763 -6.750 8 HG3 GLN 45 1HG GLN 45 3.863 17.155 -6.443 9 HE21 GLN 45 1HE2 GLN 45 2.428 17.160 -8.205 10 HE22 GLN 45 2HE2 GLN 45 2.911 17.125 -9.831 11 H ASP 46 H ASP 46 5.686 18.601 -4.344 12 HA ASP 46 HA ASP 46 3.024 18.860 -3.503 13 HB2 ASP 46 2HB ASP 46 5.601 19.488 -2.043 14 HB3 ASP 46 1HB ASP 46 4.026 19.473 -1.253 15 H LEU 47 H LEU 47 5.460 21.390 -3.933 16 HA LEU 47 HA LEU 47 4.066 23.548 -2.753 17 HB2 LEU 47 2HB LEU 47 5.818 23.630 -5.226 18 HB3 LEU 47 1HB LEU 47 5.434 24.996 -4.178 19 HG LEU 47 HG LEU 47 6.939 22.492 -3.359 20 HD11 LEU 47 1HD1 LEU 47 8.577 23.702 -4.423 21 HD12 LEU 47 2HD1 LEU 47 8.618 24.535 -2.870 22 HD13 LEU 47 3HD1 LEU 47 7.724 25.233 -4.221 23 HD21 LEU 47 1HD2 LEU 47 7.323 24.146 -1.311 24 HD22 LEU 47 2HD2 LEU 47 5.894 23.114 -1.380 25 HD23 LEU 47 3HD2 LEU 47 5.781 24.809 -1.852 26 H GLN 48 H GLN 48 3.718 22.075 -5.949 27 HA GLN 48 HA GLN 48 1.361 23.866 -6.418 28 HB2 GLN 48 2HB GLN 48 1.790 23.419 -8.868 29 HB3 GLN 48 1HB GLN 48 3.043 24.369 -8.071 30 HG2 GLN 48 2HG GLN 48 4.607 22.741 -8.315 31 HG3 GLN 48 1HG GLN 48 3.465 21.455 -7.929 32 HE21 GLN 48 1HE2 GLN 48 1.528 21.683 -9.896 33 HE22 GLN 48 2HE2 GLN 48 2.220 21.492 -11.434 34 H ALA 49 H ALA 49 1.715 21.484 -8.764 35 HA ALA 49 HA ALA 49 -0.714 20.158 -8.096 36 HB1 ALA 49 1HB ALA 49 0.035 19.993 -10.358 37 HB2 ALA 49 2HB ALA 49 0.175 18.363 -9.700 38 HB3 ALA 49 3HB ALA 49 1.611 19.374 -9.866 39 H THR 50 H THR 50 -1.098 18.194 -6.994 40 HA THR 50 HA THR 50 1.264 17.065 -5.560 41 HB THR 50 HB THR 50 -1.533 17.326 -4.451 42 HG1 THR 50 1HG THR 50 0.258 18.736 -3.115 43 HG21 THR 50 1HG2 THR 50 1.062 16.188 -3.478 44 HG22 THR 50 2HG2 THR 50 -0.575 15.565 -3.282 45 HG23 THR 50 3HG2 THR 50 -0.027 16.932 -2.309 46 H GLU 51 H GLU 51 1.245 14.853 -5.170 47 HA GLU 51 HA GLU 51 -0.776 13.309 -6.725 48 HB2 GLU 51 2HB GLU 51 2.111 12.618 -6.140 49 HB3 GLU 51 1HB GLU 51 0.992 11.649 -7.096 50 HG2 GLU 51 2HG GLU 51 0.749 13.558 -8.684 51 HG3 GLU 51 1HG GLU 51 1.954 14.449 -7.754 52 H ALA 52 H ALA 52 -1.756 11.573 -5.666 53 HA ALA 52 HA ALA 52 -0.647 10.675 -3.081 54 HB1 ALA 52 1HB ALA 52 -3.319 12.049 -3.416 55 HB2 ALA 52 2HB ALA 52 -2.070 12.375 -2.213 56 HB3 ALA 52 3HB ALA 52 -3.037 10.903 -2.105 57 H ASN 53 H ASN 53 -0.533 8.524 -3.607 58 HA ASN 53 HA ASN 53 -2.805 7.388 -5.126 59 HB2 ASN 53 2HB ASN 53 -0.006 6.358 -4.720 60 HB3 ASN 53 1HB ASN 53 -1.275 5.430 -5.513 61 HD21 ASN 53 1HD2 ASN 53 -2.552 7.673 -6.870 62 HD22 ASN 53 2HD2 ASN 53 -1.480 8.217 -8.067 63 H CYS 54 H CYS 54 -4.044 5.723 -4.373 64 HA CYS 54 HA CYS 54 -3.451 4.740 -1.613 65 HB2 CYS 54 2HB CYS 54 -6.084 4.763 -1.491 66 HB3 CYS 54 1HB CYS 54 -5.200 6.253 -1.187 67 H THR 55 H THR 55 -2.813 2.637 -2.311 68 HA THR 55 HA THR 55 -4.908 1.227 -3.893 69 HB THR 55 HB THR 55 -3.429 0.764 -5.508 70 HG1 THR 55 1HG THR 55 -1.226 0.022 -4.231 71 HG21 THR 55 1HG2 THR 55 -1.351 1.991 -5.592 72 HG22 THR 55 2HG2 THR 55 -1.345 2.200 -3.844 73 HG23 THR 55 3HG2 THR 55 -2.546 3.031 -4.824 74 H VAL 56 H VAL 56 -5.301 -0.899 -3.502 75 HA VAL 56 HA VAL 56 -4.361 -1.929 -0.887 76 HB VAL 56 HB VAL 56 -6.591 -2.677 -2.793 77 HG11 VAL 56 1HG1 VAL 56 -6.033 -4.835 -2.253 78 HG12 VAL 56 2HG1 VAL 56 -6.943 -4.444 -0.793 79 HG13 VAL 56 3HG1 VAL 56 -5.180 -4.358 -0.784 80 HG21 VAL 56 1HG2 VAL 56 -6.416 -1.110 -0.440 81 HG22 VAL 56 2HG2 VAL 56 -7.248 -2.598 0.013 82 HG23 VAL 56 3HG2 VAL 56 -7.878 -1.599 -1.295 83 H LEU 57 H LEU 57 -2.413 -2.954 -1.155 84 HA LEU 57 HA LEU 57 -1.309 -3.900 -3.522 85 HB2 LEU 57 2HB LEU 57 -0.209 -3.754 -1.230 86 HB3 LEU 57 1HB LEU 57 -0.954 -5.312 -0.876 87 HG LEU 57 HG LEU 57 0.139 -6.242 -2.932 88 HD11 LEU 57 1HD1 LEU 57 2.249 -4.517 -3.379 89 HD12 LEU 57 2HD1 LEU 57 0.889 -3.412 -3.186 90 HD13 LEU 57 3HD1 LEU 57 0.833 -4.674 -4.416 91 HD21 LEU 57 1HD2 LEU 57 1.694 -6.923 -1.457 92 HD22 LEU 57 2HD2 LEU 57 1.320 -5.548 -0.418 93 HD23 LEU 57 3HD2 LEU 57 2.554 -5.398 -1.670 94 H SER 58 H SER 58 -1.144 -6.054 -4.427 95 HA SER 58 HA SER 58 -3.670 -7.561 -4.129 96 HB2 SER 58 2HB SER 58 -3.090 -8.613 -6.221 97 HB3 SER 58 1HB SER 58 -2.770 -6.890 -6.407 98 HG SER 58 HG SER 58 -0.713 -7.310 -6.579 99 H VAL 59 H VAL 59 -3.511 -9.950 -3.855 100 HA VAL 59 HA VAL 59 -1.189 -10.599 -2.124 101 HB VAL 59 HB VAL 59 -3.655 -12.293 -2.582 102 HG11 VAL 59 1HG1 VAL 59 -1.521 -13.151 -1.406 103 HG12 VAL 59 2HG1 VAL 59 -3.048 -13.345 -0.546 104 HG13 VAL 59 3HG1 VAL 59 -1.947 -12.041 -0.105 105 HG21 VAL 59 1HG2 VAL 59 -4.651 -11.171 -0.636 106 HG22 VAL 59 2HG2 VAL 59 -4.310 -9.983 -1.895 107 HG23 VAL 59 3HG2 VAL 59 -3.242 -10.120 -0.498 108 H GLN 60 H GLN 60 0.471 -11.705 -3.015 109 HA GLN 60 HA GLN 60 -0.110 -13.764 -5.070 110 HB2 GLN 60 2HB GLN 60 1.933 -11.545 -5.399 111 HB3 GLN 60 1HB GLN 60 1.740 -12.918 -6.490 112 HG2 GLN 60 2HG GLN 60 -0.580 -12.223 -6.961 113 HG3 GLN 60 1HG GLN 60 -0.394 -10.854 -5.866 114 HE21 GLN 60 1HE2 GLN 60 -1.032 -10.154 -8.430 115 HE22 GLN 60 2HE2 GLN 60 0.320 -9.545 -9.257 116 H GLN 61 H GLN 61 1.650 -15.318 -5.295 117 HA GLN 61 HA GLN 61 3.020 -15.800 -2.762 118 HB2 GLN 61 2HB GLN 61 3.290 -17.280 -5.391 119 HB3 GLN 61 1HB GLN 61 3.777 -17.870 -3.807 120 HG2 GLN 61 2HG GLN 61 0.953 -17.232 -4.702 121 HG3 GLN 61 1HG GLN 61 1.619 -18.838 -4.403 122 HE21 GLN 61 1HE2 GLN 61 -0.195 -16.420 -2.962 123 HE22 GLN 61 2HE2 GLN 61 0.087 -16.813 -1.338 124 H ILE 62 H ILE 62 5.444 -16.411 -2.885 125 HA ILE 62 HA ILE 62 7.048 -14.216 -3.375 126 HB ILE 62 HB ILE 62 7.826 -17.128 -3.733 127 HG12 ILE 62 2HG1 ILE 62 8.092 -15.302 -1.325 128 HG13 ILE 62 1HG1 ILE 62 6.786 -16.471 -1.533 129 HG21 ILE 62 1HG2 ILE 62 9.605 -15.865 -4.657 130 HG22 ILE 62 2HG2 ILE 62 10.098 -16.143 -2.989 131 HG23 ILE 62 3HG2 ILE 62 9.429 -14.582 -3.461 132 HD11 ILE 62 1HD1 ILE 62 9.262 -16.989 -0.372 133 HD12 ILE 62 2HD1 ILE 62 9.417 -17.657 -1.997 134 HD13 ILE 62 3HD1 ILE 62 8.114 -18.202 -0.940 135 H GLY 63 H GLY 63 8.807 -14.026 -5.129 136 HA2 GLY 63 2HA GLY 63 9.463 -14.263 -7.445 137 HA3 GLY 63 1HA GLY 63 7.876 -14.952 -7.794 138 H GLU 64 H GLU 64 7.294 -12.435 -5.791 139 HA GLU 64 HA GLU 64 6.926 -10.524 -8.057 140 HB2 GLU 64 2HB GLU 64 4.803 -11.429 -7.081 141 HB3 GLU 64 1HB GLU 64 5.271 -10.740 -5.525 142 HG2 GLU 64 2HG GLU 64 3.801 -9.158 -6.602 143 HG3 GLU 64 1HG GLU 64 5.433 -8.492 -6.669 144 H VAL 65 H VAL 65 7.596 -8.383 -7.698 145 HA VAL 65 HA VAL 65 8.945 -7.873 -5.078 146 HB VAL 65 HB VAL 65 10.584 -6.515 -6.287 147 HG11 VAL 65 1HG1 VAL 65 11.635 -8.338 -7.648 148 HG12 VAL 65 2HG1 VAL 65 10.146 -9.269 -7.482 149 HG13 VAL 65 3HG1 VAL 65 11.106 -8.881 -6.054 150 HG21 VAL 65 1HG2 VAL 65 10.435 -6.857 -8.905 151 HG22 VAL 65 2HG2 VAL 65 9.498 -5.582 -8.129 152 HG23 VAL 65 3HG2 VAL 65 8.722 -7.102 -8.570 153 H PHE 66 H PHE 66 8.644 -5.812 -4.175 154 HA PHE 66 HA PHE 66 6.698 -4.042 -5.586 155 HB2 PHE 66 2HB PHE 66 6.831 -4.630 -2.617 156 HB3 PHE 66 1HB PHE 66 5.702 -3.522 -3.399 157 HD1 PHE 66 1HD PHE 66 4.070 -4.429 -5.109 158 HD2 PHE 66 2HD PHE 66 6.430 -6.969 -2.580 159 HE1 PHE 66 1HE PHE 66 2.544 -6.323 -5.589 160 HE2 PHE 66 2HE PHE 66 4.908 -8.863 -3.056 161 HZ PHE 66 HZ PHE 66 2.961 -8.543 -4.563 162 H GLU 67 H GLU 67 6.865 -1.758 -4.949 163 HA GLU 67 HA GLU 67 9.628 -1.069 -4.030 164 HB2 GLU 67 2HB GLU 67 9.581 0.832 -5.480 165 HB3 GLU 67 1HB GLU 67 8.990 -0.522 -6.442 166 HG2 GLU 67 2HG GLU 67 6.641 0.176 -5.842 167 HG3 GLU 67 1HG GLU 67 7.324 1.625 -5.101 168 H CYS 68 H CYS 68 9.832 0.741 -2.616 169 HA CYS 68 HA CYS 68 7.297 1.454 -1.199 170 HB2 CYS 68 2HB CYS 68 9.372 0.331 -0.013 171 HB3 CYS 68 1HB CYS 68 10.037 1.965 -0.063 172 H THR 69 H THR 69 7.103 3.771 -0.564 173 HA THR 69 HA THR 69 8.645 5.534 -2.425 174 HB THR 69 HB THR 69 6.716 6.529 -3.093 175 HG1 THR 69 1HG THR 69 5.506 6.067 -0.584 176 HG21 THR 69 1HG2 THR 69 4.853 5.028 -3.179 177 HG22 THR 69 2HG2 THR 69 5.360 4.214 -1.698 178 HG23 THR 69 3HG2 THR 69 6.300 4.018 -3.179 179 H PHE 70 H PHE 70 9.227 7.603 -1.673 180 HA PHE 70 HA PHE 70 8.579 8.399 1.071 181 HB2 PHE 70 2HB PHE 70 10.919 8.560 1.804 182 HB3 PHE 70 1HB PHE 70 10.504 6.886 1.427 183 HD1 PHE 70 1HD PHE 70 12.459 9.823 0.427 184 HD2 PHE 70 2HD PHE 70 11.336 5.816 -0.634 185 HE1 PHE 70 1HE PHE 70 14.308 9.742 -1.223 186 HE2 PHE 70 2HE PHE 70 13.184 5.736 -2.285 187 HZ PHE 70 HZ PHE 70 14.670 7.698 -2.580 188 H THR 71 H THR 71 9.345 10.602 1.507 189 HA THR 71 HA THR 71 10.147 12.092 -0.944 190 HB THR 71 HB THR 71 8.017 12.924 1.047 191 HG1 THR 71 1HG THR 71 7.905 12.124 -1.671 192 HG21 THR 71 1HG2 THR 71 9.678 14.454 -0.693 193 HG22 THR 71 2HG2 THR 71 8.327 15.012 0.291 194 HG23 THR 71 3HG2 THR 71 8.045 14.465 -1.361 195 H CYS 72 H CYS 72 11.613 13.731 -0.583 196 HA CYS 72 HA CYS 72 12.367 14.275 2.256 197 HB2 CYS 72 2HB CYS 72 14.490 13.596 1.898 198 HB3 CYS 72 1HB CYS 72 13.925 12.892 0.382 199 H GLY 73 H GLY 73 13.693 16.398 2.361 200 HA2 GLY 73 2HA GLY 73 12.196 18.411 0.840 201 HA3 GLY 73 1HA GLY 73 13.358 18.740 2.128 202 H ALA 74 H ALA 74 13.686 20.377 0.085 203 HA ALA 74 HA ALA 74 15.416 21.139 -1.328 204 HB1 ALA 74 1HB ALA 74 17.472 20.115 -1.206 205 HB2 ALA 74 2HB ALA 74 16.789 18.497 -1.360 206 HB3 ALA 74 3HB ALA 74 16.722 19.338 0.188 207 H ASP 75 H ASP 75 12.985 19.512 -2.108 208 HA ASP 75 HA ASP 75 12.059 18.623 -4.062 209 HB2 ASP 75 2HB ASP 75 14.482 19.999 -5.263 210 HB3 ASP 75 1HB ASP 75 13.131 19.355 -6.194 211 H CYS 76 H CYS 76 13.572 16.822 -2.557 212 HA CYS 76 HA CYS 76 14.793 15.153 -4.715 213 HB2 CYS 76 2HB CYS 76 16.679 14.910 -3.508 214 HB3 CYS 76 1HB CYS 76 16.075 16.153 -2.417 215 H ARG 77 H ARG 77 13.396 13.552 -5.122 216 HA ARG 77 HA ARG 77 12.095 12.165 -2.818 217 HB2 ARG 77 2HB ARG 77 10.829 13.076 -5.417 218 HB3 ARG 77 1HB ARG 77 10.068 11.922 -4.321 219 HG2 ARG 77 2HG ARG 77 9.579 13.515 -2.763 220 HG3 ARG 77 1HG ARG 77 11.070 14.407 -3.051 221 HD2 ARG 77 2HD ARG 77 9.221 15.780 -3.793 222 HD3 ARG 77 1HD ARG 77 10.086 15.215 -5.220 223 HE ARG 77 HE ARG 77 7.809 13.541 -4.398 224 HH11 ARG 77 1HH1 ARG 77 6.166 13.390 -5.941 225 HH12 ARG 77 2HH1 ARG 77 6.165 14.471 -7.295 226 HH21 ARG 77 1HH2 ARG 77 9.052 16.121 -6.320 227 HH22 ARG 77 2HH2 ARG 77 7.799 16.015 -7.509 228 H GLY 78 H GLY 78 11.721 9.868 -3.207 229 HA2 GLY 78 2HA GLY 78 12.447 8.702 -5.772 230 HA3 GLY 78 1HA GLY 78 13.718 8.486 -4.571 231 H THR 79 H THR 79 12.744 6.205 -5.450 232 HA THR 79 HA THR 79 10.932 5.262 -3.278 233 HB THR 79 HB THR 79 9.877 3.723 -4.847 234 HG1 THR 79 1HG THR 79 11.383 4.940 -6.899 235 HG21 THR 79 1HG2 THR 79 9.877 6.287 -6.384 236 HG22 THR 79 2HG2 THR 79 9.317 6.309 -4.712 237 HG23 THR 79 3HG2 THR 79 8.519 5.273 -5.895 238 H SER 80 H SER 80 11.253 2.922 -2.782 239 HA SER 80 HA SER 80 14.049 2.046 -3.402 240 HB2 SER 80 2HB SER 80 14.111 1.007 -1.197 241 HB3 SER 80 1HB SER 80 13.677 2.705 -1.018 242 HG SER 80 HG SER 80 11.815 2.105 -0.256 243 H GLN 81 H GLN 81 14.333 -0.277 -3.623 244 HA GLN 81 HA GLN 81 11.807 -1.679 -4.377 245 HB2 GLN 81 2HB GLN 81 14.600 -1.819 -5.508 246 HB3 GLN 81 1HB GLN 81 13.413 -3.086 -5.806 247 HG2 GLN 81 2HG GLN 81 12.559 -0.262 -6.254 248 HG3 GLN 81 1HG GLN 81 13.643 -0.989 -7.441 249 HE21 GLN 81 1HE2 GLN 81 10.607 -1.818 -5.658 250 HE22 GLN 81 2HE2 GLN 81 9.900 -2.644 -6.962 251 H TYR 82 H TYR 82 11.429 -3.699 -3.505 252 HA TYR 82 HA TYR 82 13.588 -5.065 -2.030 253 HB2 TYR 82 2HB TYR 82 11.165 -3.814 -0.777 254 HB3 TYR 82 1HB TYR 82 11.818 -5.295 -0.082 255 HD1 TYR 82 1HD TYR 82 11.961 -1.823 0.114 256 HD2 TYR 82 2HD TYR 82 14.542 -5.256 0.041 257 HE1 TYR 82 1HE TYR 82 13.745 -0.506 1.225 258 HE2 TYR 82 2HE TYR 82 16.324 -3.940 1.153 259 HH TYR 82 HH TYR 82 16.877 -1.327 1.267 260 HA PRO 83 HA PRO 83 11.764 -8.846 -3.461 261 HB2 PRO 83 2HB PRO 83 11.436 -9.647 -0.600 262 HB3 PRO 83 1HB PRO 83 12.174 -10.540 -1.944 263 HG2 PRO 83 2HG PRO 83 13.651 -9.333 -0.082 264 HG3 PRO 83 1HG PRO 83 14.162 -9.425 -1.774 265 HD2 PRO 83 2HD PRO 83 13.191 -7.077 -0.240 266 HD3 PRO 83 1HD PRO 83 14.239 -7.145 -1.671 267 H CYS 84 H CYS 84 9.817 -10.476 -2.268 268 HA CYS 84 HA CYS 84 7.410 -9.010 -2.875 269 HB2 CYS 84 2HB CYS 84 6.639 -11.107 -3.110 270 HB3 CYS 84 1HB CYS 84 8.156 -11.730 -2.458 271 H VAL 85 H VAL 85 5.741 -8.358 -1.462 272 HA VAL 85 HA VAL 85 6.446 -8.280 1.443 273 HB VAL 85 HB VAL 85 6.797 -6.061 0.312 274 HG11 VAL 85 1HG1 VAL 85 3.957 -5.443 0.131 275 HG12 VAL 85 2HG1 VAL 85 4.410 -6.732 -0.983 276 HG13 VAL 85 3HG1 VAL 85 5.235 -5.176 -1.055 277 HG21 VAL 85 1HG2 VAL 85 5.379 -6.679 2.692 278 HG22 VAL 85 2HG2 VAL 85 4.551 -5.307 1.952 279 HG23 VAL 85 3HG2 VAL 85 6.271 -5.201 2.327 280 H GLN 86 H GLN 86 4.596 -8.347 2.868 281 HA GLN 86 HA GLN 86 2.515 -10.076 2.097 282 HB2 GLN 86 2HB GLN 86 2.347 -7.968 4.265 283 HB3 GLN 86 1HB GLN 86 1.417 -9.464 4.165 284 HG2 GLN 86 2HG GLN 86 4.426 -9.257 4.476 285 HG3 GLN 86 1HG GLN 86 3.285 -9.752 5.726 286 HE21 GLN 86 1HE2 GLN 86 5.500 -11.136 3.820 287 HE22 GLN 86 2HE2 GLN 86 4.741 -12.607 3.449 288 H VAL 87 H VAL 87 0.112 -8.795 2.924 289 HA VAL 87 HA VAL 87 -0.302 -6.873 0.663 290 HB VAL 87 HB VAL 87 -1.360 -9.107 0.321 291 HG11 VAL 87 1HG1 VAL 87 -2.899 -10.006 1.809 292 HG12 VAL 87 2HG1 VAL 87 -3.318 -8.432 2.485 293 HG13 VAL 87 3HG1 VAL 87 -1.798 -9.206 2.931 294 HG21 VAL 87 1HG2 VAL 87 -2.845 -7.899 -0.869 295 HG22 VAL 87 2HG2 VAL 87 -2.583 -6.511 0.187 296 HG23 VAL 87 3HG2 VAL 87 -3.822 -7.701 0.588 297 H TYR 88 H TYR 88 -1.617 -5.090 1.044 298 HA TYR 88 HA TYR 88 -3.243 -4.712 3.340 299 HB2 TYR 88 2HB TYR 88 -1.070 -4.691 4.497 300 HB3 TYR 88 1HB TYR 88 -0.550 -3.368 3.485 301 HD1 TYR 88 1HD TYR 88 -4.046 -2.911 4.173 302 HD2 TYR 88 2HD TYR 88 -0.145 -2.535 5.961 303 HE1 TYR 88 1HE TYR 88 -4.946 -1.318 5.810 304 HE2 TYR 88 2HE TYR 88 -1.068 -0.931 7.599 305 HH TYR 88 HH TYR 88 -3.442 0.761 7.382 306 H VAL 89 H VAL 89 -1.869 -1.793 3.273 307 HA VAL 89 HA VAL 89 -3.066 -0.965 0.681 308 HB VAL 89 HB VAL 89 -4.738 -0.641 2.527 309 HG11 VAL 89 1HG1 VAL 89 -4.276 0.659 4.389 310 HG12 VAL 89 2HG1 VAL 89 -3.034 1.593 3.555 311 HG13 VAL 89 3HG1 VAL 89 -2.683 -0.044 4.109 312 HG21 VAL 89 1HG2 VAL 89 -3.556 1.820 1.202 313 HG22 VAL 89 2HG2 VAL 89 -5.124 1.796 2.011 314 HG23 VAL 89 3HG2 VAL 89 -4.855 0.802 0.578 315 H ASN 90 H ASN 90 -1.866 0.565 -0.353 316 HA ASN 90 HA ASN 90 0.563 1.503 1.027 317 HB2 ASN 90 2HB ASN 90 -0.331 1.791 -1.854 318 HB3 ASN 90 1HB ASN 90 1.241 2.268 -1.222 319 HD21 ASN 90 1HD2 ASN 90 0.241 -0.483 0.443 320 HD22 ASN 90 2HD2 ASN 90 1.043 -1.654 -0.487 321 H ASN 91 H ASN 91 0.384 3.402 2.119 322 HA ASN 91 HA ASN 91 -1.707 5.317 1.280 323 HB2 ASN 91 2HB ASN 91 0.167 5.275 3.666 324 HB3 ASN 91 1HB ASN 91 -1.037 6.529 3.371 325 HD21 ASN 91 1HD2 ASN 91 -1.169 4.877 5.707 326 HD22 ASN 91 2HD2 ASN 91 -2.541 3.884 5.584 327 H SER 92 H SER 92 -0.678 5.959 -0.692 328 HA SER 92 HA SER 92 1.957 7.258 -0.475 329 HB2 SER 92 2HB SER 92 0.796 7.625 -3.048 330 HB3 SER 92 1HB SER 92 2.152 6.597 -2.604 331 HG SER 92 HG SER 92 0.527 5.043 -1.919 332 H GLU 93 H GLU 93 -0.892 8.206 0.509 333 HA GLU 93 HA GLU 93 -1.113 10.790 -0.865 334 HB2 GLU 93 2HB GLU 93 -2.982 11.205 0.583 335 HB3 GLU 93 1HB GLU 93 -3.086 9.503 0.137 336 HG2 GLU 93 2HG GLU 93 -1.857 8.947 2.268 337 HG3 GLU 93 1HG GLU 93 -1.998 10.644 2.727 338 H SER 94 H SER 94 0.707 9.378 1.573 339 HA SER 94 HA SER 94 1.707 12.039 2.458 340 HB2 SER 94 2HB SER 94 1.784 11.345 4.751 341 HB3 SER 94 1HB SER 94 0.169 10.934 4.186 342 HG SER 94 HG SER 94 0.652 8.864 4.284 343 H ASN 95 H ASN 95 2.470 9.714 0.598 344 HA ASN 95 HA ASN 95 4.442 8.662 -0.078 345 HB2 ASN 95 2HB ASN 95 5.761 10.503 1.941 346 HB3 ASN 95 1HB ASN 95 6.547 9.680 0.595 347 HD21 ASN 95 1HD2 ASN 95 5.883 12.690 1.273 348 HD22 ASN 95 2HD2 ASN 95 5.256 13.267 -0.196 349 H SER 96 H SER 96 2.970 7.238 1.784 350 HA SER 96 HA SER 96 5.148 5.946 3.369 351 HB2 SER 96 2HB SER 96 3.506 5.537 5.189 352 HB3 SER 96 1HB SER 96 3.796 7.256 4.929 353 HG SER 96 HG SER 96 1.866 7.409 3.868 354 H ARG 97 H ARG 97 4.925 3.686 3.631 355 HA ARG 97 HA ARG 97 2.882 2.402 1.873 356 HB2 ARG 97 2HB ARG 97 5.121 2.166 0.924 357 HB3 ARG 97 1HB ARG 97 5.744 1.582 2.462 358 HG2 ARG 97 2HG ARG 97 5.404 -0.331 1.028 359 HG3 ARG 97 1HG ARG 97 4.163 -0.379 2.275 360 HD2 ARG 97 2HD ARG 97 2.503 0.457 0.773 361 HD3 ARG 97 1HD ARG 97 3.704 0.867 -0.444 362 HE ARG 97 HE ARG 97 3.590 -1.369 -1.168 363 HH11 ARG 97 1HH1 ARG 97 2.988 -3.538 -0.973 364 HH12 ARG 97 2HH1 ARG 97 2.320 -4.108 0.521 365 HH21 ARG 97 1HH2 ARG 97 2.525 -1.023 2.093 366 HH22 ARG 97 2HH2 ARG 97 2.059 -2.683 2.256 367 H ALA 98 H ALA 98 1.453 1.213 3.050 368 HA ALA 98 HA ALA 98 2.282 0.295 5.758 369 HB1 ALA 98 1HB ALA 98 -0.540 -0.015 4.938 370 HB2 ALA 98 2HB ALA 98 0.034 1.651 4.999 371 HB3 ALA 98 3HB ALA 98 0.131 0.630 6.435 372 H LEU 99 H LEU 99 2.728 -1.833 6.017 373 HA LEU 99 HA LEU 99 1.620 -3.767 4.017 374 HB2 LEU 99 2HB LEU 99 3.641 -5.166 4.563 375 HB3 LEU 99 1HB LEU 99 4.021 -3.642 3.761 376 HG LEU 99 HG LEU 99 3.991 -3.015 6.492 377 HD11 LEU 99 1HD1 LEU 99 4.038 -5.375 7.081 378 HD12 LEU 99 2HD1 LEU 99 5.622 -4.673 7.410 379 HD13 LEU 99 3HD1 LEU 99 5.377 -5.661 5.968 380 HD21 LEU 99 1HD2 LEU 99 5.516 -2.187 4.673 381 HD22 LEU 99 2HD2 LEU 99 6.384 -3.719 4.764 382 HD23 LEU 99 3HD2 LEU 99 6.370 -2.630 6.150 383 H LEU 100 H LEU 100 0.439 -5.434 4.828 384 HA LEU 100 HA LEU 100 0.493 -5.891 7.786 385 HB2 LEU 100 2HB LEU 100 -1.564 -4.653 6.936 386 HB3 LEU 100 1HB LEU 100 -1.958 -6.106 6.019 387 HG LEU 100 HG LEU 100 -1.906 -7.416 8.141 388 HD11 LEU 100 1HD1 LEU 100 -0.992 -4.797 9.139 389 HD12 LEU 100 2HD1 LEU 100 -0.752 -6.406 9.820 390 HD13 LEU 100 3HD1 LEU 100 -2.257 -5.537 10.119 391 HD21 LEU 100 1HD2 LEU 100 -3.858 -5.449 8.955 392 HD22 LEU 100 2HD2 LEU 100 -4.127 -7.023 8.207 393 HD23 LEU 100 3HD2 LEU 100 -3.866 -5.602 7.198 394 H HIS 101 H HIS 101 0.262 -8.084 8.428 395 HA HIS 101 HA HIS 101 0.868 -10.030 6.283 396 HB2 HIS 101 2HB HIS 101 0.719 -10.403 9.291 397 HB3 HIS 101 1HB HIS 101 1.327 -11.585 8.132 398 HD1 HIS 101 1HD HIS 101 2.221 -8.143 7.251 399 HD2 HIS 101 2HD HIS 101 3.886 -11.179 9.579 400 HE1 HIS 101 1HE HIS 101 4.643 -7.504 7.639 401 HE2 HIS 101 2HE HIS 101 5.664 -9.343 9.057 402 H SER 102 H SER 102 -0.802 -11.095 5.331 403 HA SER 102 HA SER 102 -3.505 -10.927 6.214 404 HB2 SER 102 2HB SER 102 -2.751 -11.533 3.888 405 HB3 SER 102 1HB SER 102 -2.300 -13.121 4.501 406 HG SER 102 HG SER 102 -4.516 -12.768 3.568 407 H ASP 103 H ASP 103 -1.018 -13.404 6.730 408 HA ASP 103 HA ASP 103 -2.260 -14.251 9.199 409 HB2 ASP 103 2HB ASP 103 -3.701 -15.351 7.393 410 HB3 ASP 103 1HB ASP 103 -2.279 -16.308 6.980 411 H GLU 104 H GLU 104 -0.960 -15.998 10.227 412 HA GLU 104 HA GLU 104 1.840 -15.604 9.831 413 HB2 GLU 104 2HB GLU 104 0.341 -17.812 11.274 414 HB3 GLU 104 1HB GLU 104 2.078 -17.540 11.392 415 HG2 GLU 104 2HG GLU 104 1.643 -15.242 12.230 416 HG3 GLU 104 1HG GLU 104 -0.089 -15.571 12.174 417 H HIS 105 H HIS 105 -0.433 -17.991 8.572 418 HA HIS 105 HA HIS 105 1.423 -19.910 7.621 419 HB2 HIS 105 2HB HIS 105 -0.987 -20.321 7.605 420 HB3 HIS 105 1HB HIS 105 -1.223 -19.019 6.437 421 HD1 HIS 105 1HD HIS 105 0.597 -22.361 6.711 422 HD2 HIS 105 2HD HIS 105 -0.959 -19.805 3.811 423 HE1 HIS 105 1HE HIS 105 0.825 -23.572 4.496 424 HE2 HIS 105 2HE HIS 105 -0.123 -22.025 2.719 425 H GLN 106 H GLN 106 0.264 -16.884 6.173 426 HA GLN 106 HA GLN 106 1.551 -17.184 3.644 427 HB2 GLN 106 2HB GLN 106 -0.147 -15.411 4.233 428 HB3 GLN 106 1HB GLN 106 1.116 -14.588 5.150 429 HG2 GLN 106 2HG GLN 106 2.494 -14.409 3.119 430 HG3 GLN 106 1HG GLN 106 1.253 -15.257 2.194 431 HE21 GLN 106 1HE2 GLN 106 1.848 -12.745 1.262 432 HE22 GLN 106 2HE2 GLN 106 0.629 -11.637 1.670 433 H LEU 107 H LEU 107 2.677 -15.871 6.732 434 HA LEU 107 HA LEU 107 5.215 -14.924 5.850 435 HB2 LEU 107 2HB LEU 107 4.222 -14.443 8.093 436 HB3 LEU 107 1HB LEU 107 4.514 -16.122 8.549 437 HG LEU 107 HG LEU 107 6.955 -15.760 8.034 438 HD11 LEU 107 1HD1 LEU 107 5.870 -13.183 7.178 439 HD12 LEU 107 2HD1 LEU 107 7.442 -13.903 6.839 440 HD13 LEU 107 3HD1 LEU 107 7.190 -12.998 8.332 441 HD21 LEU 107 1HD2 LEU 107 6.722 -13.749 10.051 442 HD22 LEU 107 2HD2 LEU 107 7.062 -15.467 10.263 443 HD23 LEU 107 3HD2 LEU 107 5.395 -14.890 10.271 444 H LEU 108 H LEU 108 4.202 -18.101 7.111 445 HA LEU 108 HA LEU 108 6.778 -19.338 6.943 446 HB2 LEU 108 2HB LEU 108 4.758 -20.277 8.147 447 HB3 LEU 108 1HB LEU 108 4.077 -20.670 6.569 448 HG LEU 108 HG LEU 108 6.159 -21.995 6.076 449 HD11 LEU 108 1HD1 LEU 108 7.915 -21.596 7.445 450 HD12 LEU 108 2HD1 LEU 108 7.077 -22.589 8.637 451 HD13 LEU 108 3HD1 LEU 108 6.889 -20.835 8.661 452 HD21 LEU 108 1HD2 LEU 108 4.634 -23.568 6.667 453 HD22 LEU 108 2HD2 LEU 108 4.048 -22.606 8.024 454 HD23 LEU 108 3HD2 LEU 108 5.481 -23.617 8.213 455 H THR 109 H THR 109 4.196 -18.761 4.647 456 HA THR 109 HA THR 109 5.243 -20.412 2.530 457 HB THR 109 HB THR 109 3.406 -18.004 2.376 458 HG1 THR 109 1HG THR 109 2.605 -20.698 2.456 459 HG21 THR 109 1HG2 THR 109 3.563 -20.412 0.569 460 HG22 THR 109 2HG2 THR 109 4.441 -18.917 0.249 461 HG23 THR 109 3HG2 THR 109 2.679 -18.911 0.298 462 H ASN 110 H ASN 110 5.626 -17.021 3.479 463 HA ASN 110 HA ASN 110 7.841 -16.810 1.488 464 HB2 ASN 110 2HB ASN 110 6.180 -14.399 2.123 465 HB3 ASN 110 1HB ASN 110 7.092 -14.777 0.662 466 HD21 ASN 110 1HD2 ASN 110 4.015 -14.287 1.466 467 HD22 ASN 110 2HD2 ASN 110 3.232 -15.462 0.525 468 HA PRO 111 HA PRO 111 9.037 -15.725 5.940 469 HB2 PRO 111 2HB PRO 111 11.469 -17.190 5.090 470 HB3 PRO 111 1HB PRO 111 10.526 -17.343 6.582 471 HG2 PRO 111 2HG PRO 111 10.464 -19.196 4.651 472 HG3 PRO 111 1HG PRO 111 9.056 -18.825 5.659 473 HD2 PRO 111 2HD PRO 111 9.583 -18.079 2.814 474 HD3 PRO 111 1HD PRO 111 8.047 -18.422 3.632 475 H LYS 112 H LYS 112 10.497 -15.382 2.788 476 HA LYS 112 HA LYS 112 12.517 -13.472 3.753 477 HB2 LYS 112 2HB LYS 112 11.794 -14.390 0.956 478 HB3 LYS 112 1HB LYS 112 13.143 -13.324 1.349 479 HG2 LYS 112 2HG LYS 112 14.060 -15.103 2.844 480 HG3 LYS 112 1HG LYS 112 12.764 -16.173 2.311 481 HD2 LYS 112 2HD LYS 112 13.544 -15.876 -0.045 482 HD3 LYS 112 1HD LYS 112 14.903 -14.927 0.561 483 HE2 LYS 112 2HE LYS 112 15.889 -17.019 0.475 484 HE3 LYS 112 1HE LYS 112 15.249 -17.053 2.117 485 HZ1 LYS 112 1HZ LYS 112 13.465 -17.917 -0.021 486 HZ2 LYS 112 2HZ LYS 112 13.632 -18.508 1.563 487 HZ3 LYS 112 3HZ LYS 112 14.751 -18.952 0.365 488 H CYS 113 H CYS 113 9.311 -13.190 3.383 489 HA CYS 113 HA CYS 113 9.440 -10.523 2.044 490 HB2 CYS 113 2HB CYS 113 7.098 -12.344 2.659 491 HB3 CYS 113 1HB CYS 113 6.951 -10.743 1.938 492 H SER 114 H SER 114 10.413 -9.664 4.109 493 HA SER 114 HA SER 114 8.728 -8.079 5.597 494 HB2 SER 114 2HB SER 114 8.637 -10.894 6.535 495 HB3 SER 114 1HB SER 114 8.796 -9.666 7.789 496 HG SER 114 HG SER 114 7.003 -8.896 5.936 497 H TYR 115 H TYR 115 11.388 -10.389 6.068 498 HA TYR 115 HA TYR 115 12.710 -8.927 8.143 499 HB2 TYR 115 2HB TYR 115 13.830 -10.833 6.070 500 HB3 TYR 115 1HB TYR 115 14.708 -10.270 7.496 501 HD1 TYR 115 1HD TYR 115 14.321 -11.226 9.642 502 HD2 TYR 115 2HD TYR 115 11.665 -12.098 6.384 503 HE1 TYR 115 1HE TYR 115 13.206 -12.962 11.016 504 HE2 TYR 115 2HE TYR 115 10.551 -13.836 7.755 505 HH TYR 115 HH TYR 115 11.581 -14.466 11.114 506 H ILE 116 H ILE 116 12.849 -8.679 4.623 507 HA ILE 116 HA ILE 116 15.142 -6.971 4.495 508 HB ILE 116 HB ILE 116 13.397 -6.201 2.413 509 HG12 ILE 116 2HG1 ILE 116 11.945 -8.099 3.236 510 HG13 ILE 116 1HG1 ILE 116 12.494 -8.277 1.573 511 HG21 ILE 116 1HG2 ILE 116 15.658 -8.196 2.639 512 HG22 ILE 116 2HG2 ILE 116 15.717 -6.551 2.008 513 HG23 ILE 116 3HG2 ILE 116 14.893 -7.814 1.096 514 HD11 ILE 116 1HD1 ILE 116 13.651 -10.157 2.055 515 HD12 ILE 116 2HD1 ILE 116 12.800 -10.163 3.598 516 HD13 ILE 116 3HD1 ILE 116 14.394 -9.422 3.476 517 HA PRO 117 HA PRO 117 13.951 -3.156 6.441 518 HB2 PRO 117 2HB PRO 117 14.566 -2.018 3.734 519 HB3 PRO 117 1HB PRO 117 15.043 -1.425 5.336 520 HG2 PRO 117 2HG PRO 117 16.698 -2.844 3.743 521 HG3 PRO 117 1HG PRO 117 16.781 -2.882 5.510 522 HD2 PRO 117 2HD PRO 117 15.985 -5.017 3.680 523 HD3 PRO 117 1HD PRO 117 16.300 -5.110 5.427 524 HA PRO 118 HA PRO 118 9.878 -3.059 4.321 525 HB2 PRO 118 2HB PRO 118 8.344 -3.740 6.426 526 HB3 PRO 118 1HB PRO 118 9.287 -4.954 5.540 527 HG2 PRO 118 2HG PRO 118 9.759 -3.778 8.205 528 HG3 PRO 118 1HG PRO 118 10.220 -5.363 7.567 529 HD2 PRO 118 2HD PRO 118 11.874 -3.030 7.779 530 HD3 PRO 118 1HD PRO 118 12.301 -4.592 7.055 531 H CYS 119 H CYS 119 8.443 -1.289 4.249 532 HA CYS 119 HA CYS 119 8.872 0.807 6.319 533 HB2 CYS 119 2HB CYS 119 7.268 1.858 4.262 534 HB3 CYS 119 1HB CYS 119 8.980 2.174 4.530 535 H LYS 120 H LYS 120 7.366 0.689 7.924 536 HA LYS 120 HA LYS 120 4.517 0.326 7.116 537 HB2 LYS 120 2HB LYS 120 4.191 -1.078 9.161 538 HB3 LYS 120 1HB LYS 120 5.262 -1.827 7.977 539 HG2 LYS 120 2HG LYS 120 7.216 -0.866 9.245 540 HG3 LYS 120 1HG LYS 120 6.078 -0.350 10.492 541 HD2 LYS 120 2HD LYS 120 5.339 -2.700 10.774 542 HD3 LYS 120 1HD LYS 120 6.525 -3.203 9.567 543 HE2 LYS 120 2HE LYS 120 8.310 -2.873 10.978 544 HE3 LYS 120 1HE LYS 120 7.522 -1.547 11.834 545 HZ1 LYS 120 1HZ LYS 120 7.573 -4.318 12.469 546 HZ2 LYS 120 2HZ LYS 120 5.974 -3.760 12.334 547 HZ3 LYS 120 3HZ LYS 120 7.050 -3.010 13.414 548 H ARG 121 H ARG 121 3.107 1.684 8.174 549 HA ARG 121 HA ARG 121 4.165 3.922 9.634 550 HB2 ARG 121 2HB ARG 121 1.324 2.937 9.273 551 HB3 ARG 121 1HB ARG 121 1.760 4.492 9.975 552 HG2 ARG 121 2HG ARG 121 2.984 5.051 7.868 553 HG3 ARG 121 1HG ARG 121 2.396 3.543 7.168 554 HD2 ARG 121 2HD ARG 121 0.683 5.832 8.178 555 HD3 ARG 121 1HD ARG 121 0.935 5.386 6.491 556 HE ARG 121 HE ARG 121 -0.062 3.069 7.542 557 HH11 ARG 121 1HH1 ARG 121 -2.262 2.609 7.777 558 HH12 ARG 121 2HH1 ARG 121 -3.392 3.910 7.950 559 HH21 ARG 121 1HH2 ARG 121 -0.973 6.387 7.759 560 HH22 ARG 121 2HH2 ARG 121 -2.662 6.050 7.940 561 H GLU 122 H GLU 122 2.552 0.928 10.618 562 HA GLU 122 HA GLU 122 3.035 1.693 13.460 563 HB2 GLU 122 2HB GLU 122 0.626 1.416 12.833 564 HB3 GLU 122 1HB GLU 122 0.976 -0.255 12.390 565 HG2 GLU 122 2HG GLU 122 0.128 -0.273 14.649 566 HG3 GLU 122 1HG GLU 122 1.859 -0.599 14.733 567 H ASN 123 H ASN 123 4.184 0.237 14.713 568 HA ASN 123 HA ASN 123 5.929 -1.608 13.462 569 HB2 ASN 123 2HB ASN 123 4.953 -1.709 16.322 570 HB3 ASN 123 1HB ASN 123 6.475 -2.352 15.701 571 HD21 ASN 123 1HD2 ASN 123 4.758 0.613 16.560 572 HD22 ASN 123 2HD2 ASN 123 6.112 1.637 16.475 573 H GLN 124 H GLN 124 2.833 -2.151 15.130 574 HA GLN 124 HA GLN 124 2.453 -4.606 13.554 575 HB2 GLN 124 2HB GLN 124 2.176 -6.075 15.460 576 HB3 GLN 124 1HB GLN 124 3.760 -5.308 15.584 577 HG2 GLN 124 2HG GLN 124 2.681 -3.554 17.064 578 HG3 GLN 124 1HG GLN 124 1.239 -4.570 17.088 579 HE21 GLN 124 1HE2 GLN 124 1.314 -5.369 19.236 580 HE22 GLN 124 2HE2 GLN 124 2.618 -6.256 19.864 581 H LYS 125 H LYS 125 0.238 -5.474 13.834 582 HA LYS 125 HA LYS 125 -1.661 -3.498 15.004 583 HB2 LYS 125 2HB LYS 125 -1.903 -4.899 12.327 584 HB3 LYS 125 1HB LYS 125 -3.179 -3.935 13.076 585 HG2 LYS 125 2HG LYS 125 -1.617 -1.989 13.127 586 HG3 LYS 125 1HG LYS 125 -0.433 -2.957 12.250 587 HD2 LYS 125 2HD LYS 125 -2.113 -3.276 10.427 588 HD3 LYS 125 1HD LYS 125 -3.199 -2.182 11.285 589 HE2 LYS 125 2HE LYS 125 -0.963 -0.665 11.253 590 HE3 LYS 125 1HE LYS 125 -0.720 -1.580 9.766 591 HZ1 LYS 125 1HZ LYS 125 -3.187 -0.965 9.356 592 HZ2 LYS 125 2HZ LYS 125 -1.973 0.181 9.041 593 HZ3 LYS 125 3HZ LYS 125 -2.886 0.277 10.470 594 H ASN 126 H ASN 126 -3.706 -4.453 15.678 595 HA ASN 126 HA ASN 126 -3.454 -6.954 16.993 596 HB2 ASN 126 2HB ASN 126 -5.176 -5.118 17.439 597 HB3 ASN 126 1HB ASN 126 -6.079 -5.766 16.069 598 HD21 ASN 126 1HD2 ASN 126 -7.513 -5.989 18.313 599 HD22 ASN 126 2HD2 ASN 126 -7.452 -7.549 18.981 600 H LEU 127 H LEU 127 -3.792 -9.041 16.302 601 HA LEU 127 HA LEU 127 -3.835 -9.663 13.532 602 HB2 LEU 127 2HB LEU 127 -4.450 -11.284 16.002 603 HB3 LEU 127 1HB LEU 127 -4.575 -11.989 14.394 604 HG LEU 127 HG LEU 127 -2.332 -12.301 15.574 605 HD11 LEU 127 1HD1 LEU 127 -1.648 -12.672 13.468 606 HD12 LEU 127 2HD1 LEU 127 -1.383 -10.943 13.250 607 HD13 LEU 127 3HD1 LEU 127 -2.948 -11.652 12.855 608 HD21 LEU 127 1HD2 LEU 127 -1.967 -9.387 14.822 609 HD22 LEU 127 2HD2 LEU 127 -0.818 -10.428 15.661 610 HD23 LEU 127 3HD2 LEU 127 -2.306 -9.932 16.466 611 H GLU 128 H GLU 128 -6.463 -9.401 15.891 612 HA GLU 128 HA GLU 128 -8.545 -10.445 14.248 613 HB2 GLU 128 2HB GLU 128 -8.756 -9.940 16.695 614 HB3 GLU 128 1HB GLU 128 -8.775 -8.221 16.298 615 HG2 GLU 128 2HG GLU 128 -10.763 -8.615 14.845 616 HG3 GLU 128 1HG GLU 128 -10.772 -10.302 15.361 617 H SER 129 H SER 129 -7.111 -7.210 14.464 618 HA SER 129 HA SER 129 -9.006 -5.836 12.847 619 HB2 SER 129 2HB SER 129 -7.160 -4.758 14.169 620 HB3 SER 129 1HB SER 129 -6.017 -5.338 12.960 621 HG SER 129 HG SER 129 -8.013 -4.178 11.678 622 H VAL 130 H VAL 130 -6.234 -7.858 12.006 623 HA VAL 130 HA VAL 130 -6.200 -7.222 9.214 624 HB VAL 130 HB VAL 130 -5.362 -9.791 10.584 625 HG11 VAL 130 1HG1 VAL 130 -3.771 -9.324 8.346 626 HG12 VAL 130 2HG1 VAL 130 -5.391 -8.885 7.801 627 HG13 VAL 130 3HG1 VAL 130 -5.084 -10.497 8.450 628 HG21 VAL 130 1HG2 VAL 130 -3.120 -8.297 9.860 629 HG22 VAL 130 2HG2 VAL 130 -3.766 -8.465 11.493 630 HG23 VAL 130 3HG2 VAL 130 -4.241 -7.093 10.491 631 H MET 131 H MET 131 -8.016 -9.636 11.092 632 HA MET 131 HA MET 131 -9.060 -11.137 8.934 633 HB2 MET 131 2HB MET 131 -9.469 -11.835 11.226 634 HB3 MET 131 1HB MET 131 -10.370 -10.354 11.554 635 HG2 MET 131 2HG MET 131 -11.365 -11.829 9.217 636 HG3 MET 131 1HG MET 131 -11.493 -12.734 10.725 637 HE1 MET 131 1HE MET 131 -13.718 -11.687 8.755 638 HE2 MET 131 2HE MET 131 -13.032 -10.091 8.474 639 HE3 MET 131 3HE MET 131 -14.607 -10.239 9.244 640 H ASN 132 H ASN 132 -10.297 -8.152 10.426 641 HA ASN 132 HA ASN 132 -12.567 -7.866 8.706 642 HB2 ASN 132 2HB ASN 132 -12.080 -6.589 10.867 643 HB3 ASN 132 1HB ASN 132 -10.994 -5.580 9.911 644 HD21 ASN 132 1HD2 ASN 132 -12.669 -3.842 10.573 645 HD22 ASN 132 2HD2 ASN 132 -14.034 -3.662 9.578 646 H TRP 133 H TRP 133 -9.194 -6.847 8.411 647 HA TRP 133 HA TRP 133 -9.454 -5.169 6.143 648 HB2 TRP 133 2HB TRP 133 -7.347 -5.102 7.161 649 HB3 TRP 133 1HB TRP 133 -7.218 -6.856 7.225 650 HD1 TRP 133 HD TRP 133 -6.268 -8.104 5.159 651 HE1 TRP 133 1HE TRP 133 -5.231 -7.325 2.930 652 HE3 TRP 133 3HE TRP 133 -7.475 -3.152 5.320 653 HZ2 TRP 133 2HZ TRP 133 -4.955 -4.914 1.419 654 HZ3 TRP 133 3HZ TRP 133 -6.811 -1.638 3.479 655 HH2 TRP 133 HH TRP 133 -5.554 -2.514 1.532 656 H GLN 134 H GLN 134 -8.942 -8.702 6.295 657 HA GLN 134 HA GLN 134 -8.711 -9.038 3.476 658 HB2 GLN 134 2HB GLN 134 -8.463 -11.232 3.972 659 HB3 GLN 134 1HB GLN 134 -8.444 -10.686 5.642 660 HG2 GLN 134 2HG GLN 134 -10.021 -12.458 5.568 661 HG3 GLN 134 1HG GLN 134 -10.983 -10.988 5.619 662 HE21 GLN 134 1HE2 GLN 134 -12.710 -11.170 4.193 663 HE22 GLN 134 2HE2 GLN 134 -12.639 -11.898 2.664 664 H GLN 135 H GLN 135 -11.563 -9.100 5.608 665 HA GLN 135 HA GLN 135 -13.418 -9.676 3.465 666 HB2 GLN 135 2HB GLN 135 -13.778 -8.557 6.250 667 HB3 GLN 135 1HB GLN 135 -15.125 -8.858 5.159 668 HG2 GLN 135 2HG GLN 135 -14.303 -11.240 4.944 669 HG3 GLN 135 1HG GLN 135 -13.161 -10.886 6.241 670 HE21 GLN 135 1HE2 GLN 135 -15.732 -8.968 6.978 671 HE22 GLN 135 2HE2 GLN 135 -16.616 -10.024 7.971 672 H TYR 136 H TYR 136 -12.133 -6.716 4.888 673 HA TYR 136 HA TYR 136 -14.001 -4.872 3.837 674 HB2 TYR 136 2HB TYR 136 -12.296 -4.265 5.488 675 HB3 TYR 136 1HB TYR 136 -11.031 -4.497 4.283 676 HD1 TYR 136 1HD TYR 136 -13.863 -2.371 5.326 677 HD2 TYR 136 2HD TYR 136 -10.714 -2.931 2.459 678 HE1 TYR 136 1HE TYR 136 -14.196 -0.054 4.504 679 HE2 TYR 136 2HE TYR 136 -11.047 -0.620 1.639 680 HH TYR 136 HH TYR 136 -13.688 1.147 2.137 681 H TRP 137 H TRP 137 -10.841 -5.778 2.336 682 HA TRP 137 HA TRP 137 -11.690 -4.364 -0.097 683 HB2 TRP 137 2HB TRP 137 -9.448 -5.064 -0.977 684 HB3 TRP 137 1HB TRP 137 -9.368 -4.134 0.515 685 HD1 TRP 137 HD TRP 137 -8.300 -5.246 2.569 686 HE1 TRP 137 1HE TRP 137 -7.236 -7.551 3.023 687 HE3 TRP 137 3HE TRP 137 -9.665 -7.676 -1.679 688 HZ2 TRP 137 2HZ TRP 137 -6.998 -10.099 1.737 689 HZ3 TRP 137 3HZ TRP 137 -9.015 -10.042 -2.055 690 HH2 TRP 137 HH TRP 137 -7.682 -11.255 -0.351 691 H LYS 138 H LYS 138 -11.279 -7.712 0.954 692 HA LYS 138 HA LYS 138 -11.541 -8.938 -1.606 693 HB2 LYS 138 2HB LYS 138 -10.846 -10.118 0.490 694 HB3 LYS 138 1HB LYS 138 -12.521 -10.034 1.042 695 HG2 LYS 138 2HG LYS 138 -13.235 -11.272 -0.990 696 HG3 LYS 138 1HG LYS 138 -11.546 -11.403 -1.483 697 HD2 LYS 138 2HD LYS 138 -11.059 -12.575 0.677 698 HD3 LYS 138 1HD LYS 138 -12.788 -12.557 1.028 699 HE2 LYS 138 2HE LYS 138 -12.642 -14.622 0.007 700 HE3 LYS 138 1HE LYS 138 -12.916 -13.619 -1.418 701 HZ1 LYS 138 1HZ LYS 138 -10.506 -14.988 -0.549 702 HZ2 LYS 138 2HZ LYS 138 -10.281 -13.438 -1.203 703 HZ3 LYS 138 3HZ LYS 138 -11.054 -14.644 -2.116 704 H ASP 139 H ASP 139 -14.012 -7.899 0.726 705 HA ASP 139 HA ASP 139 -16.161 -8.931 -0.990 706 HB2 ASP 139 2HB ASP 139 -16.209 -7.314 1.569 707 HB3 ASP 139 1HB ASP 139 -17.650 -7.907 0.744 708 H GLU 140 H GLU 140 -14.367 -6.012 -0.810 709 HA GLU 140 HA GLU 140 -16.578 -4.505 -2.110 710 HB2 GLU 140 2HB GLU 140 -13.990 -3.539 -0.876 711 HB3 GLU 140 1HB GLU 140 -15.190 -2.497 -1.640 712 HG2 GLU 140 2HG GLU 140 -16.890 -3.287 -0.019 713 HG3 GLU 140 1HG GLU 140 -15.666 -4.282 0.766 714 H ILE 141 H ILE 141 -13.048 -4.221 -2.444 715 HA ILE 141 HA ILE 141 -13.379 -3.816 -5.315 716 HB ILE 141 HB ILE 141 -11.034 -3.300 -5.340 717 HG12 ILE 141 2HG1 ILE 141 -10.958 -4.582 -2.591 718 HG13 ILE 141 1HG1 ILE 141 -10.210 -5.221 -4.054 719 HG21 ILE 141 1HG2 ILE 141 -12.809 -1.903 -3.890 720 HG22 ILE 141 2HG2 ILE 141 -11.113 -1.432 -3.999 721 HG23 ILE 141 3HG2 ILE 141 -11.688 -2.335 -2.597 722 HD11 ILE 141 1HD1 ILE 141 -8.433 -4.131 -2.948 723 HD12 ILE 141 2HD1 ILE 141 -9.446 -2.762 -2.489 724 HD13 ILE 141 3HD1 ILE 141 -8.953 -2.968 -4.168 725 H GLY 142 H GLY 142 -12.532 -6.472 -3.224 726 HA2 GLY 142 2HA GLY 142 -12.252 -8.747 -3.776 727 HA3 GLY 142 1HA GLY 142 -12.680 -8.338 -5.438 728 H SER 143 H SER 143 -10.029 -6.993 -3.490 729 HA SER 143 HA SER 143 -7.700 -7.125 -3.792 730 HB2 SER 143 2HB SER 143 -8.409 -9.649 -4.221 731 HB3 SER 143 1HB SER 143 -7.997 -9.251 -5.885 732 HG SER 143 HG SER 143 -6.047 -8.258 -4.610 733 H GLN 144 H GLN 144 -8.251 -5.005 -4.888 734 HA GLN 144 HA GLN 144 -7.163 -5.043 -7.624 735 HB2 GLN 144 2HB GLN 144 -9.986 -4.499 -6.975 736 HB3 GLN 144 1HB GLN 144 -9.221 -3.293 -8.009 737 HG2 GLN 144 2HG GLN 144 -8.443 -5.125 -9.512 738 HG3 GLN 144 1HG GLN 144 -9.317 -6.283 -8.509 739 HE21 GLN 144 1HE2 GLN 144 -10.677 -3.076 -9.000 740 HE22 GLN 144 2HE2 GLN 144 -11.933 -3.561 -10.034 741 HA PRO 145 HA PRO 145 -5.331 -1.665 -5.054 742 HB2 PRO 145 2HB PRO 145 -3.681 -1.505 -7.533 743 HB3 PRO 145 1HB PRO 145 -3.171 -1.527 -5.837 744 HG2 PRO 145 2HG PRO 145 -2.915 -3.660 -7.430 745 HG3 PRO 145 1HG PRO 145 -3.251 -3.804 -5.701 746 HD2 PRO 145 2HD PRO 145 -5.062 -4.272 -8.007 747 HD3 PRO 145 1HD PRO 145 -5.111 -4.971 -6.375 748 H PHE 146 H PHE 146 -5.375 0.657 -5.349 749 HA PHE 146 HA PHE 146 -6.487 1.646 -7.897 750 HB2 PHE 146 2HB PHE 146 -8.117 3.073 -6.665 751 HB3 PHE 146 1HB PHE 146 -8.458 1.354 -6.510 752 HD1 PHE 146 1HD PHE 146 -8.221 4.367 -4.778 753 HD2 PHE 146 2HD PHE 146 -7.201 0.212 -4.390 754 HE1 PHE 146 1HE PHE 146 -8.177 4.609 -2.315 755 HE2 PHE 146 2HE PHE 146 -7.138 0.460 -1.923 756 HZ PHE 146 HZ PHE 146 -7.632 2.657 -0.886 757 H THR 147 H THR 147 -6.174 3.966 -8.191 758 HA THR 147 HA THR 147 -4.002 5.047 -6.448 759 HB THR 147 HB THR 147 -3.008 6.069 -8.418 760 HG1 THR 147 1HG THR 147 -4.385 4.759 -10.308 761 HG21 THR 147 1HG2 THR 147 -3.379 3.184 -8.127 762 HG22 THR 147 2HG2 THR 147 -1.904 4.105 -8.410 763 HG23 THR 147 3HG2 THR 147 -2.940 3.662 -9.766 764 H CYS 148 H CYS 148 -3.950 7.360 -6.307 765 HA CYS 148 HA CYS 148 -6.429 8.733 -7.132 766 HB2 CYS 148 2HB CYS 148 -5.973 9.884 -4.701 767 HB3 CYS 148 1HB CYS 148 -7.106 8.558 -4.952 768 H TYR 149 H TYR 149 -6.170 11.083 -7.204 769 HA TYR 149 HA TYR 149 -3.430 12.139 -6.900 770 HB2 TYR 149 2HB TYR 149 -4.813 11.911 -9.578 771 HB3 TYR 149 1HB TYR 149 -3.587 13.135 -9.270 772 HD1 TYR 149 1HD TYR 149 -4.236 9.552 -9.725 773 HD2 TYR 149 2HD TYR 149 -1.267 12.510 -8.778 774 HE1 TYR 149 1HE TYR 149 -2.446 7.883 -10.130 775 HE2 TYR 149 2HE TYR 149 0.524 10.839 -9.183 776 HH TYR 149 HH TYR 149 0.101 7.663 -9.215 777 H PHE 150 H PHE 150 -3.510 14.307 -6.353 778 HA PHE 150 HA PHE 150 -6.014 15.755 -6.968 779 HB2 PHE 150 2HB PHE 150 -6.703 16.001 -4.818 780 HB3 PHE 150 1HB PHE 150 -5.647 14.634 -4.476 781 HD1 PHE 150 1HD PHE 150 -5.867 18.332 -4.524 782 HD2 PHE 150 2HD PHE 150 -3.591 14.908 -3.293 783 HE1 PHE 150 1HE PHE 150 -4.464 19.794 -3.096 784 HE2 PHE 150 2HE PHE 150 -2.173 16.354 -1.873 785 HZ PHE 150 HZ PHE 150 -2.606 18.803 -1.768 786 H ASN 151 H ASN 151 -5.726 17.983 -7.226 787 HA ASN 151 HA ASN 151 -3.039 19.067 -6.579 788 HB2 ASN 151 2HB ASN 151 -2.829 19.986 -8.891 789 HB3 ASN 151 1HB ASN 151 -2.761 18.224 -8.830 790 HD21 ASN 151 1HD2 ASN 151 -3.554 18.136 -11.091 791 HD22 ASN 151 2HD2 ASN 151 -5.192 18.422 -11.437 792 H GLN 152 H GLN 152 -3.024 21.231 -6.167 793 HA GLN 152 HA GLN 152 -5.647 22.576 -5.969 794 HB2 GLN 152 2HB GLN 152 -3.949 22.558 -4.079 795 HB3 GLN 152 1HB GLN 152 -2.933 23.593 -5.080 796 HG2 GLN 152 2HG GLN 152 -4.669 25.305 -5.149 797 HG3 GLN 152 1HG GLN 152 -5.780 24.256 -4.267 798 HE21 GLN 152 1HE2 GLN 152 -5.292 26.676 -3.066 799 HE22 GLN 152 2HE2 GLN 152 -4.247 26.499 -1.739 800 H HIS 153 H HIS 153 -3.221 22.305 -8.267 801 HA HIS 153 HA HIS 153 -2.662 24.872 -9.170 802 HB2 HIS 153 2HB HIS 153 -2.269 23.937 -11.323 803 HB3 HIS 153 1HB HIS 153 -1.903 22.653 -10.177 804 HD1 HIS 153 1HD HIS 153 -5.141 23.837 -11.853 805 HD2 HIS 153 2HD HIS 153 -3.010 20.328 -11.123 806 HE1 HIS 153 1HE HIS 153 -6.516 21.948 -12.832 807 HE2 HIS 153 2HE HIS 153 -5.230 19.805 -12.389 808 H GLN 154 H GLN 154 -5.703 23.097 -9.490 809 HA GLN 154 HA GLN 154 -6.903 25.026 -11.299 810 HB2 GLN 154 2HB GLN 154 -7.743 22.671 -10.976 811 HB3 GLN 154 1HB GLN 154 -8.300 23.144 -9.371 812 HG2 GLN 154 2HG GLN 154 -9.740 24.873 -10.363 813 HG3 GLN 154 1HG GLN 154 -9.170 24.434 -11.974 814 HE21 GLN 154 1HE2 GLN 154 -11.883 24.203 -11.627 815 HE22 GLN 154 2HE2 GLN 154 -12.342 22.576 -11.468 816 H ARG 155 H ARG 155 -7.838 24.309 -7.940 817 HA ARG 155 HA ARG 155 -7.439 27.008 -7.044 818 HB2 ARG 155 2HB ARG 155 -9.878 26.483 -8.417 819 HB3 ARG 155 1HB ARG 155 -10.261 26.721 -6.709 820 HG2 ARG 155 2HG ARG 155 -9.158 28.860 -6.680 821 HG3 ARG 155 1HG ARG 155 -8.486 28.597 -8.290 822 HD2 ARG 155 2HD ARG 155 -10.301 29.675 -9.087 823 HD3 ARG 155 1HD ARG 155 -11.217 28.231 -8.655 824 HE ARG 155 HE ARG 155 -10.987 29.853 -6.331 825 HH11 ARG 155 1HH1 ARG 155 -12.740 31.148 -5.729 826 HH12 ARG 155 2HH1 ARG 155 -13.937 31.563 -6.910 827 HH21 ARG 155 1HH2 ARG 155 -12.393 29.820 -9.478 828 HH22 ARG 155 2HH2 ARG 155 -13.741 30.811 -9.032 829 HA PRO 156 HA PRO 156 -9.065 24.350 -3.521 830 HB2 PRO 156 2HB PRO 156 -10.891 22.433 -3.888 831 HB3 PRO 156 1HB PRO 156 -11.324 24.142 -4.085 832 HG2 PRO 156 2HG PRO 156 -10.965 22.054 -6.130 833 HG3 PRO 156 1HG PRO 156 -11.929 23.536 -6.186 834 HD2 PRO 156 2HD PRO 156 -9.255 23.101 -7.239 835 HD3 PRO 156 1HD PRO 156 -10.271 24.547 -7.367 836 H ASP 157 H ASP 157 -9.897 21.338 -4.927 837 HA ASP 157 HA ASP 157 -7.194 20.234 -4.970 838 HB2 ASP 157 2HB ASP 157 -7.617 18.626 -3.124 839 HB3 ASP 157 1HB ASP 157 -7.628 20.293 -2.551 840 H ASP 158 H ASP 158 -8.315 19.909 -7.176 841 HA ASP 158 HA ASP 158 -10.529 18.200 -7.570 842 HB2 ASP 158 2HB ASP 158 -9.233 19.395 -9.389 843 HB3 ASP 158 1HB ASP 158 -7.983 18.159 -9.229 844 H VAL 159 H VAL 159 -10.570 15.809 -7.905 845 HA VAL 159 HA VAL 159 -8.220 14.428 -6.671 846 HB VAL 159 HB VAL 159 -9.733 13.018 -5.359 847 HG11 VAL 159 1HG1 VAL 159 -10.681 15.811 -4.812 848 HG12 VAL 159 2HG1 VAL 159 -8.958 15.456 -4.683 849 HG13 VAL 159 3HG1 VAL 159 -10.114 14.581 -3.679 850 HG21 VAL 159 1HG2 VAL 159 -11.807 14.618 -6.847 851 HG22 VAL 159 2HG2 VAL 159 -12.182 13.939 -5.264 852 HG23 VAL 159 3HG2 VAL 159 -11.726 12.874 -6.594 853 H LEU 160 H LEU 160 -7.903 12.259 -7.314 854 HA LEU 160 HA LEU 160 -9.494 11.383 -9.700 855 HB2 LEU 160 2HB LEU 160 -7.034 12.071 -10.099 856 HB3 LEU 160 1HB LEU 160 -6.616 10.631 -9.172 857 HG LEU 160 HG LEU 160 -8.036 9.278 -10.741 858 HD11 LEU 160 1HD1 LEU 160 -8.616 11.966 -11.729 859 HD12 LEU 160 2HD1 LEU 160 -9.469 10.453 -12.034 860 HD13 LEU 160 3HD1 LEU 160 -8.070 10.890 -13.016 861 HD21 LEU 160 1HD2 LEU 160 -5.936 8.916 -11.513 862 HD22 LEU 160 2HD2 LEU 160 -5.490 10.610 -11.320 863 HD23 LEU 160 3HD2 LEU 160 -6.328 10.082 -12.777 864 H LEU 161 H LEU 161 -9.970 9.094 -9.760 865 HA LEU 161 HA LEU 161 -9.098 7.506 -7.406 866 HB2 LEU 161 2HB LEU 161 -11.304 8.623 -6.884 867 HB3 LEU 161 1HB LEU 161 -12.010 7.685 -8.203 868 HG LEU 161 HG LEU 161 -10.742 5.699 -6.894 869 HD11 LEU 161 1HD1 LEU 161 -9.883 7.176 -5.133 870 HD12 LEU 161 2HD1 LEU 161 -11.059 6.048 -4.457 871 HD13 LEU 161 3HD1 LEU 161 -11.520 7.721 -4.770 872 HD21 LEU 161 1HD2 LEU 161 -13.459 6.885 -6.249 873 HD22 LEU 161 2HD2 LEU 161 -12.946 5.264 -5.775 874 HD23 LEU 161 3HD2 LEU 161 -13.100 5.678 -7.484 875 H HIS 162 H HIS 162 -7.937 6.750 -9.579 876 HA HIS 162 HA HIS 162 -9.574 5.056 -11.312 877 HB2 HIS 162 2HB HIS 162 -6.572 5.373 -11.019 878 HB3 HIS 162 1HB HIS 162 -7.338 4.336 -12.223 879 HD1 HIS 162 1HD HIS 162 -5.696 6.594 -13.334 880 HD2 HIS 162 2HD HIS 162 -9.722 7.077 -12.354 881 HE1 HIS 162 1HE HIS 162 -6.528 8.580 -14.671 882 HE2 HIS 162 2HE HIS 162 -8.976 8.882 -14.082 883 H ARG 163 H ARG 163 -9.626 2.762 -11.288 884 HA ARG 163 HA ARG 163 -8.567 1.512 -8.782 885 HB2 ARG 163 2HB ARG 163 -11.060 0.853 -10.371 886 HB3 ARG 163 1HB ARG 163 -10.475 -0.080 -8.992 887 HG2 ARG 163 2HG ARG 163 -10.609 1.985 -7.591 888 HG3 ARG 163 1HG ARG 163 -11.317 2.832 -8.967 889 HD2 ARG 163 2HD ARG 163 -12.473 0.391 -7.588 890 HD3 ARG 163 1HD ARG 163 -13.097 2.039 -7.486 891 HE ARG 163 HE ARG 163 -13.129 1.559 -10.188 892 HH11 ARG 163 1HH1 ARG 163 -14.845 0.567 -11.274 893 HH12 ARG 163 2HH1 ARG 163 -15.887 -0.517 -10.414 894 HH21 ARG 163 1HH2 ARG 163 -14.205 -0.164 -7.402 895 HH22 ARG 163 2HH2 ARG 163 -15.524 -0.931 -8.221 896 H THR 164 H THR 164 -7.750 -0.651 -8.949 897 HA THR 164 HA THR 164 -6.494 -1.245 -11.525 898 HB THR 164 HB THR 164 -6.483 -2.721 -8.884 899 HG1 THR 164 1HG THR 164 -4.156 -1.947 -9.296 900 HG21 THR 164 1HG2 THR 164 -5.911 -4.470 -10.239 901 HG22 THR 164 2HG2 THR 164 -4.339 -3.670 -10.226 902 HG23 THR 164 3HG2 THR 164 -5.446 -3.416 -11.574 903 H HIS 165 H HIS 165 -7.104 -2.849 -12.957 904 HA HIS 165 HA HIS 165 -9.560 -4.409 -12.247 905 HB2 HIS 165 2HB HIS 165 -8.669 -3.383 -14.960 906 HB3 HIS 165 1HB HIS 165 -10.098 -4.375 -14.667 907 HD1 HIS 165 1HD HIS 165 -11.824 -3.254 -12.807 908 HD2 HIS 165 2HD HIS 165 -9.192 -0.676 -14.763 909 HE1 HIS 165 1HE HIS 165 -12.760 -0.916 -12.515 910 HE2 HIS 165 2HE HIS 165 -11.166 0.660 -13.702 911 H ASP 166 H ASP 166 -9.481 -6.617 -12.604 912 HA ASP 166 HA ASP 166 -6.925 -7.887 -12.851 913 HB2 ASP 166 2HB ASP 166 -9.731 -8.988 -13.176 914 HB3 ASP 166 1HB ASP 166 -8.278 -9.986 -13.108 Start of MODEL 9 1 H1 GLN 45 1HT GLN 45 3.232 18.106 -2.606 2 H2 GLN 45 2HT GLN 45 4.431 18.116 -3.810 3 H3 GLN 45 3HT GLN 45 3.146 19.226 -3.875 4 HA GLN 45 HA GLN 45 3.921 20.361 -1.937 5 HB2 GLN 45 2HB GLN 45 4.770 18.291 -0.814 6 HB3 GLN 45 1HB GLN 45 6.152 18.309 -1.910 7 HG2 GLN 45 2HG GLN 45 6.804 20.529 -1.083 8 HG3 GLN 45 1HG GLN 45 5.404 20.551 -0.010 9 HE21 GLN 45 1HE2 GLN 45 7.818 20.794 1.271 10 HE22 GLN 45 2HE2 GLN 45 8.250 19.345 2.043 11 H ASP 46 H ASP 46 6.829 18.982 -3.428 12 HA ASP 46 HA ASP 46 7.936 21.487 -4.155 13 HB2 ASP 46 2HB ASP 46 8.360 18.736 -5.352 14 HB3 ASP 46 1HB ASP 46 9.345 20.141 -5.757 15 H LEU 47 H LEU 47 5.939 19.229 -6.030 16 HA LEU 47 HA LEU 47 5.803 21.169 -8.262 17 HB2 LEU 47 2HB LEU 47 4.475 18.455 -7.989 18 HB3 LEU 47 1HB LEU 47 4.664 19.395 -9.470 19 HG LEU 47 HG LEU 47 6.964 18.342 -7.799 20 HD11 LEU 47 1HD1 LEU 47 6.019 16.423 -8.774 21 HD12 LEU 47 2HD1 LEU 47 7.240 16.907 -9.951 22 HD13 LEU 47 3HD1 LEU 47 5.541 17.285 -10.236 23 HD21 LEU 47 1HD2 LEU 47 7.831 20.171 -8.958 24 HD22 LEU 47 2HD2 LEU 47 6.714 19.975 -10.308 25 HD23 LEU 47 3HD2 LEU 47 8.084 18.879 -10.131 26 H GLN 48 H GLN 48 3.897 22.356 -8.686 27 HA GLN 48 HA GLN 48 2.143 22.861 -6.531 28 HB2 GLN 48 2HB GLN 48 2.481 24.301 -8.616 29 HB3 GLN 48 1HB GLN 48 1.351 23.212 -9.425 30 HG2 GLN 48 2HG GLN 48 0.034 25.027 -8.579 31 HG3 GLN 48 1HG GLN 48 -0.265 23.657 -7.507 32 HE21 GLN 48 1HE2 GLN 48 0.846 23.673 -5.369 33 HE22 GLN 48 2HE2 GLN 48 1.405 25.134 -4.710 34 H ALA 49 H ALA 49 1.787 20.644 -9.280 35 HA ALA 49 HA ALA 49 -0.862 19.761 -8.470 36 HB1 ALA 49 1HB ALA 49 -0.594 18.037 -10.153 37 HB2 ALA 49 2HB ALA 49 1.153 18.276 -10.186 38 HB3 ALA 49 3HB ALA 49 0.079 19.529 -10.808 39 H THR 50 H THR 50 -1.359 17.895 -7.200 40 HA THR 50 HA THR 50 1.011 16.731 -5.799 41 HB THR 50 HB THR 50 -1.800 16.937 -4.714 42 HG1 THR 50 1HG THR 50 -0.713 18.980 -5.044 43 HG21 THR 50 1HG2 THR 50 0.838 15.944 -3.695 44 HG22 THR 50 2HG2 THR 50 -0.768 15.247 -3.501 45 HG23 THR 50 3HG2 THR 50 -0.298 16.664 -2.558 46 H GLU 51 H GLU 51 1.041 14.528 -5.393 47 HA GLU 51 HA GLU 51 -0.952 12.929 -6.930 48 HB2 GLU 51 2HB GLU 51 1.946 12.282 -6.355 49 HB3 GLU 51 1HB GLU 51 0.840 11.323 -7.340 50 HG2 GLU 51 2HG GLU 51 0.582 13.278 -8.878 51 HG3 GLU 51 1HG GLU 51 1.790 14.141 -7.928 52 H ALA 52 H ALA 52 -1.888 11.186 -5.850 53 HA ALA 52 HA ALA 52 -0.735 10.320 -3.277 54 HB1 ALA 52 1HB ALA 52 -2.178 12.045 -2.443 55 HB2 ALA 52 2HB ALA 52 -3.061 10.535 -2.221 56 HB3 ALA 52 3HB ALA 52 -3.462 11.600 -3.567 57 H ASN 53 H ASN 53 -0.613 8.156 -3.767 58 HA ASN 53 HA ASN 53 -2.902 7.002 -5.253 59 HB2 ASN 53 2HB ASN 53 -0.120 5.932 -4.808 60 HB3 ASN 53 1HB ASN 53 -1.401 5.034 -5.618 61 HD21 ASN 53 1HD2 ASN 53 -2.593 7.339 -6.984 62 HD22 ASN 53 2HD2 ASN 53 -1.492 7.836 -8.177 63 H CYS 54 H CYS 54 -4.195 5.431 -4.439 64 HA CYS 54 HA CYS 54 -3.569 4.464 -1.682 65 HB2 CYS 54 2HB CYS 54 -6.412 4.758 -2.236 66 HB3 CYS 54 1HB CYS 54 -5.483 5.393 -0.883 67 H THR 55 H THR 55 -3.006 2.371 -2.384 68 HA THR 55 HA THR 55 -5.151 0.990 -3.926 69 HB THR 55 HB THR 55 -3.681 0.499 -5.550 70 HG1 THR 55 1HG THR 55 -1.864 -0.330 -3.542 71 HG21 THR 55 1HG2 THR 55 -2.710 2.738 -4.851 72 HG22 THR 55 2HG2 THR 55 -1.572 1.658 -5.648 73 HG23 THR 55 3HG2 THR 55 -1.531 1.844 -3.898 74 H VAL 56 H VAL 56 -5.518 -1.153 -3.537 75 HA VAL 56 HA VAL 56 -4.614 -2.131 -0.892 76 HB VAL 56 HB VAL 56 -6.845 -2.827 -2.791 77 HG11 VAL 56 1HG1 VAL 56 -5.506 -4.624 -0.783 78 HG12 VAL 56 2HG1 VAL 56 -6.078 -5.005 -2.408 79 HG13 VAL 56 3HG1 VAL 56 -7.235 -4.779 -1.096 80 HG21 VAL 56 1HG2 VAL 56 -7.220 -2.865 0.131 81 HG22 VAL 56 2HG2 VAL 56 -8.171 -2.054 -1.115 82 HG23 VAL 56 3HG2 VAL 56 -6.695 -1.307 -0.505 83 H LEU 57 H LEU 57 -2.647 -3.130 -1.111 84 HA LEU 57 HA LEU 57 -1.495 -4.113 -3.431 85 HB2 LEU 57 2HB LEU 57 -0.378 -3.942 -1.187 86 HB3 LEU 57 1HB LEU 57 -1.208 -5.422 -0.717 87 HG LEU 57 HG LEU 57 -0.174 -6.579 -2.675 88 HD11 LEU 57 1HD1 LEU 57 0.518 -5.142 -4.299 89 HD12 LEU 57 2HD1 LEU 57 1.997 -5.047 -3.342 90 HD13 LEU 57 3HD1 LEU 57 0.749 -3.816 -3.160 91 HD21 LEU 57 1HD2 LEU 57 1.465 -7.184 -1.251 92 HD22 LEU 57 2HD2 LEU 57 1.005 -5.824 -0.225 93 HD23 LEU 57 3HD2 LEU 57 2.265 -5.625 -1.443 94 H SER 58 H SER 58 -1.373 -6.229 -4.380 95 HA SER 58 HA SER 58 -3.889 -7.743 -4.042 96 HB2 SER 58 2HB SER 58 -3.368 -8.755 -6.169 97 HB3 SER 58 1HB SER 58 -3.051 -7.031 -6.330 98 HG SER 58 HG SER 58 -1.079 -7.560 -6.790 99 H VAL 59 H VAL 59 -3.755 -10.109 -3.795 100 HA VAL 59 HA VAL 59 -1.411 -10.815 -2.131 101 HB VAL 59 HB VAL 59 -3.927 -12.435 -2.620 102 HG11 VAL 59 1HG1 VAL 59 -2.182 -12.468 -0.170 103 HG12 VAL 59 2HG1 VAL 59 -1.724 -13.403 -1.594 104 HG13 VAL 59 3HG1 VAL 59 -3.257 -13.725 -0.783 105 HG21 VAL 59 1HG2 VAL 59 -4.297 -10.068 -1.673 106 HG22 VAL 59 2HG2 VAL 59 -3.391 -10.610 -0.260 107 HG23 VAL 59 3HG2 VAL 59 -4.904 -11.402 -0.693 108 H GLN 60 H GLN 60 0.256 -11.763 -3.171 109 HA GLN 60 HA GLN 60 -0.315 -13.888 -5.152 110 HB2 GLN 60 2HB GLN 60 1.530 -11.540 -5.676 111 HB3 GLN 60 1HB GLN 60 1.348 -12.946 -6.725 112 HG2 GLN 60 2HG GLN 60 -1.081 -12.416 -6.948 113 HG3 GLN 60 1HG GLN 60 -0.819 -10.954 -5.998 114 HE21 GLN 60 1HE2 GLN 60 0.052 -9.127 -7.074 115 HE22 GLN 60 2HE2 GLN 60 0.519 -9.133 -8.707 116 H GLN 61 H GLN 61 1.534 -15.317 -5.472 117 HA GLN 61 HA GLN 61 3.047 -15.754 -3.051 118 HB2 GLN 61 2HB GLN 61 3.327 -16.951 -5.824 119 HB3 GLN 61 1HB GLN 61 4.179 -17.528 -4.395 120 HG2 GLN 61 2HG GLN 61 2.238 -18.913 -4.636 121 HG3 GLN 61 1HG GLN 61 1.917 -17.819 -3.288 122 HE21 GLN 61 1HE2 GLN 61 0.202 -16.312 -3.513 123 HE22 GLN 61 2HE2 GLN 61 -0.764 -16.204 -4.900 124 H ILE 62 H ILE 62 5.416 -15.738 -2.917 125 HA ILE 62 HA ILE 62 6.623 -13.309 -3.546 126 HB ILE 62 HB ILE 62 7.503 -15.126 -2.005 127 HG12 ILE 62 2HG1 ILE 62 9.721 -14.321 -3.857 128 HG13 ILE 62 1HG1 ILE 62 8.809 -13.053 -3.037 129 HG21 ILE 62 1HG2 ILE 62 8.805 -16.188 -4.517 130 HG22 ILE 62 2HG2 ILE 62 7.316 -16.876 -3.867 131 HG23 ILE 62 3HG2 ILE 62 8.795 -16.911 -2.908 132 HD11 ILE 62 1HD1 ILE 62 9.259 -14.178 -0.864 133 HD12 ILE 62 2HD1 ILE 62 10.743 -13.682 -1.679 134 HD13 ILE 62 3HD1 ILE 62 10.240 -15.372 -1.710 135 H GLY 63 H GLY 63 8.820 -13.374 -5.002 136 HA2 GLY 63 2HA GLY 63 9.773 -13.908 -7.156 137 HA3 GLY 63 1HA GLY 63 8.235 -14.632 -7.626 138 H GLU 64 H GLU 64 7.526 -11.819 -6.058 139 HA GLU 64 HA GLU 64 7.474 -10.262 -8.606 140 HB2 GLU 64 2HB GLU 64 5.486 -10.265 -6.318 141 HB3 GLU 64 1HB GLU 64 5.420 -9.174 -7.703 142 HG2 GLU 64 2HG GLU 64 5.275 -11.133 -9.214 143 HG3 GLU 64 1HG GLU 64 5.280 -12.200 -7.810 144 H VAL 65 H VAL 65 8.107 -8.090 -8.477 145 HA VAL 65 HA VAL 65 9.373 -7.304 -5.894 146 HB VAL 65 HB VAL 65 10.791 -5.819 -7.219 147 HG11 VAL 65 1HG1 VAL 65 12.140 -7.476 -8.168 148 HG12 VAL 65 2HG1 VAL 65 10.760 -8.397 -8.765 149 HG13 VAL 65 3HG1 VAL 65 11.154 -8.412 -7.046 150 HG21 VAL 65 1HG2 VAL 65 8.713 -6.359 -9.219 151 HG22 VAL 65 2HG2 VAL 65 10.347 -6.502 -9.867 152 HG23 VAL 65 3HG2 VAL 65 9.831 -4.999 -9.103 153 H PHE 66 H PHE 66 8.811 -5.350 -4.942 154 HA PHE 66 HA PHE 66 6.661 -3.778 -6.293 155 HB2 PHE 66 2HB PHE 66 6.981 -4.424 -3.352 156 HB3 PHE 66 1HB PHE 66 5.774 -3.318 -4.011 157 HD1 PHE 66 1HD PHE 66 6.982 -6.836 -4.132 158 HD2 PHE 66 2HD PHE 66 3.762 -4.126 -4.972 159 HE1 PHE 66 1HE PHE 66 5.496 -8.755 -4.625 160 HE2 PHE 66 2HE PHE 66 2.276 -6.044 -5.471 161 HZ PHE 66 HZ PHE 66 3.141 -8.362 -5.297 162 H GLU 67 H GLU 67 6.619 -1.491 -5.717 163 HA GLU 67 HA GLU 67 9.338 -0.488 -4.990 164 HB2 GLU 67 2HB GLU 67 8.519 0.076 -7.276 165 HB3 GLU 67 1HB GLU 67 7.145 0.908 -6.549 166 HG2 GLU 67 2HG GLU 67 8.733 2.388 -5.323 167 HG3 GLU 67 1HG GLU 67 10.070 1.602 -6.161 168 H CYS 68 H CYS 68 9.536 0.938 -3.303 169 HA CYS 68 HA CYS 68 7.039 1.620 -1.809 170 HB2 CYS 68 2HB CYS 68 9.706 0.723 -0.996 171 HB3 CYS 68 1HB CYS 68 9.203 2.183 -0.145 172 H THR 69 H THR 69 7.020 3.857 -0.866 173 HA THR 69 HA THR 69 8.664 5.729 -2.522 174 HB THR 69 HB THR 69 6.812 6.980 -3.021 175 HG1 THR 69 1HG THR 69 6.134 7.671 -1.107 176 HG21 THR 69 1HG2 THR 69 5.310 4.488 -2.213 177 HG22 THR 69 2HG2 THR 69 6.396 4.511 -3.604 178 HG23 THR 69 3HG2 THR 69 4.982 5.567 -3.570 179 H PHE 70 H PHE 70 9.331 7.674 -1.529 180 HA PHE 70 HA PHE 70 8.696 8.150 1.300 181 HB2 PHE 70 2HB PHE 70 10.977 8.085 2.087 182 HB3 PHE 70 1HB PHE 70 10.628 6.530 1.330 183 HD1 PHE 70 1HD PHE 70 11.532 5.993 -0.918 184 HD2 PHE 70 2HD PHE 70 12.529 9.647 1.107 185 HE1 PHE 70 1HE PHE 70 13.423 6.350 -2.485 186 HE2 PHE 70 2HE PHE 70 14.417 10.003 -0.460 187 HZ PHE 70 HZ PHE 70 14.864 8.352 -2.256 188 H THR 71 H THR 71 9.592 10.264 2.000 189 HA THR 71 HA THR 71 10.393 12.001 -0.280 190 HB THR 71 HB THR 71 8.397 12.783 1.859 191 HG1 THR 71 1HG THR 71 8.017 12.077 -0.863 192 HG21 THR 71 1HG2 THR 71 8.723 14.866 1.090 193 HG22 THR 71 2HG2 THR 71 8.317 14.339 -0.542 194 HG23 THR 71 3HG2 THR 71 9.986 14.260 0.021 195 H CYS 72 H CYS 72 11.898 13.586 0.251 196 HA CYS 72 HA CYS 72 12.734 13.726 3.113 197 HB2 CYS 72 2HB CYS 72 15.062 14.214 1.718 198 HB3 CYS 72 1HB CYS 72 14.635 12.677 2.455 199 H GLY 73 H GLY 73 14.068 15.803 3.488 200 HA2 GLY 73 2HA GLY 73 12.555 18.016 2.295 201 HA3 GLY 73 1HA GLY 73 13.729 18.153 3.605 202 H ALA 74 H ALA 74 14.007 20.084 1.838 203 HA ALA 74 HA ALA 74 15.655 21.098 0.497 204 HB1 ALA 74 1HB ALA 74 17.073 19.266 1.834 205 HB2 ALA 74 2HB ALA 74 17.772 20.186 0.502 206 HB3 ALA 74 3HB ALA 74 17.180 18.549 0.227 207 H ASP 75 H ASP 75 13.327 19.809 -0.614 208 HA ASP 75 HA ASP 75 12.477 19.136 -2.697 209 HB2 ASP 75 2HB ASP 75 13.851 21.152 -3.384 210 HB3 ASP 75 1HB ASP 75 15.170 20.042 -3.758 211 H CYS 76 H CYS 76 13.673 17.156 -1.104 212 HA CYS 76 HA CYS 76 15.115 15.454 -3.091 213 HB2 CYS 76 2HB CYS 76 16.456 15.715 -1.144 214 HB3 CYS 76 1HB CYS 76 15.072 15.510 -0.079 215 H ARG 77 H ARG 77 13.725 14.078 -4.075 216 HA ARG 77 HA ARG 77 11.756 12.630 -2.368 217 HB2 ARG 77 2HB ARG 77 10.255 12.709 -4.500 218 HB3 ARG 77 1HB ARG 77 10.313 14.133 -3.463 219 HG2 ARG 77 2HG ARG 77 12.434 14.104 -5.490 220 HG3 ARG 77 1HG ARG 77 10.812 14.120 -6.183 221 HD2 ARG 77 2HD ARG 77 11.628 16.005 -3.962 222 HD3 ARG 77 1HD ARG 77 11.839 16.410 -5.666 223 HE ARG 77 HE ARG 77 9.335 16.449 -4.233 224 HH11 ARG 77 1HH1 ARG 77 7.467 16.837 -5.448 225 HH12 ARG 77 2HH1 ARG 77 7.515 16.645 -7.169 226 HH21 ARG 77 1HH2 ARG 77 10.855 15.714 -7.238 227 HH22 ARG 77 2HH2 ARG 77 9.432 16.010 -8.183 228 H GLY 78 H GLY 78 11.495 10.416 -2.980 229 HA2 GLY 78 2HA GLY 78 12.502 9.398 -5.490 230 HA3 GLY 78 1HA GLY 78 13.673 9.120 -4.200 231 H THR 79 H THR 79 12.770 6.888 -5.294 232 HA THR 79 HA THR 79 10.804 5.832 -3.316 233 HB THR 79 HB THR 79 9.947 4.324 -5.081 234 HG1 THR 79 1HG THR 79 11.990 5.597 -6.481 235 HG21 THR 79 1HG2 THR 79 9.850 7.300 -5.397 236 HG22 THR 79 2HG2 THR 79 8.571 6.182 -4.923 237 HG23 THR 79 3HG2 THR 79 9.068 6.286 -6.610 238 H SER 80 H SER 80 11.074 3.487 -2.915 239 HA SER 80 HA SER 80 13.868 2.555 -3.462 240 HB2 SER 80 2HB SER 80 13.905 1.546 -1.246 241 HB3 SER 80 1HB SER 80 13.505 3.253 -1.082 242 HG SER 80 HG SER 80 11.401 2.723 -0.739 243 H GLN 81 H GLN 81 14.059 0.160 -3.497 244 HA GLN 81 HA GLN 81 11.505 -1.114 -4.381 245 HB2 GLN 81 2HB GLN 81 14.342 -1.827 -5.178 246 HB3 GLN 81 1HB GLN 81 12.867 -2.564 -5.805 247 HG2 GLN 81 2HG GLN 81 13.439 0.399 -6.025 248 HG3 GLN 81 1HG GLN 81 13.890 -0.758 -7.277 249 HE21 GLN 81 1HE2 GLN 81 11.151 -2.070 -5.974 250 HE22 GLN 81 2HE2 GLN 81 9.983 -1.365 -6.983 251 H TYR 82 H TYR 82 10.927 -3.057 -3.443 252 HA TYR 82 HA TYR 82 12.878 -4.415 -1.669 253 HB2 TYR 82 2HB TYR 82 10.237 -3.215 -0.821 254 HB3 TYR 82 1HB TYR 82 10.961 -4.547 0.074 255 HD1 TYR 82 1HD TYR 82 10.695 -1.089 -0.027 256 HD2 TYR 82 2HD TYR 82 13.653 -4.166 0.451 257 HE1 TYR 82 1HE TYR 82 12.183 0.520 1.130 258 HE2 TYR 82 2HE TYR 82 15.141 -2.556 1.605 259 HH TYR 82 HH TYR 82 15.415 -0.464 2.277 260 HA PRO 83 HA PRO 83 11.175 -8.118 -3.352 261 HB2 PRO 83 2HB PRO 83 10.824 -9.586 -0.965 262 HB3 PRO 83 1HB PRO 83 12.267 -9.570 -1.992 263 HG2 PRO 83 2HG PRO 83 11.728 -8.129 0.527 264 HG3 PRO 83 1HG PRO 83 13.261 -8.708 -0.143 265 HD2 PRO 83 2HD PRO 83 12.577 -6.082 -0.150 266 HD3 PRO 83 1HD PRO 83 13.575 -6.803 -1.430 267 H CYS 84 H CYS 84 9.337 -9.898 -2.110 268 HA CYS 84 HA CYS 84 6.868 -8.368 -2.476 269 HB2 CYS 84 2HB CYS 84 6.096 -10.375 -3.130 270 HB3 CYS 84 1HB CYS 84 7.657 -11.089 -2.723 271 H VAL 85 H VAL 85 5.271 -8.039 -0.900 272 HA VAL 85 HA VAL 85 6.063 -8.640 1.918 273 HB VAL 85 HB VAL 85 4.888 -6.440 2.488 274 HG11 VAL 85 1HG1 VAL 85 7.289 -6.615 2.640 275 HG12 VAL 85 2HG1 VAL 85 6.916 -5.096 1.823 276 HG13 VAL 85 3HG1 VAL 85 7.458 -6.490 0.889 277 HG21 VAL 85 1HG2 VAL 85 5.556 -5.436 -0.214 278 HG22 VAL 85 2HG2 VAL 85 4.197 -5.026 0.833 279 HG23 VAL 85 3HG2 VAL 85 4.146 -6.494 -0.143 280 H GLN 86 H GLN 86 4.085 -8.454 3.397 281 HA GLN 86 HA GLN 86 2.083 -10.264 2.560 282 HB2 GLN 86 2HB GLN 86 1.781 -8.125 4.681 283 HB3 GLN 86 1HB GLN 86 0.896 -9.646 4.569 284 HG2 GLN 86 2HG GLN 86 3.891 -9.380 4.966 285 HG3 GLN 86 1HG GLN 86 2.730 -9.816 6.218 286 HE21 GLN 86 1HE2 GLN 86 4.990 -11.289 4.450 287 HE22 GLN 86 2HE2 GLN 86 4.243 -12.780 4.131 288 H VAL 87 H VAL 87 -0.350 -8.913 3.321 289 HA VAL 87 HA VAL 87 -0.685 -7.081 0.973 290 HB VAL 87 HB VAL 87 -1.763 -9.282 0.632 291 HG11 VAL 87 1HG1 VAL 87 -3.590 -8.553 2.925 292 HG12 VAL 87 2HG1 VAL 87 -2.164 -9.561 3.161 293 HG13 VAL 87 3HG1 VAL 87 -3.454 -10.099 2.086 294 HG21 VAL 87 1HG2 VAL 87 -2.771 -6.879 0.039 295 HG22 VAL 87 2HG2 VAL 87 -4.034 -7.411 1.141 296 HG23 VAL 87 3HG2 VAL 87 -3.668 -8.355 -0.299 297 H TYR 88 H TYR 88 -2.008 -5.280 1.251 298 HA TYR 88 HA TYR 88 -3.673 -4.789 3.507 299 HB2 TYR 88 2HB TYR 88 -1.464 -4.743 4.664 300 HB3 TYR 88 1HB TYR 88 -0.983 -3.428 3.616 301 HD1 TYR 88 1HD TYR 88 -0.594 -2.621 6.134 302 HD2 TYR 88 2HD TYR 88 -4.458 -2.941 4.254 303 HE1 TYR 88 1HE TYR 88 -1.531 -0.999 7.746 304 HE2 TYR 88 2HE TYR 88 -5.371 -1.329 5.866 305 HH TYR 88 HH TYR 88 -4.987 -0.172 7.733 306 H VAL 89 H VAL 89 -2.272 -1.899 3.353 307 HA VAL 89 HA VAL 89 -3.395 -1.159 0.701 308 HB VAL 89 HB VAL 89 -5.114 -0.739 2.467 309 HG11 VAL 89 1HG1 VAL 89 -4.704 0.687 4.279 310 HG12 VAL 89 2HG1 VAL 89 -3.319 1.445 3.494 311 HG13 VAL 89 3HG1 VAL 89 -3.176 -0.184 4.150 312 HG21 VAL 89 1HG2 VAL 89 -3.984 1.158 0.576 313 HG22 VAL 89 2HG2 VAL 89 -4.731 1.997 1.936 314 HG23 VAL 89 3HG2 VAL 89 -5.678 0.861 0.974 315 H ASN 90 H ASN 90 -2.155 0.320 -0.365 316 HA ASN 90 HA ASN 90 0.279 1.258 1.010 317 HB2 ASN 90 2HB ASN 90 -0.516 1.659 -1.879 318 HB3 ASN 90 1HB ASN 90 1.095 1.784 -1.186 319 HD21 ASN 90 1HD2 ASN 90 0.604 -0.653 0.542 320 HD22 ASN 90 2HD2 ASN 90 0.734 -1.974 -0.515 321 H ASN 91 H ASN 91 -0.021 3.142 2.137 322 HA ASN 91 HA ASN 91 -1.993 5.108 1.168 323 HB2 ASN 91 2HB ASN 91 -1.789 4.608 3.601 324 HB3 ASN 91 1HB ASN 91 -0.130 5.205 3.564 325 HD21 ASN 91 1HD2 ASN 91 -3.469 6.296 2.735 326 HD22 ASN 91 2HD2 ASN 91 -3.203 7.916 3.169 327 H SER 92 H SER 92 -0.875 5.665 -0.811 328 HA SER 92 HA SER 92 1.783 6.892 -0.540 329 HB2 SER 92 2HB SER 92 0.658 7.236 -3.150 330 HB3 SER 92 1HB SER 92 2.031 6.254 -2.666 331 HG SER 92 HG SER 92 0.398 4.695 -1.941 332 H GLU 93 H GLU 93 -0.993 8.015 0.408 333 HA GLU 93 HA GLU 93 -1.085 10.557 -1.064 334 HB2 GLU 93 2HB GLU 93 -2.946 11.114 0.313 335 HB3 GLU 93 1HB GLU 93 -3.109 9.381 0.032 336 HG2 GLU 93 2HG GLU 93 -1.884 9.000 2.206 337 HG3 GLU 93 1HG GLU 93 -1.990 10.735 2.503 338 H SER 94 H SER 94 0.675 9.131 1.409 339 HA SER 94 HA SER 94 1.797 11.770 2.222 340 HB2 SER 94 2HB SER 94 1.851 11.153 4.513 341 HB3 SER 94 1HB SER 94 0.248 10.657 3.976 342 HG SER 94 HG SER 94 0.844 8.762 4.663 343 H ASN 95 H ASN 95 2.442 9.359 0.396 344 HA ASN 95 HA ASN 95 4.381 8.268 -0.318 345 HB2 ASN 95 2HB ASN 95 5.842 10.030 1.668 346 HB3 ASN 95 1HB ASN 95 6.505 9.255 0.230 347 HD21 ASN 95 1HD2 ASN 95 4.562 9.836 -1.702 348 HD22 ASN 95 2HD2 ASN 95 4.449 11.515 -1.913 349 H SER 96 H SER 96 2.910 6.905 1.626 350 HA SER 96 HA SER 96 5.101 5.421 2.973 351 HB2 SER 96 2HB SER 96 3.993 7.158 4.548 352 HB3 SER 96 1HB SER 96 2.590 6.092 4.501 353 HG SER 96 HG SER 96 4.506 4.469 4.921 354 H ARG 97 H ARG 97 4.711 3.213 2.985 355 HA ARG 97 HA ARG 97 2.037 2.338 1.988 356 HB2 ARG 97 2HB ARG 97 3.671 1.743 0.355 357 HB3 ARG 97 1HB ARG 97 4.788 1.155 1.588 358 HG2 ARG 97 2HG ARG 97 3.551 -0.787 1.977 359 HG3 ARG 97 1HG ARG 97 2.059 -0.081 1.358 360 HD2 ARG 97 2HD ARG 97 2.869 -1.678 -0.270 361 HD3 ARG 97 1HD ARG 97 3.093 -0.057 -0.929 362 HE ARG 97 HE ARG 97 5.468 -0.870 0.466 363 HH11 ARG 97 1HH1 ARG 97 7.245 -1.505 -0.775 364 HH12 ARG 97 2HH1 ARG 97 7.011 -1.963 -2.430 365 HH21 ARG 97 1HH2 ARG 97 3.585 -1.431 -2.366 366 HH22 ARG 97 2HH2 ARG 97 4.938 -1.920 -3.330 367 H ALA 98 H ALA 98 0.847 1.233 3.442 368 HA ALA 98 HA ALA 98 2.181 0.182 5.870 369 HB1 ALA 98 1HB ALA 98 0.128 0.353 6.940 370 HB2 ALA 98 2HB ALA 98 -0.783 0.076 5.456 371 HB3 ALA 98 3HB ALA 98 -0.025 1.641 5.746 372 H LEU 99 H LEU 99 2.443 -1.975 6.210 373 HA LEU 99 HA LEU 99 1.117 -3.856 4.299 374 HB2 LEU 99 2HB LEU 99 3.084 -5.336 4.657 375 HB3 LEU 99 1HB LEU 99 3.527 -3.788 3.942 376 HG LEU 99 HG LEU 99 3.702 -3.198 6.604 377 HD11 LEU 99 1HD1 LEU 99 3.282 -5.775 6.885 378 HD12 LEU 99 2HD1 LEU 99 4.533 -4.991 7.850 379 HD13 LEU 99 3HD1 LEU 99 4.976 -5.913 6.412 380 HD21 LEU 99 1HD2 LEU 99 5.478 -2.554 5.221 381 HD22 LEU 99 2HD2 LEU 99 5.687 -4.177 4.566 382 HD23 LEU 99 3HD2 LEU 99 6.225 -3.813 6.206 383 H LEU 100 H LEU 100 -0.037 -5.526 5.166 384 HA LEU 100 HA LEU 100 0.094 -5.905 8.132 385 HB2 LEU 100 2HB LEU 100 -1.982 -4.714 7.363 386 HB3 LEU 100 1HB LEU 100 -2.376 -6.127 6.386 387 HG LEU 100 HG LEU 100 -2.249 -7.516 8.494 388 HD11 LEU 100 1HD1 LEU 100 -1.042 -6.311 10.073 389 HD12 LEU 100 2HD1 LEU 100 -2.690 -5.935 10.574 390 HD13 LEU 100 3HD1 LEU 100 -1.774 -4.774 9.615 391 HD21 LEU 100 1HD2 LEU 100 -4.422 -6.912 7.658 392 HD22 LEU 100 2HD2 LEU 100 -4.263 -5.264 8.263 393 HD23 LEU 100 3HD2 LEU 100 -4.446 -6.604 9.395 394 H HIS 101 H HIS 101 -0.123 -8.091 8.841 395 HA HIS 101 HA HIS 101 0.531 -10.070 6.747 396 HB2 HIS 101 2HB HIS 101 0.234 -10.675 9.682 397 HB3 HIS 101 1HB HIS 101 1.258 -11.476 8.492 398 HD1 HIS 101 1HD HIS 101 2.198 -8.542 7.348 399 HD2 HIS 101 2HD HIS 101 2.589 -10.018 11.229 400 HE1 HIS 101 1HE HIS 101 4.083 -7.238 8.425 401 HE2 HIS 101 2HE HIS 101 4.330 -8.128 10.787 402 H SER 102 H SER 102 -1.088 -11.164 5.781 403 HA SER 102 HA SER 102 -3.794 -11.145 6.791 404 HB2 SER 102 2HB SER 102 -4.304 -12.582 4.908 405 HB3 SER 102 1HB SER 102 -3.155 -11.365 4.361 406 HG SER 102 HG SER 102 -2.849 -14.100 4.730 407 H ASP 103 H ASP 103 -1.086 -13.393 6.969 408 HA ASP 103 HA ASP 103 -2.162 -14.705 9.291 409 HB2 ASP 103 2HB ASP 103 -3.642 -15.641 7.427 410 HB3 ASP 103 1HB ASP 103 -2.191 -16.433 6.810 411 H GLU 104 H GLU 104 -0.713 -16.429 10.039 412 HA GLU 104 HA GLU 104 2.050 -15.873 9.494 413 HB2 GLU 104 2HB GLU 104 1.186 -16.832 11.640 414 HB3 GLU 104 1HB GLU 104 0.869 -18.347 10.794 415 HG2 GLU 104 2HG GLU 104 3.281 -18.458 10.164 416 HG3 GLU 104 1HG GLU 104 3.568 -17.004 11.120 417 H HIS 105 H HIS 105 -0.233 -18.228 8.204 418 HA HIS 105 HA HIS 105 1.582 -20.037 7.012 419 HB2 HIS 105 2HB HIS 105 -0.817 -20.479 7.093 420 HB3 HIS 105 1HB HIS 105 -1.130 -19.099 6.039 421 HD1 HIS 105 1HD HIS 105 0.729 -22.430 5.967 422 HD2 HIS 105 2HD HIS 105 -1.000 -19.685 3.350 423 HE1 HIS 105 1HE HIS 105 0.846 -23.473 3.659 424 HE2 HIS 105 2HE HIS 105 -0.206 -21.809 2.056 425 H GLN 106 H GLN 106 0.325 -16.934 5.812 426 HA GLN 106 HA GLN 106 1.493 -17.079 3.213 427 HB2 GLN 106 2HB GLN 106 -0.191 -15.360 3.987 428 HB3 GLN 106 1HB GLN 106 1.114 -14.573 4.873 429 HG2 GLN 106 2HG GLN 106 2.374 -14.271 2.784 430 HG3 GLN 106 1HG GLN 106 1.098 -15.091 1.885 431 HE21 GLN 106 1HE2 GLN 106 1.604 -12.536 1.039 432 HE22 GLN 106 2HE2 GLN 106 0.398 -11.463 1.569 433 H LEU 107 H LEU 107 2.735 -15.893 6.310 434 HA LEU 107 HA LEU 107 5.262 -14.961 5.316 435 HB2 LEU 107 2HB LEU 107 4.307 -14.390 7.565 436 HB3 LEU 107 1HB LEU 107 4.612 -16.049 8.074 437 HG LEU 107 HG LEU 107 7.042 -15.692 7.452 438 HD11 LEU 107 1HD1 LEU 107 7.537 -13.822 6.297 439 HD12 LEU 107 2HD1 LEU 107 7.188 -12.897 7.756 440 HD13 LEU 107 3HD1 LEU 107 5.923 -13.168 6.560 441 HD21 LEU 107 1HD2 LEU 107 7.186 -15.426 9.683 442 HD22 LEU 107 2HD2 LEU 107 5.544 -14.788 9.734 443 HD23 LEU 107 3HD2 LEU 107 6.905 -13.698 9.472 444 H LEU 108 H LEU 108 4.186 -18.073 6.665 445 HA LEU 108 HA LEU 108 6.725 -19.381 6.580 446 HB2 LEU 108 2HB LEU 108 4.665 -20.228 7.767 447 HB3 LEU 108 1HB LEU 108 3.996 -20.644 6.191 448 HG LEU 108 HG LEU 108 6.049 -22.043 5.769 449 HD11 LEU 108 1HD1 LEU 108 6.889 -22.597 8.369 450 HD12 LEU 108 2HD1 LEU 108 6.766 -20.839 8.334 451 HD13 LEU 108 3HD1 LEU 108 7.788 -21.676 7.165 452 HD21 LEU 108 1HD2 LEU 108 4.459 -23.549 6.362 453 HD22 LEU 108 2HD2 LEU 108 3.881 -22.540 7.689 454 HD23 LEU 108 3HD2 LEU 108 5.277 -23.594 7.924 455 H THR 109 H THR 109 4.220 -18.832 4.179 456 HA THR 109 HA THR 109 5.308 -20.606 2.183 457 HB THR 109 HB THR 109 3.362 -18.300 2.126 458 HG1 THR 109 1HG THR 109 1.965 -20.076 1.596 459 HG21 THR 109 1HG2 THR 109 4.303 -18.175 -0.021 460 HG22 THR 109 2HG2 THR 109 2.888 -19.203 -0.237 461 HG23 THR 109 3HG2 THR 109 4.494 -19.924 -0.137 462 H ASN 110 H ASN 110 5.688 -17.159 2.921 463 HA ASN 110 HA ASN 110 8.005 -17.119 1.041 464 HB2 ASN 110 2HB ASN 110 7.382 -14.801 0.413 465 HB3 ASN 110 1HB ASN 110 6.151 -15.969 -0.061 466 HD21 ASN 110 1HD2 ASN 110 4.545 -14.161 0.020 467 HD22 ASN 110 2HD2 ASN 110 3.939 -13.646 1.519 468 HA PRO 111 HA PRO 111 8.976 -15.769 5.476 469 HB2 PRO 111 2HB PRO 111 11.470 -17.204 4.733 470 HB3 PRO 111 1HB PRO 111 10.522 -17.292 6.228 471 HG2 PRO 111 2HG PRO 111 10.506 -19.254 4.411 472 HG3 PRO 111 1HG PRO 111 9.081 -18.847 5.382 473 HD2 PRO 111 2HD PRO 111 9.613 -18.290 2.500 474 HD3 PRO 111 1HD PRO 111 8.073 -18.566 3.339 475 H LYS 112 H LYS 112 10.505 -15.455 2.357 476 HA LYS 112 HA LYS 112 12.466 -13.486 3.325 477 HB2 LYS 112 2HB LYS 112 11.783 -14.435 0.527 478 HB3 LYS 112 1HB LYS 112 13.102 -13.335 0.921 479 HG2 LYS 112 2HG LYS 112 14.055 -15.084 2.431 480 HG3 LYS 112 1HG LYS 112 12.788 -16.189 1.894 481 HD2 LYS 112 2HD LYS 112 13.575 -15.882 -0.457 482 HD3 LYS 112 1HD LYS 112 14.903 -14.893 0.150 483 HE2 LYS 112 2HE LYS 112 15.143 -17.100 1.737 484 HE3 LYS 112 1HE LYS 112 14.541 -17.825 0.246 485 HZ1 LYS 112 1HZ LYS 112 17.022 -17.581 0.433 486 HZ2 LYS 112 2HZ LYS 112 16.793 -15.903 0.292 487 HZ3 LYS 112 3HZ LYS 112 16.325 -16.937 -0.972 488 H CYS 113 H CYS 113 9.263 -13.266 2.952 489 HA CYS 113 HA CYS 113 9.298 -10.672 1.496 490 HB2 CYS 113 2HB CYS 113 7.115 -12.590 2.301 491 HB3 CYS 113 1HB CYS 113 6.742 -10.942 1.792 492 H SER 114 H SER 114 10.556 -10.129 3.749 493 HA SER 114 HA SER 114 9.145 -8.149 5.071 494 HB2 SER 114 2HB SER 114 7.513 -9.331 6.136 495 HB3 SER 114 1HB SER 114 8.401 -10.848 6.021 496 HG SER 114 HG SER 114 9.827 -9.846 7.665 497 H TYR 115 H TYR 115 11.470 -10.758 5.408 498 HA TYR 115 HA TYR 115 12.829 -9.758 7.720 499 HB2 TYR 115 2HB TYR 115 13.701 -11.526 5.431 500 HB3 TYR 115 1HB TYR 115 14.787 -11.107 6.758 501 HD1 TYR 115 1HD TYR 115 11.221 -12.229 6.314 502 HD2 TYR 115 2HD TYR 115 14.880 -12.603 8.533 503 HE1 TYR 115 1HE TYR 115 10.182 -13.974 7.727 504 HE2 TYR 115 2HE TYR 115 13.839 -14.352 9.949 505 HH TYR 115 HH TYR 115 12.044 -15.610 10.291 506 H ILE 116 H ILE 116 13.211 -9.050 4.265 507 HA ILE 116 HA ILE 116 15.571 -7.415 4.679 508 HB ILE 116 HB ILE 116 13.890 -8.249 2.434 509 HG12 ILE 116 2HG1 ILE 116 16.094 -7.961 1.243 510 HG13 ILE 116 1HG1 ILE 116 16.769 -7.353 2.755 511 HG21 ILE 116 1HG2 ILE 116 14.519 -6.266 1.008 512 HG22 ILE 116 2HG2 ILE 116 14.951 -5.408 2.481 513 HG23 ILE 116 3HG2 ILE 116 13.283 -5.923 2.217 514 HD11 ILE 116 1HD1 ILE 116 16.139 -9.473 3.875 515 HD12 ILE 116 2HD1 ILE 116 17.229 -9.757 2.519 516 HD13 ILE 116 3HD1 ILE 116 15.504 -10.081 2.345 517 HA PRO 117 HA PRO 117 14.029 -3.652 6.452 518 HB2 PRO 117 2HB PRO 117 15.027 -2.455 3.887 519 HB3 PRO 117 1HB PRO 117 15.235 -1.879 5.551 520 HG2 PRO 117 2HG PRO 117 17.142 -3.257 4.202 521 HG3 PRO 117 1HG PRO 117 16.971 -3.283 5.964 522 HD2 PRO 117 2HD PRO 117 16.536 -5.457 4.080 523 HD3 PRO 117 1HD PRO 117 16.521 -5.513 5.854 524 HA PRO 118 HA PRO 118 10.290 -3.636 3.770 525 HB2 PRO 118 2HB PRO 118 8.473 -4.133 5.702 526 HB3 PRO 118 1HB PRO 118 9.475 -5.424 5.013 527 HG2 PRO 118 2HG PRO 118 9.684 -4.065 7.631 528 HG3 PRO 118 1HG PRO 118 10.097 -5.726 7.178 529 HD2 PRO 118 2HD PRO 118 11.907 -3.557 7.460 530 HD3 PRO 118 1HD PRO 118 12.266 -5.152 6.768 531 H CYS 119 H CYS 119 8.752 -1.938 3.470 532 HA CYS 119 HA CYS 119 9.123 0.387 5.290 533 HB2 CYS 119 2HB CYS 119 7.546 1.167 3.095 534 HB3 CYS 119 1HB CYS 119 9.254 1.522 3.346 535 H LYS 120 H LYS 120 7.606 0.448 6.878 536 HA LYS 120 HA LYS 120 4.767 -0.095 6.109 537 HB2 LYS 120 2HB LYS 120 4.391 -1.177 8.246 538 HB3 LYS 120 1HB LYS 120 5.763 -1.961 7.464 539 HG2 LYS 120 2HG LYS 120 7.295 -0.480 8.785 540 HG3 LYS 120 1HG LYS 120 5.886 0.140 9.646 541 HD2 LYS 120 2HD LYS 120 5.340 -2.282 10.233 542 HD3 LYS 120 1HD LYS 120 6.948 -2.692 9.637 543 HE2 LYS 120 2HE LYS 120 6.879 -2.298 12.113 544 HE3 LYS 120 1HE LYS 120 7.987 -1.220 11.265 545 HZ1 LYS 120 1HZ LYS 120 6.705 0.568 11.671 546 HZ2 LYS 120 2HZ LYS 120 6.147 -0.369 12.974 547 HZ3 LYS 120 3HZ LYS 120 5.249 -0.289 11.535 548 H ARG 121 H ARG 121 3.287 1.402 6.893 549 HA ARG 121 HA ARG 121 4.231 3.966 7.743 550 HB2 ARG 121 2HB ARG 121 2.004 3.422 6.634 551 HB3 ARG 121 1HB ARG 121 1.454 2.858 8.207 552 HG2 ARG 121 2HG ARG 121 1.901 5.056 9.189 553 HG3 ARG 121 1HG ARG 121 2.522 5.638 7.645 554 HD2 ARG 121 2HD ARG 121 0.236 6.388 7.832 555 HD3 ARG 121 1HD ARG 121 0.273 5.098 6.632 556 HE ARG 121 HE ARG 121 -0.280 3.804 9.037 557 HH11 ARG 121 1HH1 ARG 121 -2.401 3.424 9.720 558 HH12 ARG 121 2HH1 ARG 121 -3.679 4.433 9.133 559 HH21 ARG 121 1HH2 ARG 121 -1.592 6.395 7.179 560 HH22 ARG 121 2HH2 ARG 121 -3.222 6.116 7.693 561 H GLU 122 H GLU 122 2.780 1.267 9.522 562 HA GLU 122 HA GLU 122 4.196 2.044 11.950 563 HB2 GLU 122 2HB GLU 122 2.242 3.577 12.003 564 HB3 GLU 122 1HB GLU 122 1.165 2.185 11.929 565 HG2 GLU 122 2HG GLU 122 2.204 1.320 14.028 566 HG3 GLU 122 1HG GLU 122 3.170 2.793 14.121 567 H ASN 123 H ASN 123 4.157 0.352 13.522 568 HA ASN 123 HA ASN 123 4.001 -2.286 12.540 569 HB2 ASN 123 2HB ASN 123 3.565 -1.479 15.427 570 HB3 ASN 123 1HB ASN 123 4.225 -3.002 14.830 571 HD21 ASN 123 1HD2 ASN 123 4.927 0.463 15.200 572 HD22 ASN 123 2HD2 ASN 123 6.607 0.320 14.984 573 H GLN 124 H GLN 124 1.532 -0.312 14.114 574 HA GLN 124 HA GLN 124 -0.740 -0.773 14.563 575 HB2 GLN 124 2HB GLN 124 -0.397 -2.238 11.927 576 HB3 GLN 124 1HB GLN 124 -1.940 -1.760 12.636 577 HG2 GLN 124 2HG GLN 124 -1.229 0.611 12.559 578 HG3 GLN 124 1HG GLN 124 0.291 0.115 11.814 579 HE21 GLN 124 1HE2 GLN 124 -1.356 1.855 10.362 580 HE22 GLN 124 2HE2 GLN 124 -2.054 1.026 9.055 581 H LYS 125 H LYS 125 -2.358 -2.923 14.122 582 HA LYS 125 HA LYS 125 -0.998 -5.088 15.661 583 HB2 LYS 125 2HB LYS 125 -3.921 -4.298 15.525 584 HB3 LYS 125 1HB LYS 125 -3.316 -5.716 16.381 585 HG2 LYS 125 2HG LYS 125 -1.833 -4.214 17.725 586 HG3 LYS 125 1HG LYS 125 -2.590 -2.827 16.938 587 HD2 LYS 125 2HD LYS 125 -4.801 -3.581 17.784 588 HD3 LYS 125 1HD LYS 125 -4.004 -4.913 18.625 589 HE2 LYS 125 2HE LYS 125 -2.514 -2.779 19.468 590 HE3 LYS 125 1HE LYS 125 -4.113 -2.048 19.320 591 HZ1 LYS 125 1HZ LYS 125 -5.030 -3.697 20.745 592 HZ2 LYS 125 2HZ LYS 125 -3.655 -3.069 21.519 593 HZ3 LYS 125 3HZ LYS 125 -3.586 -4.588 20.760 594 H ASN 126 H ASN 126 -1.289 -7.249 14.982 595 HA ASN 126 HA ASN 126 -2.239 -7.516 12.164 596 HB2 ASN 126 2HB ASN 126 -0.413 -9.296 13.806 597 HB3 ASN 126 1HB ASN 126 -0.865 -9.577 12.124 598 HD21 ASN 126 1HD2 ASN 126 1.873 -9.167 12.894 599 HD22 ASN 126 2HD2 ASN 126 2.395 -7.694 12.231 600 H LEU 127 H LEU 127 -3.589 -7.840 15.072 601 HA LEU 127 HA LEU 127 -4.681 -10.558 14.712 602 HB2 LEU 127 2HB LEU 127 -5.234 -8.484 16.854 603 HB3 LEU 127 1HB LEU 127 -5.784 -10.161 16.878 604 HG LEU 127 HG LEU 127 -2.895 -9.237 16.858 605 HD11 LEU 127 1HD1 LEU 127 -3.964 -8.891 19.026 606 HD12 LEU 127 2HD1 LEU 127 -2.878 -10.278 19.128 607 HD13 LEU 127 3HD1 LEU 127 -4.620 -10.529 18.993 608 HD21 LEU 127 1HD2 LEU 127 -2.741 -11.286 15.794 609 HD22 LEU 127 2HD2 LEU 127 -4.232 -11.891 16.519 610 HD23 LEU 127 3HD2 LEU 127 -2.747 -11.835 17.469 611 H GLU 128 H GLU 128 -6.733 -8.073 16.011 612 HA GLU 128 HA GLU 128 -8.936 -8.781 14.357 613 HB2 GLU 128 2HB GLU 128 -8.428 -6.258 15.957 614 HB3 GLU 128 1HB GLU 128 -9.985 -6.702 15.256 615 HG2 GLU 128 2HG GLU 128 -9.948 -8.814 16.564 616 HG3 GLU 128 1HG GLU 128 -8.429 -8.307 17.306 617 H SER 129 H SER 129 -6.353 -6.464 13.877 618 HA SER 129 HA SER 129 -7.573 -4.768 11.970 619 HB2 SER 129 2HB SER 129 -4.702 -5.717 11.910 620 HB3 SER 129 1HB SER 129 -5.335 -4.222 11.233 621 HG SER 129 HG SER 129 -4.704 -3.528 13.149 622 H VAL 130 H VAL 130 -6.165 -7.995 11.576 623 HA VAL 130 HA VAL 130 -6.117 -8.017 8.726 624 HB VAL 130 HB VAL 130 -6.485 -10.264 10.720 625 HG11 VAL 130 1HG1 VAL 130 -6.648 -10.199 7.769 626 HG12 VAL 130 2HG1 VAL 130 -7.241 -11.414 8.901 627 HG13 VAL 130 3HG1 VAL 130 -5.546 -11.414 8.416 628 HG21 VAL 130 1HG2 VAL 130 -4.135 -9.341 9.032 629 HG22 VAL 130 2HG2 VAL 130 -4.124 -10.718 10.134 630 HG23 VAL 130 3HG2 VAL 130 -4.313 -9.082 10.767 631 H MET 131 H MET 131 -8.720 -8.913 11.011 632 HA MET 131 HA MET 131 -10.561 -9.863 9.085 633 HB2 MET 131 2HB MET 131 -10.939 -8.452 11.728 634 HB3 MET 131 1HB MET 131 -12.307 -8.984 10.762 635 HG2 MET 131 2HG MET 131 -10.068 -10.774 11.751 636 HG3 MET 131 1HG MET 131 -11.675 -10.672 12.467 637 HE1 MET 131 1HE MET 131 -13.486 -10.437 9.445 638 HE2 MET 131 2HE MET 131 -13.715 -10.742 11.167 639 HE3 MET 131 3HE MET 131 -14.086 -12.007 10.000 640 H ASN 132 H ASN 132 -9.832 -6.575 10.158 641 HA ASN 132 HA ASN 132 -11.925 -5.279 8.708 642 HB2 ASN 132 2HB ASN 132 -10.433 -4.255 10.502 643 HB3 ASN 132 1HB ASN 132 -9.186 -4.115 9.261 644 HD21 ASN 132 1HD2 ASN 132 -9.871 -1.693 10.156 645 HD22 ASN 132 2HD2 ASN 132 -10.956 -0.894 9.125 646 H TRP 133 H TRP 133 -8.559 -6.073 7.798 647 HA TRP 133 HA TRP 133 -8.707 -4.834 5.214 648 HB2 TRP 133 2HB TRP 133 -6.523 -5.241 5.955 649 HB3 TRP 133 1HB TRP 133 -6.898 -6.892 6.451 650 HD1 TRP 133 HD TRP 133 -6.281 -4.778 3.305 651 HE1 TRP 133 1HE TRP 133 -5.655 -6.351 1.369 652 HE3 TRP 133 3HE TRP 133 -7.035 -9.296 5.560 653 HZ2 TRP 133 2HZ TRP 133 -5.483 -9.154 0.842 654 HZ3 TRP 133 3HZ TRP 133 -6.620 -11.403 4.317 655 HH2 TRP 133 HH TRP 133 -5.849 -11.336 1.964 656 H GLN 134 H GLN 134 -9.001 -8.276 6.149 657 HA GLN 134 HA GLN 134 -9.635 -9.102 3.458 658 HB2 GLN 134 2HB GLN 134 -10.447 -11.222 4.665 659 HB3 GLN 134 1HB GLN 134 -8.749 -10.796 4.847 660 HG2 GLN 134 2HG GLN 134 -8.983 -10.610 7.074 661 HG3 GLN 134 1HG GLN 134 -10.304 -9.463 6.875 662 HE21 GLN 134 1HE2 GLN 134 -12.465 -10.666 6.091 663 HE22 GLN 134 2HE2 GLN 134 -12.826 -12.096 6.933 664 H GLN 135 H GLN 135 -11.691 -8.608 6.348 665 HA GLN 135 HA GLN 135 -14.115 -9.338 5.042 666 HB2 GLN 135 2HB GLN 135 -13.792 -9.143 7.519 667 HB3 GLN 135 1HB GLN 135 -13.802 -7.390 7.338 668 HG2 GLN 135 2HG GLN 135 -16.059 -7.591 6.239 669 HG3 GLN 135 1HG GLN 135 -16.045 -9.306 6.656 670 HE21 GLN 135 1HE2 GLN 135 -17.126 -9.727 8.579 671 HE22 GLN 135 2HE2 GLN 135 -17.234 -8.660 9.894 672 H TYR 136 H TYR 136 -12.604 -6.140 5.487 673 HA TYR 136 HA TYR 136 -14.756 -4.721 4.205 674 HB2 TYR 136 2HB TYR 136 -13.181 -3.586 5.704 675 HB3 TYR 136 1HB TYR 136 -11.867 -3.913 4.573 676 HD1 TYR 136 1HD TYR 136 -14.831 -1.871 5.235 677 HD2 TYR 136 2HD TYR 136 -11.797 -2.860 2.364 678 HE1 TYR 136 1HE TYR 136 -15.419 0.150 3.921 679 HE2 TYR 136 2HE TYR 136 -12.381 -0.840 1.048 680 HH TYR 136 HH TYR 136 -14.909 0.658 1.007 681 H TRP 137 H TRP 137 -11.488 -5.554 2.986 682 HA TRP 137 HA TRP 137 -12.117 -4.580 0.345 683 HB2 TRP 137 2HB TRP 137 -9.837 -6.266 1.383 684 HB3 TRP 137 1HB TRP 137 -9.932 -5.647 -0.264 685 HD1 TRP 137 HD TRP 137 -8.542 -4.768 2.948 686 HE1 TRP 137 1HE TRP 137 -8.018 -2.253 3.122 687 HE3 TRP 137 3HE TRP 137 -11.157 -3.064 -1.068 688 HZ2 TRP 137 2HZ TRP 137 -8.634 0.169 1.730 689 HZ3 TRP 137 3HZ TRP 137 -11.179 -0.650 -1.632 690 HH2 TRP 137 HH TRP 137 -9.921 0.968 -0.238 691 H LYS 138 H LYS 138 -12.061 -7.850 1.767 692 HA LYS 138 HA LYS 138 -12.323 -9.257 -0.680 693 HB2 LYS 138 2HB LYS 138 -11.914 -10.346 1.536 694 HB3 LYS 138 1HB LYS 138 -13.602 -10.032 1.952 695 HG2 LYS 138 2HG LYS 138 -14.314 -11.337 -0.033 696 HG3 LYS 138 1HG LYS 138 -12.623 -11.694 -0.385 697 HD2 LYS 138 2HD LYS 138 -12.428 -12.737 1.886 698 HD3 LYS 138 1HD LYS 138 -14.163 -12.499 2.098 699 HE2 LYS 138 2HE LYS 138 -14.705 -14.018 0.376 700 HE3 LYS 138 1HE LYS 138 -13.081 -13.954 -0.312 701 HZ1 LYS 138 1HZ LYS 138 -12.329 -14.930 1.884 702 HZ2 LYS 138 2HZ LYS 138 -13.178 -15.967 0.839 703 HZ3 LYS 138 3HZ LYS 138 -13.963 -15.281 2.180 704 H ASP 139 H ASP 139 -14.832 -7.887 1.431 705 HA ASP 139 HA ASP 139 -17.044 -8.812 -0.139 706 HB2 ASP 139 2HB ASP 139 -16.765 -6.424 1.696 707 HB3 ASP 139 1HB ASP 139 -18.296 -6.974 1.017 708 H GLU 140 H GLU 140 -15.225 -5.738 -0.191 709 HA GLU 140 HA GLU 140 -16.825 -4.748 -2.429 710 HB2 GLU 140 2HB GLU 140 -14.303 -3.676 -1.134 711 HB3 GLU 140 1HB GLU 140 -15.229 -2.834 -2.379 712 HG2 GLU 140 2HG GLU 140 -17.227 -2.892 -0.901 713 HG3 GLU 140 1HG GLU 140 -16.253 -3.659 0.353 714 H ILE 141 H ILE 141 -13.377 -5.595 -2.021 715 HA ILE 141 HA ILE 141 -13.416 -6.532 -4.830 716 HB ILE 141 HB ILE 141 -11.119 -5.420 -5.092 717 HG12 ILE 141 2HG1 ILE 141 -11.958 -3.347 -3.173 718 HG13 ILE 141 1HG1 ILE 141 -11.470 -4.866 -2.422 719 HG21 ILE 141 1HG2 ILE 141 -13.026 -4.577 -6.300 720 HG22 ILE 141 2HG2 ILE 141 -12.210 -3.187 -5.581 721 HG23 ILE 141 3HG2 ILE 141 -13.682 -3.826 -4.845 722 HD11 ILE 141 1HD1 ILE 141 -9.327 -4.806 -3.524 723 HD12 ILE 141 2HD1 ILE 141 -9.580 -3.226 -2.785 724 HD13 ILE 141 3HD1 ILE 141 -9.819 -3.437 -4.520 725 H GLY 142 H GLY 142 -12.711 -8.567 -4.806 726 HA2 GLY 142 2HA GLY 142 -11.491 -9.907 -2.650 727 HA3 GLY 142 1HA GLY 142 -11.384 -10.447 -4.321 728 H SER 143 H SER 143 -10.009 -8.164 -5.356 729 HA SER 143 HA SER 143 -7.643 -7.517 -3.876 730 HB2 SER 143 2HB SER 143 -7.197 -9.955 -4.229 731 HB3 SER 143 1HB SER 143 -7.292 -9.691 -5.966 732 HG SER 143 HG SER 143 -5.494 -8.434 -4.160 733 H GLN 144 H GLN 144 -8.624 -5.563 -4.959 734 HA GLN 144 HA GLN 144 -7.535 -5.272 -7.724 735 HB2 GLN 144 2HB GLN 144 -10.096 -5.490 -7.503 736 HB3 GLN 144 1HB GLN 144 -10.034 -3.877 -6.794 737 HG2 GLN 144 2HG GLN 144 -8.743 -3.134 -8.843 738 HG3 GLN 144 1HG GLN 144 -9.115 -4.703 -9.557 739 HE21 GLN 144 1HE2 GLN 144 -10.681 -4.148 -11.125 740 HE22 GLN 144 2HE2 GLN 144 -12.127 -3.333 -10.771 741 HA PRO 145 HA PRO 145 -5.589 -2.058 -4.993 742 HB2 PRO 145 2HB PRO 145 -3.726 -1.970 -7.291 743 HB3 PRO 145 1HB PRO 145 -3.379 -2.160 -5.568 744 HG2 PRO 145 2HG PRO 145 -3.185 -4.174 -7.359 745 HG3 PRO 145 1HG PRO 145 -3.541 -4.415 -5.645 746 HD2 PRO 145 2HD PRO 145 -5.349 -4.661 -7.979 747 HD3 PRO 145 1HD PRO 145 -5.468 -5.413 -6.376 748 H PHE 146 H PHE 146 -5.532 0.281 -5.358 749 HA PHE 146 HA PHE 146 -6.409 1.184 -8.028 750 HB2 PHE 146 2HB PHE 146 -8.109 2.678 -6.952 751 HB3 PHE 146 1HB PHE 146 -8.492 0.963 -6.839 752 HD1 PHE 146 1HD PHE 146 -8.381 3.958 -5.058 753 HD2 PHE 146 2HD PHE 146 -7.420 -0.211 -4.611 754 HE1 PHE 146 1HE PHE 146 -8.534 4.180 -2.597 755 HE2 PHE 146 2HE PHE 146 -7.546 0.025 -2.148 756 HZ PHE 146 HZ PHE 146 -8.108 2.221 -1.142 757 H THR 147 H THR 147 -5.976 3.429 -8.438 758 HA THR 147 HA THR 147 -3.983 4.605 -6.549 759 HB THR 147 HB THR 147 -2.856 5.577 -8.467 760 HG1 THR 147 1HG THR 147 -5.030 5.514 -9.646 761 HG21 THR 147 1HG2 THR 147 -2.787 3.095 -9.751 762 HG22 THR 147 2HG2 THR 147 -3.198 2.727 -8.075 763 HG23 THR 147 3HG2 THR 147 -1.733 3.637 -8.446 764 H CYS 148 H CYS 148 -3.978 6.931 -6.478 765 HA CYS 148 HA CYS 148 -6.431 8.224 -7.490 766 HB2 CYS 148 2HB CYS 148 -5.617 9.010 -4.754 767 HB3 CYS 148 1HB CYS 148 -7.230 8.742 -5.411 768 H TYR 149 H TYR 149 -6.236 10.581 -7.554 769 HA TYR 149 HA TYR 149 -3.526 11.687 -7.100 770 HB2 TYR 149 2HB TYR 149 -4.857 11.560 -9.814 771 HB3 TYR 149 1HB TYR 149 -3.603 12.735 -9.433 772 HD1 TYR 149 1HD TYR 149 -4.345 9.171 -9.971 773 HD2 TYR 149 2HD TYR 149 -1.315 12.044 -8.968 774 HE1 TYR 149 1HE TYR 149 -2.593 7.463 -10.380 775 HE2 TYR 149 2HE TYR 149 0.439 10.336 -9.376 776 HH TYR 149 HH TYR 149 -0.126 7.476 -11.009 777 H PHE 150 H PHE 150 -3.639 13.867 -6.553 778 HA PHE 150 HA PHE 150 -6.178 15.262 -7.124 779 HB2 PHE 150 2HB PHE 150 -6.911 15.353 -4.979 780 HB3 PHE 150 1HB PHE 150 -5.768 14.049 -4.668 781 HD1 PHE 150 1HD PHE 150 -3.677 14.448 -3.540 782 HD2 PHE 150 2HD PHE 150 -6.307 17.695 -4.514 783 HE1 PHE 150 1HE PHE 150 -2.375 15.940 -2.059 784 HE2 PHE 150 2HE PHE 150 -5.020 19.201 -3.027 785 HZ PHE 150 HZ PHE 150 -3.042 18.323 -1.796 786 H ASN 151 H ASN 151 -5.978 17.535 -7.158 787 HA ASN 151 HA ASN 151 -3.316 18.651 -6.494 788 HB2 ASN 151 2HB ASN 151 -3.128 19.721 -8.720 789 HB3 ASN 151 1HB ASN 151 -3.115 17.962 -8.833 790 HD21 ASN 151 1HD2 ASN 151 -3.840 19.000 -11.172 791 HD22 ASN 151 2HD2 ASN 151 -5.521 18.993 -11.412 792 H GLN 152 H GLN 152 -3.561 20.548 -5.485 793 HA GLN 152 HA GLN 152 -6.196 21.867 -5.467 794 HB2 GLN 152 2HB GLN 152 -5.328 23.127 -3.603 795 HB3 GLN 152 1HB GLN 152 -4.865 21.446 -3.364 796 HG2 GLN 152 2HG GLN 152 -2.657 22.005 -4.483 797 HG3 GLN 152 1HG GLN 152 -3.130 23.702 -4.394 798 HE21 GLN 152 1HE2 GLN 152 -1.724 24.455 -2.749 799 HE22 GLN 152 2HE2 GLN 152 -1.686 23.815 -1.178 800 H HIS 153 H HIS 153 -3.458 22.040 -7.353 801 HA HIS 153 HA HIS 153 -2.744 24.707 -7.599 802 HB2 HIS 153 2HB HIS 153 -2.140 24.227 -9.885 803 HB3 HIS 153 1HB HIS 153 -1.843 22.768 -8.944 804 HD1 HIS 153 1HD HIS 153 -3.050 23.488 -12.094 805 HD2 HIS 153 2HD HIS 153 -4.710 21.329 -8.934 806 HE1 HIS 153 1HE HIS 153 -4.815 21.976 -13.108 807 HE2 HIS 153 2HE HIS 153 -5.832 20.659 -11.194 808 H GLN 154 H GLN 154 -5.719 23.167 -8.750 809 HA GLN 154 HA GLN 154 -6.620 25.453 -10.273 810 HB2 GLN 154 2HB GLN 154 -7.545 23.123 -10.514 811 HB3 GLN 154 1HB GLN 154 -8.315 23.319 -8.939 812 HG2 GLN 154 2HG GLN 154 -9.567 25.263 -9.773 813 HG3 GLN 154 1HG GLN 154 -8.781 25.105 -11.344 814 HE21 GLN 154 1HE2 GLN 154 -11.527 24.938 -11.403 815 HE22 GLN 154 2HE2 GLN 154 -12.032 23.332 -11.628 816 H ARG 155 H ARG 155 -8.002 24.188 -7.240 817 HA ARG 155 HA ARG 155 -7.711 26.688 -5.853 818 HB2 ARG 155 2HB ARG 155 -9.967 26.443 -7.583 819 HB3 ARG 155 1HB ARG 155 -10.547 26.437 -5.915 820 HG2 ARG 155 2HG ARG 155 -9.424 28.512 -5.438 821 HG3 ARG 155 1HG ARG 155 -8.573 28.471 -6.984 822 HD2 ARG 155 2HD ARG 155 -10.269 29.733 -7.780 823 HD3 ARG 155 1HD ARG 155 -11.232 28.256 -7.727 824 HE ARG 155 HE ARG 155 -11.445 29.266 -5.158 825 HH11 ARG 155 1HH1 ARG 155 -13.073 30.708 -4.543 826 HH12 ARG 155 2HH1 ARG 155 -13.817 31.714 -5.741 827 HH21 ARG 155 1HH2 ARG 155 -11.912 30.467 -8.356 828 HH22 ARG 155 2HH2 ARG 155 -13.161 31.578 -7.899 829 HA PRO 156 HA PRO 156 -9.837 23.551 -3.063 830 HB2 PRO 156 2HB PRO 156 -11.521 21.697 -3.973 831 HB3 PRO 156 1HB PRO 156 -11.974 23.411 -4.010 832 HG2 PRO 156 2HG PRO 156 -11.149 21.636 -6.229 833 HG3 PRO 156 1HG PRO 156 -12.248 23.023 -6.239 834 HD2 PRO 156 2HD PRO 156 -9.470 23.003 -6.979 835 HD3 PRO 156 1HD PRO 156 -10.562 24.396 -6.900 836 H ASP 157 H ASP 157 -10.358 20.742 -4.930 837 HA ASP 157 HA ASP 157 -7.656 19.699 -4.896 838 HB2 ASP 157 2HB ASP 157 -8.079 17.971 -3.144 839 HB3 ASP 157 1HB ASP 157 -8.089 19.608 -2.489 840 H ASP 158 H ASP 158 -8.535 19.312 -7.124 841 HA ASP 158 HA ASP 158 -10.770 17.608 -7.639 842 HB2 ASP 158 2HB ASP 158 -8.182 17.947 -9.196 843 HB3 ASP 158 1HB ASP 158 -9.608 17.106 -9.807 844 H VAL 159 H VAL 159 -10.750 15.234 -8.033 845 HA VAL 159 HA VAL 159 -8.365 13.876 -6.841 846 HB VAL 159 HB VAL 159 -9.845 12.378 -5.592 847 HG11 VAL 159 1HG1 VAL 159 -10.162 13.852 -3.859 848 HG12 VAL 159 2HG1 VAL 159 -10.955 15.047 -4.884 849 HG13 VAL 159 3HG1 VAL 159 -9.198 14.899 -4.900 850 HG21 VAL 159 1HG2 VAL 159 -12.325 13.274 -5.495 851 HG22 VAL 159 2HG2 VAL 159 -11.834 12.196 -6.801 852 HG23 VAL 159 3HG2 VAL 159 -11.938 13.934 -7.084 853 H LEU 160 H LEU 160 -7.989 11.732 -7.546 854 HA LEU 160 HA LEU 160 -9.527 10.899 -9.978 855 HB2 LEU 160 2HB LEU 160 -7.081 11.668 -10.328 856 HB3 LEU 160 1HB LEU 160 -6.632 10.205 -9.456 857 HG LEU 160 HG LEU 160 -7.986 8.871 -11.089 858 HD11 LEU 160 1HD1 LEU 160 -8.130 10.539 -13.298 859 HD12 LEU 160 2HD1 LEU 160 -8.651 11.586 -11.979 860 HD13 LEU 160 3HD1 LEU 160 -9.493 10.067 -12.283 861 HD21 LEU 160 1HD2 LEU 160 -5.494 10.306 -11.591 862 HD22 LEU 160 2HD2 LEU 160 -6.322 9.887 -13.088 863 HD23 LEU 160 3HD2 LEU 160 -5.902 8.625 -11.932 864 H LEU 161 H LEU 161 -9.925 8.596 -10.132 865 HA LEU 161 HA LEU 161 -9.084 6.982 -7.775 866 HB2 LEU 161 2HB LEU 161 -11.387 7.947 -7.395 867 HB3 LEU 161 1HB LEU 161 -11.934 7.010 -8.785 868 HG LEU 161 HG LEU 161 -10.658 5.057 -7.443 869 HD11 LEU 161 1HD1 LEU 161 -11.119 5.310 -5.028 870 HD12 LEU 161 2HD1 LEU 161 -11.692 6.953 -5.311 871 HD13 LEU 161 3HD1 LEU 161 -9.998 6.548 -5.596 872 HD21 LEU 161 1HD2 LEU 161 -13.470 6.106 -7.053 873 HD22 LEU 161 2HD2 LEU 161 -12.934 4.554 -6.409 874 HD23 LEU 161 3HD2 LEU 161 -12.933 4.835 -8.151 875 H HIS 162 H HIS 162 -7.722 6.367 -9.871 876 HA HIS 162 HA HIS 162 -9.074 4.668 -11.809 877 HB2 HIS 162 2HB HIS 162 -6.152 5.078 -11.130 878 HB3 HIS 162 1HB HIS 162 -6.703 4.006 -12.417 879 HD1 HIS 162 1HD HIS 162 -5.059 6.225 -13.448 880 HD2 HIS 162 2HD HIS 162 -9.140 6.742 -12.752 881 HE1 HIS 162 1HE HIS 162 -5.787 8.196 -14.866 882 HE2 HIS 162 2HE HIS 162 -8.267 8.518 -14.450 883 H ARG 163 H ARG 163 -8.666 2.325 -12.014 884 HA ARG 163 HA ARG 163 -8.271 1.022 -9.346 885 HB2 ARG 163 2HB ARG 163 -10.013 0.170 -11.676 886 HB3 ARG 163 1HB ARG 163 -9.775 -0.770 -10.203 887 HG2 ARG 163 2HG ARG 163 -10.648 1.153 -8.875 888 HG3 ARG 163 1HG ARG 163 -10.977 2.008 -10.384 889 HD2 ARG 163 2HD ARG 163 -12.414 0.058 -11.083 890 HD3 ARG 163 1HD ARG 163 -12.204 -0.605 -9.463 891 HE ARG 163 HE ARG 163 -13.925 1.631 -10.181 892 HH11 ARG 163 1HH1 ARG 163 -15.068 2.570 -8.472 893 HH12 ARG 163 2HH1 ARG 163 -14.591 2.234 -6.841 894 HH21 ARG 163 1HH2 ARG 163 -11.972 0.154 -7.755 895 HH22 ARG 163 2HH2 ARG 163 -12.838 0.867 -6.435 896 H THR 164 H THR 164 -7.280 -1.140 -9.414 897 HA THR 164 HA THR 164 -5.399 -1.419 -11.721 898 HB THR 164 HB THR 164 -5.103 -2.622 -8.967 899 HG1 THR 164 1HG THR 164 -3.643 -0.410 -9.852 900 HG21 THR 164 1HG2 THR 164 -3.808 -3.177 -11.334 901 HG22 THR 164 2HG2 THR 164 -3.146 -3.467 -9.725 902 HG23 THR 164 3HG2 THR 164 -2.743 -1.985 -10.591 903 H HIS 165 H HIS 165 -5.322 -3.359 -12.830 904 HA HIS 165 HA HIS 165 -7.215 -5.495 -11.918 905 HB2 HIS 165 2HB HIS 165 -6.487 -4.666 -14.745 906 HB3 HIS 165 1HB HIS 165 -7.508 -6.043 -14.329 907 HD1 HIS 165 1HD HIS 165 -9.721 -5.392 -12.853 908 HD2 HIS 165 2HD HIS 165 -7.879 -2.272 -14.922 909 HE1 HIS 165 1HE HIS 165 -11.413 -3.509 -12.966 910 HE2 HIS 165 2HE HIS 165 -10.302 -1.606 -14.222 911 H ASP 166 H ASP 166 -6.407 -7.587 -11.889 912 HA ASP 166 HA ASP 166 -3.516 -7.896 -12.000 913 HB2 ASP 166 2HB ASP 166 -5.757 -9.905 -11.636 914 HB3 ASP 166 1HB ASP 166 -4.043 -10.304 -11.513 Start of MODEL 10 1 H1 GLN 45 1HT GLN 45 3.810 14.041 -2.817 2 H2 GLN 45 2HT GLN 45 4.288 12.436 -3.112 3 H3 GLN 45 3HT GLN 45 3.728 13.407 -4.389 4 HA GLN 45 HA GLN 45 6.351 13.247 -3.208 5 HB2 GLN 45 2HB GLN 45 5.226 14.325 -5.810 6 HB3 GLN 45 1HB GLN 45 6.945 14.159 -5.452 7 HG2 GLN 45 2HG GLN 45 6.671 11.737 -5.153 8 HG3 GLN 45 1HG GLN 45 4.940 11.883 -5.460 9 HE21 GLN 45 1HE2 GLN 45 6.558 10.249 -7.140 10 HE22 GLN 45 2HE2 GLN 45 6.654 10.967 -8.674 11 H ASP 46 H ASP 46 5.277 16.001 -5.096 12 HA ASP 46 HA ASP 46 6.660 17.869 -3.417 13 HB2 ASP 46 2HB ASP 46 4.500 18.310 -5.502 14 HB3 ASP 46 1HB ASP 46 5.456 19.597 -4.765 15 H LEU 47 H LEU 47 5.853 19.294 -1.847 16 HA LEU 47 HA LEU 47 3.723 18.383 -0.203 17 HB2 LEU 47 2HB LEU 47 4.857 21.189 -0.389 18 HB3 LEU 47 1HB LEU 47 3.959 20.519 0.973 19 HG LEU 47 HG LEU 47 6.623 19.507 -0.068 20 HD11 LEU 47 1HD1 LEU 47 6.841 21.607 1.157 21 HD12 LEU 47 2HD1 LEU 47 7.433 20.284 2.160 22 HD13 LEU 47 3HD1 LEU 47 5.841 20.978 2.467 23 HD21 LEU 47 1HD2 LEU 47 4.632 18.471 1.915 24 HD22 LEU 47 2HD2 LEU 47 6.347 18.275 2.280 25 HD23 LEU 47 3HD2 LEU 47 5.673 17.580 0.805 26 H GLN 48 H GLN 48 3.759 20.725 -2.855 27 HA GLN 48 HA GLN 48 1.161 21.817 -2.377 28 HB2 GLN 48 2HB GLN 48 1.263 22.677 -4.620 29 HB3 GLN 48 1HB GLN 48 2.894 22.757 -3.959 30 HG2 GLN 48 2HG GLN 48 3.447 20.624 -5.098 31 HG3 GLN 48 1HG GLN 48 1.828 20.586 -5.794 32 HE21 GLN 48 1HE2 GLN 48 1.324 22.087 -7.507 33 HE22 GLN 48 2HE2 GLN 48 2.525 23.018 -8.267 34 H ALA 49 H ALA 49 -0.840 21.330 -3.459 35 HA ALA 49 HA ALA 49 -1.466 18.530 -3.575 36 HB1 ALA 49 1HB ALA 49 -2.920 21.026 -4.445 37 HB2 ALA 49 2HB ALA 49 -3.225 20.044 -3.021 38 HB3 ALA 49 3HB ALA 49 -3.629 19.422 -4.621 39 H THR 50 H THR 50 -1.466 17.132 -5.296 40 HA THR 50 HA THR 50 -1.650 17.935 -8.049 41 HB THR 50 HB THR 50 1.098 17.024 -7.159 42 HG1 THR 50 1HG THR 50 1.389 19.315 -8.164 43 HG21 THR 50 1HG2 THR 50 0.561 18.268 -9.807 44 HG22 THR 50 2HG2 THR 50 -0.035 16.626 -9.574 45 HG23 THR 50 3HG2 THR 50 1.681 16.978 -9.377 46 H GLU 51 H GLU 51 0.449 15.418 -6.685 47 HA GLU 51 HA GLU 51 -1.388 13.410 -7.901 48 HB2 GLU 51 2HB GLU 51 1.561 13.163 -7.273 49 HB3 GLU 51 1HB GLU 51 0.571 11.964 -8.105 50 HG2 GLU 51 2HG GLU 51 0.093 13.655 -9.884 51 HG3 GLU 51 1HG GLU 51 1.197 14.766 -9.076 52 H ALA 52 H ALA 52 -2.135 11.733 -6.701 53 HA ALA 52 HA ALA 52 -1.002 11.134 -4.048 54 HB1 ALA 52 1HB ALA 52 -2.698 12.882 -3.564 55 HB2 ALA 52 2HB ALA 52 -3.206 11.314 -2.936 56 HB3 ALA 52 3HB ALA 52 -3.908 11.934 -4.430 57 H ASN 53 H ASN 53 -0.693 8.933 -4.424 58 HA ASN 53 HA ASN 53 -2.818 7.534 -5.956 59 HB2 ASN 53 2HB ASN 53 -0.003 6.698 -5.258 60 HB3 ASN 53 1HB ASN 53 -1.156 5.670 -6.104 61 HD21 ASN 53 1HD2 ASN 53 -2.407 7.694 -7.736 62 HD22 ASN 53 2HD2 ASN 53 -1.257 8.249 -8.854 63 H CYS 54 H CYS 54 -4.112 6.035 -5.073 64 HA CYS 54 HA CYS 54 -3.524 5.161 -2.277 65 HB2 CYS 54 2HB CYS 54 -6.358 5.350 -2.851 66 HB3 CYS 54 1HB CYS 54 -5.451 6.100 -1.545 67 H THR 55 H THR 55 -2.913 3.057 -2.857 68 HA THR 55 HA THR 55 -4.961 1.546 -4.421 69 HB THR 55 HB THR 55 -3.386 0.928 -5.907 70 HG1 THR 55 1HG THR 55 -2.727 -0.527 -4.118 71 HG21 THR 55 1HG2 THR 55 -1.378 2.240 -6.052 72 HG22 THR 55 2HG2 THR 55 -1.409 2.585 -4.325 73 HG23 THR 55 3HG2 THR 55 -2.618 3.299 -5.386 74 H VAL 56 H VAL 56 -5.303 -0.609 -3.897 75 HA VAL 56 HA VAL 56 -4.327 -1.397 -1.202 76 HB VAL 56 HB VAL 56 -6.188 -3.162 -1.468 77 HG11 VAL 56 1HG1 VAL 56 -7.875 -0.951 -1.281 78 HG12 VAL 56 2HG1 VAL 56 -6.304 -0.345 -0.759 79 HG13 VAL 56 3HG1 VAL 56 -7.027 -1.733 0.053 80 HG21 VAL 56 1HG2 VAL 56 -8.038 -2.413 -2.992 81 HG22 VAL 56 2HG2 VAL 56 -6.595 -2.953 -3.848 82 HG23 VAL 56 3HG2 VAL 56 -6.929 -1.235 -3.677 83 H LEU 57 H LEU 57 -2.545 -2.631 -1.407 84 HA LEU 57 HA LEU 57 -1.550 -3.805 -3.718 85 HB2 LEU 57 2HB LEU 57 -0.469 -3.625 -1.392 86 HB3 LEU 57 1HB LEU 57 -1.297 -5.137 -1.028 87 HG LEU 57 HG LEU 57 -0.235 -6.083 -3.147 88 HD11 LEU 57 1HD1 LEU 57 2.060 -4.390 -3.127 89 HD12 LEU 57 2HD1 LEU 57 0.645 -3.360 -3.334 90 HD13 LEU 57 3HD1 LEU 57 0.943 -4.684 -4.457 91 HD21 LEU 57 1HD2 LEU 57 1.309 -5.267 -0.690 92 HD22 LEU 57 2HD2 LEU 57 2.086 -6.199 -1.969 93 HD23 LEU 57 3HD2 LEU 57 0.687 -6.859 -1.123 94 H SER 58 H SER 58 -1.580 -6.009 -4.509 95 HA SER 58 HA SER 58 -4.209 -7.301 -4.075 96 HB2 SER 58 2HB SER 58 -3.737 -8.530 -6.110 97 HB3 SER 58 1HB SER 58 -3.347 -6.839 -6.410 98 HG SER 58 HG SER 58 -1.202 -7.980 -5.378 99 H VAL 59 H VAL 59 -4.278 -9.583 -3.481 100 HA VAL 59 HA VAL 59 -1.879 -10.338 -1.907 101 HB VAL 59 HB VAL 59 -4.604 -11.656 -1.929 102 HG11 VAL 59 1HG1 VAL 59 -2.148 -12.415 -0.806 103 HG12 VAL 59 2HG1 VAL 59 -3.736 -13.053 -0.383 104 HG13 VAL 59 3HG1 VAL 59 -3.054 -11.707 0.530 105 HG21 VAL 59 1HG2 VAL 59 -3.533 -9.578 0.001 106 HG22 VAL 59 2HG2 VAL 59 -5.154 -10.271 -0.022 107 HG23 VAL 59 3HG2 VAL 59 -4.635 -9.198 -1.322 108 H GLN 60 H GLN 60 -0.444 -11.598 -2.894 109 HA GLN 60 HA GLN 60 -1.367 -13.989 -4.358 110 HB2 GLN 60 2HB GLN 60 0.566 -11.956 -5.513 111 HB3 GLN 60 1HB GLN 60 0.270 -13.557 -6.195 112 HG2 GLN 60 2HG GLN 60 -2.151 -12.973 -6.408 113 HG3 GLN 60 1HG GLN 60 -1.773 -11.343 -5.846 114 HE21 GLN 60 1HE2 GLN 60 -2.759 -11.000 -8.205 115 HE22 GLN 60 2HE2 GLN 60 -1.616 -10.937 -9.462 116 H GLN 61 H GLN 61 0.373 -15.629 -4.459 117 HA GLN 61 HA GLN 61 2.142 -15.365 -2.120 118 HB2 GLN 61 2HB GLN 61 0.754 -17.475 -3.076 119 HB3 GLN 61 1HB GLN 61 2.307 -17.767 -3.858 120 HG2 GLN 61 2HG GLN 61 2.639 -18.849 -1.830 121 HG3 GLN 61 1HG GLN 61 3.265 -17.244 -1.454 122 HE21 GLN 61 1HE2 GLN 61 1.593 -15.688 -0.440 123 HE22 GLN 61 2HE2 GLN 61 0.427 -16.362 0.593 124 H ILE 62 H ILE 62 3.877 -14.052 -2.636 125 HA ILE 62 HA ILE 62 5.834 -13.330 -3.719 126 HB ILE 62 HB ILE 62 5.977 -16.313 -4.260 127 HG12 ILE 62 2HG1 ILE 62 7.214 -14.656 -2.040 128 HG13 ILE 62 1HG1 ILE 62 5.725 -15.585 -1.858 129 HG21 ILE 62 1HG2 ILE 62 7.985 -14.071 -4.492 130 HG22 ILE 62 2HG2 ILE 62 7.620 -15.346 -5.657 131 HG23 ILE 62 3HG2 ILE 62 8.504 -15.726 -4.182 132 HD11 ILE 62 1HD1 ILE 62 7.940 -17.125 -3.030 133 HD12 ILE 62 2HD1 ILE 62 6.835 -17.558 -1.726 134 HD13 ILE 62 3HD1 ILE 62 8.254 -16.567 -1.386 135 H GLY 63 H GLY 63 7.044 -13.438 -5.929 136 HA2 GLY 63 2HA GLY 63 6.939 -13.711 -8.322 137 HA3 GLY 63 1HA GLY 63 5.218 -14.062 -8.179 138 H GLU 64 H GLU 64 5.747 -11.477 -6.203 139 HA GLU 64 HA GLU 64 5.354 -9.502 -8.404 140 HB2 GLU 64 2HB GLU 64 3.794 -9.719 -5.820 141 HB3 GLU 64 1HB GLU 64 3.735 -8.316 -6.888 142 HG2 GLU 64 2HG GLU 64 3.018 -9.826 -8.751 143 HG3 GLU 64 1HG GLU 64 2.949 -11.157 -7.595 144 H VAL 65 H VAL 65 6.340 -7.520 -8.100 145 HA VAL 65 HA VAL 65 7.992 -7.237 -5.627 146 HB VAL 65 HB VAL 65 8.577 -6.137 -8.392 147 HG11 VAL 65 1HG1 VAL 65 10.065 -4.846 -7.306 148 HG12 VAL 65 2HG1 VAL 65 10.868 -6.305 -6.725 149 HG13 VAL 65 3HG1 VAL 65 9.593 -5.557 -5.763 150 HG21 VAL 65 1HG2 VAL 65 10.503 -8.041 -7.444 151 HG22 VAL 65 2HG2 VAL 65 9.491 -8.137 -8.886 152 HG23 VAL 65 3HG2 VAL 65 8.901 -8.772 -7.350 153 H PHE 66 H PHE 66 7.707 -5.345 -4.486 154 HA PHE 66 HA PHE 66 5.929 -3.286 -5.723 155 HB2 PHE 66 2HB PHE 66 6.170 -3.921 -2.776 156 HB3 PHE 66 1HB PHE 66 4.964 -2.896 -3.558 157 HD1 PHE 66 1HD PHE 66 3.636 -4.085 -5.546 158 HD2 PHE 66 2HD PHE 66 5.590 -6.120 -2.310 159 HE1 PHE 66 1HE PHE 66 2.213 -6.076 -5.938 160 HE2 PHE 66 2HE PHE 66 4.166 -8.110 -2.700 161 HZ PHE 66 HZ PHE 66 2.475 -8.089 -4.514 162 H GLU 67 H GLU 67 6.373 -1.078 -5.132 163 HA GLU 67 HA GLU 67 9.188 -0.671 -4.219 164 HB2 GLU 67 2HB GLU 67 9.272 1.294 -5.606 165 HB3 GLU 67 1HB GLU 67 8.625 -0.014 -6.597 166 HG2 GLU 67 2HG GLU 67 6.311 0.792 -6.036 167 HG3 GLU 67 1HG GLU 67 7.042 2.180 -5.229 168 H CYS 68 H CYS 68 9.599 1.062 -2.782 169 HA CYS 68 HA CYS 68 7.188 1.987 -1.278 170 HB2 CYS 68 2HB CYS 68 9.334 0.662 -0.283 171 HB3 CYS 68 1HB CYS 68 9.910 2.322 -0.122 172 H THR 69 H THR 69 7.279 4.279 -0.538 173 HA THR 69 HA THR 69 8.904 5.946 -2.414 174 HB THR 69 HB THR 69 7.099 7.377 -2.704 175 HG1 THR 69 1HG THR 69 5.808 6.338 -0.423 176 HG21 THR 69 1HG2 THR 69 6.616 4.806 -3.209 177 HG22 THR 69 2HG2 THR 69 5.370 6.034 -3.432 178 HG23 THR 69 3HG2 THR 69 5.384 5.045 -1.970 179 H PHE 70 H PHE 70 9.853 7.839 -1.588 180 HA PHE 70 HA PHE 70 9.503 8.499 1.260 181 HB2 PHE 70 2HB PHE 70 11.816 8.237 1.864 182 HB3 PHE 70 1HB PHE 70 11.297 6.709 1.154 183 HD1 PHE 70 1HD PHE 70 11.998 6.075 -1.130 184 HD2 PHE 70 2HD PHE 70 13.388 9.688 0.732 185 HE1 PHE 70 1HE PHE 70 13.786 6.272 -2.839 186 HE2 PHE 70 2HE PHE 70 15.174 9.882 -0.978 187 HZ PHE 70 HZ PHE 70 15.372 8.173 -2.763 188 H THR 71 H THR 71 10.505 10.591 1.761 189 HA THR 71 HA THR 71 11.299 12.147 -0.651 190 HB THR 71 HB THR 71 9.836 13.743 1.294 191 HG1 THR 71 1HG THR 71 8.873 11.476 1.280 192 HG21 THR 71 1HG2 THR 71 10.309 14.509 -0.962 193 HG22 THR 71 2HG2 THR 71 8.562 14.334 -0.782 194 HG23 THR 71 3HG2 THR 71 9.486 13.108 -1.648 195 H CYS 72 H CYS 72 12.965 13.582 -0.299 196 HA CYS 72 HA CYS 72 13.897 13.922 2.519 197 HB2 CYS 72 2HB CYS 72 16.220 14.056 1.058 198 HB3 CYS 72 1HB CYS 72 15.659 12.621 1.908 199 H GLY 73 H GLY 73 15.323 15.914 2.723 200 HA2 GLY 73 2HA GLY 73 14.036 18.108 1.259 201 HA3 GLY 73 1HA GLY 73 15.177 18.282 2.594 202 H ALA 74 H ALA 74 15.678 19.993 0.661 203 HA ALA 74 HA ALA 74 17.465 20.721 -0.687 204 HB1 ALA 74 1HB ALA 74 18.654 18.869 0.830 205 HB2 ALA 74 2HB ALA 74 19.476 19.601 -0.548 206 HB3 ALA 74 3HB ALA 74 18.719 18.017 -0.711 207 H ASP 75 H ASP 75 15.037 19.581 -1.766 208 HA ASP 75 HA ASP 75 14.176 18.860 -3.820 209 HB2 ASP 75 2HB ASP 75 15.810 20.635 -4.611 210 HB3 ASP 75 1HB ASP 75 16.979 19.340 -4.868 211 H CYS 76 H CYS 76 15.250 16.921 -1.986 212 HA CYS 76 HA CYS 76 16.403 14.883 -3.839 213 HB2 CYS 76 2HB CYS 76 17.789 15.132 -1.915 214 HB3 CYS 76 1HB CYS 76 16.401 15.191 -0.838 215 H ARG 77 H ARG 77 14.777 13.711 -4.730 216 HA ARG 77 HA ARG 77 12.655 12.661 -2.913 217 HB2 ARG 77 2HB ARG 77 12.295 13.917 -5.652 218 HB3 ARG 77 1HB ARG 77 11.045 12.963 -4.850 219 HG2 ARG 77 2HG ARG 77 10.667 14.562 -3.221 220 HG3 ARG 77 1HG ARG 77 12.313 15.183 -3.296 221 HD2 ARG 77 2HD ARG 77 10.862 16.855 -4.247 222 HD3 ARG 77 1HD ARG 77 11.771 16.128 -5.570 223 HE ARG 77 HE ARG 77 9.151 14.894 -5.053 224 HH11 ARG 77 1HH1 ARG 77 7.688 15.066 -6.770 225 HH12 ARG 77 2HH1 ARG 77 8.032 16.146 -8.078 226 HH21 ARG 77 1HH2 ARG 77 11.044 17.230 -6.743 227 HH22 ARG 77 2HH2 ARG 77 9.932 17.370 -8.065 228 H GLY 78 H GLY 78 12.122 10.456 -3.350 229 HA2 GLY 78 2HA GLY 78 12.746 9.189 -5.858 230 HA3 GLY 78 1HA GLY 78 14.034 8.865 -4.700 231 H THR 79 H THR 79 12.838 6.678 -5.517 232 HA THR 79 HA THR 79 11.022 5.910 -3.282 233 HB THR 79 HB THR 79 9.902 4.345 -4.878 234 HG1 THR 79 1HG THR 79 11.487 4.156 -6.422 235 HG21 THR 79 1HG2 THR 79 8.473 6.090 -4.833 236 HG22 THR 79 2HG2 THR 79 9.155 6.529 -6.399 237 HG23 THR 79 3HG2 THR 79 9.781 7.269 -4.926 238 H SER 80 H SER 80 11.153 3.559 -2.773 239 HA SER 80 HA SER 80 13.865 2.465 -3.422 240 HB2 SER 80 2HB SER 80 12.177 1.955 -0.957 241 HB3 SER 80 1HB SER 80 13.803 1.347 -1.254 242 HG SER 80 HG SER 80 14.118 3.825 -1.616 243 H GLN 81 H GLN 81 13.991 0.144 -3.731 244 HA GLN 81 HA GLN 81 11.387 -1.054 -4.562 245 HB2 GLN 81 2HB GLN 81 13.061 -0.649 -6.384 246 HB3 GLN 81 1HB GLN 81 14.151 -1.756 -5.558 247 HG2 GLN 81 2HG GLN 81 13.016 -3.048 -7.224 248 HG3 GLN 81 1HG GLN 81 12.305 -3.493 -5.672 249 HE21 GLN 81 1HE2 GLN 81 10.078 -3.147 -5.410 250 HE22 GLN 81 2HE2 GLN 81 9.109 -2.323 -6.527 251 H TYR 82 H TYR 82 10.743 -2.867 -3.494 252 HA TYR 82 HA TYR 82 12.802 -4.507 -2.114 253 HB2 TYR 82 2HB TYR 82 10.199 -3.615 -0.840 254 HB3 TYR 82 1HB TYR 82 11.424 -4.633 -0.089 255 HD1 TYR 82 1HD TYR 82 13.946 -3.470 -0.459 256 HD2 TYR 82 2HD TYR 82 10.181 -1.445 -0.039 257 HE1 TYR 82 1HE TYR 82 15.124 -1.447 0.349 258 HE2 TYR 82 2HE TYR 82 11.364 0.580 0.767 259 HH TYR 82 HH TYR 82 14.759 0.948 0.516 260 HA PRO 83 HA PRO 83 10.749 -8.047 -3.851 261 HB2 PRO 83 2HB PRO 83 10.566 -9.167 -1.099 262 HB3 PRO 83 1HB PRO 83 11.265 -9.880 -2.563 263 HG2 PRO 83 2HG PRO 83 12.761 -8.871 -0.568 264 HG3 PRO 83 1HG PRO 83 13.273 -8.868 -2.261 265 HD2 PRO 83 2HD PRO 83 12.428 -6.600 -0.570 266 HD3 PRO 83 1HD PRO 83 13.404 -6.610 -2.053 267 H CYS 84 H CYS 84 8.846 -9.730 -2.631 268 HA CYS 84 HA CYS 84 6.450 -8.145 -2.886 269 HB2 CYS 84 2HB CYS 84 5.546 -10.185 -3.182 270 HB3 CYS 84 1HB CYS 84 7.120 -10.899 -2.827 271 H VAL 85 H VAL 85 4.972 -7.526 -1.255 272 HA VAL 85 HA VAL 85 5.953 -7.775 1.559 273 HB VAL 85 HB VAL 85 5.036 -5.484 1.955 274 HG11 VAL 85 1HG1 VAL 85 6.916 -4.320 0.948 275 HG12 VAL 85 2HG1 VAL 85 7.120 -5.608 -0.240 276 HG13 VAL 85 3HG1 VAL 85 7.446 -5.920 1.465 277 HG21 VAL 85 1HG2 VAL 85 4.005 -5.914 -0.679 278 HG22 VAL 85 2HG2 VAL 85 5.103 -4.534 -0.740 279 HG23 VAL 85 3HG2 VAL 85 3.741 -4.529 0.379 280 H GLN 86 H GLN 86 4.128 -7.374 3.152 281 HA GLN 86 HA GLN 86 1.986 -9.154 2.685 282 HB2 GLN 86 2HB GLN 86 1.944 -6.797 4.583 283 HB3 GLN 86 1HB GLN 86 0.993 -8.277 4.697 284 HG2 GLN 86 2HG GLN 86 4.017 -8.113 4.845 285 HG3 GLN 86 1HG GLN 86 2.937 -8.375 6.214 286 HE21 GLN 86 1HE2 GLN 86 5.003 -10.112 4.449 287 HE22 GLN 86 2HE2 GLN 86 4.178 -11.591 4.332 288 H VAL 87 H VAL 87 -0.357 -7.711 3.430 289 HA VAL 87 HA VAL 87 -0.772 -6.044 0.976 290 HB VAL 87 HB VAL 87 -1.854 -8.277 0.851 291 HG11 VAL 87 1HG1 VAL 87 -3.302 -9.062 2.460 292 HG12 VAL 87 2HG1 VAL 87 -3.844 -7.445 2.909 293 HG13 VAL 87 3HG1 VAL 87 -2.292 -8.048 3.492 294 HG21 VAL 87 1HG2 VAL 87 -3.018 -5.710 0.434 295 HG22 VAL 87 2HG2 VAL 87 -4.289 -6.764 1.056 296 HG23 VAL 87 3HG2 VAL 87 -3.401 -7.216 -0.400 297 H TYR 88 H TYR 88 -2.018 -4.208 1.151 298 HA TYR 88 HA TYR 88 -3.746 -3.525 3.279 299 HB2 TYR 88 2HB TYR 88 -1.491 -3.473 4.503 300 HB3 TYR 88 1HB TYR 88 -1.143 -2.037 3.551 301 HD1 TYR 88 1HD TYR 88 -4.048 -3.440 5.505 302 HD2 TYR 88 2HD TYR 88 -1.641 -0.017 4.565 303 HE1 TYR 88 1HE TYR 88 -5.390 -2.068 7.067 304 HE2 TYR 88 2HE TYR 88 -2.980 1.359 6.128 305 HH TYR 88 HH TYR 88 -4.837 1.424 7.387 306 H VAL 89 H VAL 89 -2.301 -0.655 3.047 307 HA VAL 89 HA VAL 89 -3.233 -0.113 0.280 308 HB VAL 89 HB VAL 89 -5.099 0.367 1.888 309 HG11 VAL 89 1HG1 VAL 89 -3.113 1.364 3.494 310 HG12 VAL 89 2HG1 VAL 89 -4.826 1.720 3.695 311 HG13 VAL 89 3HG1 VAL 89 -3.789 2.842 2.813 312 HG21 VAL 89 1HG2 VAL 89 -5.632 2.528 0.916 313 HG22 VAL 89 2HG2 VAL 89 -4.789 1.568 -0.301 314 HG23 VAL 89 3HG2 VAL 89 -3.930 2.837 0.573 315 H ASN 90 H ASN 90 -1.986 1.341 -0.796 316 HA ASN 90 HA ASN 90 0.338 2.451 0.651 317 HB2 ASN 90 2HB ASN 90 -0.371 2.399 -2.300 318 HB3 ASN 90 1HB ASN 90 1.141 3.007 -1.631 319 HD21 ASN 90 1HD2 ASN 90 0.162 0.447 0.304 320 HD22 ASN 90 2HD2 ASN 90 1.047 -0.798 -0.436 321 H ASN 91 H ASN 91 0.248 4.537 1.376 322 HA ASN 91 HA ASN 91 -1.829 6.320 0.205 323 HB2 ASN 91 2HB ASN 91 -0.264 6.588 2.790 324 HB3 ASN 91 1HB ASN 91 -1.555 7.663 2.251 325 HD21 ASN 91 1HD2 ASN 91 -3.428 5.785 1.260 326 HD22 ASN 91 2HD2 ASN 91 -3.968 4.810 2.541 327 H SER 92 H SER 92 -0.552 6.879 -1.662 328 HA SER 92 HA SER 92 2.044 8.186 -1.185 329 HB2 SER 92 2HB SER 92 0.841 8.285 -3.882 330 HB3 SER 92 1HB SER 92 2.473 7.842 -3.395 331 HG SER 92 HG SER 92 1.403 5.891 -2.497 332 H GLU 93 H GLU 93 -0.178 9.482 0.009 333 HA GLU 93 HA GLU 93 -1.215 11.622 -1.607 334 HB2 GLU 93 2HB GLU 93 -0.715 11.614 1.390 335 HB3 GLU 93 1HB GLU 93 -1.851 12.643 0.515 336 HG2 GLU 93 2HG GLU 93 -3.070 10.598 -0.231 337 HG3 GLU 93 1HG GLU 93 -1.978 9.625 0.757 338 H SER 94 H SER 94 1.839 10.914 -0.374 339 HA SER 94 HA SER 94 2.977 13.390 -1.393 340 HB2 SER 94 2HB SER 94 2.225 13.327 1.340 341 HB3 SER 94 1HB SER 94 3.976 13.140 1.305 342 HG SER 94 HG SER 94 2.723 15.358 1.105 343 H ASN 95 H ASN 95 3.376 10.419 0.493 344 HA ASN 95 HA ASN 95 5.222 9.125 -1.079 345 HB2 ASN 95 2HB ASN 95 6.475 11.384 0.359 346 HB3 ASN 95 1HB ASN 95 7.332 9.855 0.521 347 HD21 ASN 95 1HD2 ASN 95 7.522 12.517 -1.293 348 HD22 ASN 95 2HD2 ASN 95 7.952 11.858 -2.798 349 H SER 96 H SER 96 3.206 8.531 0.879 350 HA SER 96 HA SER 96 4.836 7.043 2.916 351 HB2 SER 96 2HB SER 96 2.821 7.142 4.363 352 HB3 SER 96 1HB SER 96 3.445 8.745 3.976 353 HG SER 96 HG SER 96 1.326 7.394 2.645 354 H ARG 97 H ARG 97 4.337 4.881 3.275 355 HA ARG 97 HA ARG 97 2.195 3.680 1.590 356 HB2 ARG 97 2HB ARG 97 4.449 3.317 0.550 357 HB3 ARG 97 1HB ARG 97 4.951 2.488 2.024 358 HG2 ARG 97 2HG ARG 97 2.402 1.515 0.916 359 HG3 ARG 97 1HG ARG 97 3.790 1.252 -0.138 360 HD2 ARG 97 2HD ARG 97 3.749 0.502 2.795 361 HD3 ARG 97 1HD ARG 97 3.366 -0.624 1.493 362 HE ARG 97 HE ARG 97 6.038 0.403 2.159 363 HH11 ARG 97 1HH1 ARG 97 7.722 -0.549 0.988 364 HH12 ARG 97 2HH1 ARG 97 7.355 -1.518 -0.401 365 HH21 ARG 97 1HH2 ARG 97 3.925 -1.086 -0.123 366 HH22 ARG 97 2HH2 ARG 97 5.204 -1.821 -1.030 367 H ALA 98 H ALA 98 0.816 2.543 2.890 368 HA ALA 98 HA ALA 98 1.788 1.757 5.585 369 HB1 ALA 98 1HB ALA 98 -0.192 3.089 5.703 370 HB2 ALA 98 2HB ALA 98 -0.697 1.434 6.031 371 HB3 ALA 98 3HB ALA 98 -0.983 2.147 4.441 372 H LEU 99 H LEU 99 2.133 -0.348 6.052 373 HA LEU 99 HA LEU 99 1.036 -2.411 4.179 374 HB2 LEU 99 2HB LEU 99 3.501 -2.122 4.023 375 HB3 LEU 99 1HB LEU 99 3.632 -2.503 5.739 376 HG LEU 99 HG LEU 99 2.515 -4.702 5.278 377 HD11 LEU 99 1HD1 LEU 99 2.587 -3.556 2.509 378 HD12 LEU 99 2HD1 LEU 99 1.322 -4.500 3.296 379 HD13 LEU 99 3HD1 LEU 99 2.782 -5.297 2.710 380 HD21 LEU 99 1HD2 LEU 99 4.946 -4.580 5.444 381 HD22 LEU 99 2HD2 LEU 99 5.063 -4.084 3.756 382 HD23 LEU 99 3HD2 LEU 99 4.508 -5.709 4.163 383 H LEU 100 H LEU 100 -0.035 -4.137 5.096 384 HA LEU 100 HA LEU 100 0.005 -4.351 8.081 385 HB2 LEU 100 2HB LEU 100 -2.122 -3.345 7.246 386 HB3 LEU 100 1HB LEU 100 -2.388 -4.789 6.272 387 HG LEU 100 HG LEU 100 -2.263 -6.153 8.383 388 HD11 LEU 100 1HD1 LEU 100 -2.813 -4.595 10.453 389 HD12 LEU 100 2HD1 LEU 100 -1.932 -3.393 9.511 390 HD13 LEU 100 3HD1 LEU 100 -1.141 -4.897 9.982 391 HD21 LEU 100 1HD2 LEU 100 -4.492 -4.915 9.300 392 HD22 LEU 100 2HD2 LEU 100 -4.479 -5.908 7.842 393 HD23 LEU 100 3HD2 LEU 100 -4.359 -4.154 7.714 394 H HIS 101 H HIS 101 -0.054 -6.504 8.885 395 HA HIS 101 HA HIS 101 0.767 -8.530 6.902 396 HB2 HIS 101 2HB HIS 101 0.608 -8.642 9.926 397 HB3 HIS 101 1HB HIS 101 1.272 -9.913 8.897 398 HD1 HIS 101 1HD HIS 101 2.034 -6.651 7.509 399 HD2 HIS 101 2HD HIS 101 3.763 -9.116 10.396 400 HE1 HIS 101 1HE HIS 101 4.405 -5.820 7.833 401 HE2 HIS 101 2HE HIS 101 5.467 -7.311 9.589 402 H SER 102 H SER 102 -0.757 -9.795 5.982 403 HA SER 102 HA SER 102 -3.475 -9.903 6.934 404 HB2 SER 102 2HB SER 102 -3.832 -11.520 5.166 405 HB3 SER 102 1HB SER 102 -2.751 -10.276 4.546 406 HG SER 102 HG SER 102 -1.896 -12.722 5.710 407 H ASP 103 H ASP 103 -0.641 -11.970 7.326 408 HA ASP 103 HA ASP 103 -1.660 -13.131 9.747 409 HB2 ASP 103 2HB ASP 103 -3.039 -14.284 7.864 410 HB3 ASP 103 1HB ASP 103 -1.535 -15.135 7.504 411 H GLU 104 H GLU 104 -0.080 -14.517 10.729 412 HA GLU 104 HA GLU 104 2.631 -13.978 9.904 413 HB2 GLU 104 2HB GLU 104 1.498 -15.909 11.951 414 HB3 GLU 104 1HB GLU 104 3.212 -15.548 11.763 415 HG2 GLU 104 2HG GLU 104 2.734 -13.147 12.186 416 HG3 GLU 104 1HG GLU 104 1.037 -13.550 12.442 417 H HIS 105 H HIS 105 0.410 -16.682 9.468 418 HA HIS 105 HA HIS 105 2.266 -18.668 8.681 419 HB2 HIS 105 2HB HIS 105 -0.098 -19.169 9.073 420 HB3 HIS 105 1HB HIS 105 -0.557 -18.169 7.694 421 HD1 HIS 105 1HD HIS 105 1.502 -21.291 8.445 422 HD2 HIS 105 2HD HIS 105 -0.540 -19.502 5.284 423 HE1 HIS 105 1HE HIS 105 1.557 -22.951 6.528 424 HE2 HIS 105 2HE HIS 105 0.314 -21.872 4.596 425 H GLN 106 H GLN 106 0.732 -16.073 6.804 426 HA GLN 106 HA GLN 106 1.710 -16.852 4.243 427 HB2 GLN 106 2HB GLN 106 0.005 -15.043 4.686 428 HB3 GLN 106 1HB GLN 106 1.329 -14.011 5.231 429 HG2 GLN 106 2HG GLN 106 2.435 -14.342 3.010 430 HG3 GLN 106 1HG GLN 106 1.012 -15.236 2.476 431 HE21 GLN 106 1HE2 GLN 106 -0.453 -13.948 1.361 432 HE22 GLN 106 2HE2 GLN 106 -0.685 -12.286 1.613 433 H LEU 107 H LEU 107 3.138 -14.899 6.820 434 HA LEU 107 HA LEU 107 5.489 -14.079 5.441 435 HB2 LEU 107 2HB LEU 107 4.770 -13.156 7.634 436 HB3 LEU 107 1HB LEU 107 5.159 -14.699 8.393 437 HG LEU 107 HG LEU 107 7.514 -14.447 7.584 438 HD11 LEU 107 1HD1 LEU 107 6.302 -11.970 6.437 439 HD12 LEU 107 2HD1 LEU 107 7.565 -13.008 5.779 440 HD13 LEU 107 3HD1 LEU 107 7.947 -11.858 7.060 441 HD21 LEU 107 1HD2 LEU 107 7.866 -13.569 9.627 442 HD22 LEU 107 2HD2 LEU 107 6.173 -13.075 9.689 443 HD23 LEU 107 3HD2 LEU 107 7.390 -11.976 9.038 444 H LEU 108 H LEU 108 4.804 -16.983 7.393 445 HA LEU 108 HA LEU 108 7.432 -18.122 7.156 446 HB2 LEU 108 2HB LEU 108 4.769 -19.554 7.454 447 HB3 LEU 108 1HB LEU 108 6.358 -20.230 7.813 448 HG LEU 108 HG LEU 108 5.055 -17.875 9.210 449 HD11 LEU 108 1HD1 LEU 108 5.110 -20.753 9.677 450 HD12 LEU 108 2HD1 LEU 108 4.137 -19.513 10.467 451 HD13 LEU 108 3HD1 LEU 108 5.768 -19.856 11.045 452 HD21 LEU 108 1HD2 LEU 108 7.157 -18.379 10.744 453 HD22 LEU 108 2HD2 LEU 108 7.316 -17.335 9.332 454 HD23 LEU 108 3HD2 LEU 108 7.827 -19.021 9.245 455 H THR 109 H THR 109 4.593 -18.077 5.122 456 HA THR 109 HA THR 109 5.475 -20.104 3.261 457 HB THR 109 HB THR 109 3.465 -17.856 2.927 458 HG1 THR 109 1HG THR 109 2.433 -18.999 4.340 459 HG21 THR 109 1HG2 THR 109 2.880 -20.269 1.497 460 HG22 THR 109 2HG2 THR 109 4.512 -19.735 1.092 461 HG23 THR 109 3HG2 THR 109 3.145 -18.645 0.865 462 H ASN 110 H ASN 110 5.889 -16.624 3.553 463 HA ASN 110 HA ASN 110 7.651 -16.687 1.142 464 HB2 ASN 110 2HB ASN 110 6.089 -14.228 1.876 465 HB3 ASN 110 1HB ASN 110 6.751 -14.699 0.311 466 HD21 ASN 110 1HD2 ASN 110 5.737 -17.413 0.269 467 HD22 ASN 110 2HD2 ASN 110 4.048 -17.329 0.123 468 HA PRO 111 HA PRO 111 9.663 -15.040 5.043 469 HB2 PRO 111 2HB PRO 111 11.938 -16.578 4.787 470 HB3 PRO 111 1HB PRO 111 10.527 -17.024 5.754 471 HG2 PRO 111 2HG PRO 111 11.377 -17.981 3.093 472 HG3 PRO 111 1HG PRO 111 10.490 -18.824 4.373 473 HD2 PRO 111 2HD PRO 111 9.325 -17.821 2.084 474 HD3 PRO 111 1HD PRO 111 8.452 -18.106 3.600 475 H LYS 112 H LYS 112 10.443 -15.208 1.714 476 HA LYS 112 HA LYS 112 12.766 -13.384 2.054 477 HB2 LYS 112 2HB LYS 112 11.702 -14.805 -0.407 478 HB3 LYS 112 1HB LYS 112 13.138 -13.780 -0.370 479 HG2 LYS 112 2HG LYS 112 14.121 -15.292 1.361 480 HG3 LYS 112 1HG LYS 112 12.722 -16.353 1.180 481 HD2 LYS 112 2HD LYS 112 13.261 -16.573 -1.252 482 HD3 LYS 112 1HD LYS 112 14.722 -15.623 -0.978 483 HE2 LYS 112 2HE LYS 112 15.385 -17.334 0.769 484 HE3 LYS 112 1HE LYS 112 14.037 -18.323 0.211 485 HZ1 LYS 112 1HZ LYS 112 14.992 -18.571 -1.885 486 HZ2 LYS 112 2HZ LYS 112 16.304 -18.746 -0.819 487 HZ3 LYS 112 3HZ LYS 112 16.077 -17.287 -1.659 488 H CYS 113 H CYS 113 9.743 -12.790 2.315 489 HA CYS 113 HA CYS 113 9.415 -10.851 0.106 490 HB2 CYS 113 2HB CYS 113 7.609 -12.135 2.094 491 HB3 CYS 113 1HB CYS 113 7.156 -10.537 1.502 492 H SER 114 H SER 114 8.355 -10.445 3.471 493 HA SER 114 HA SER 114 9.239 -7.649 3.367 494 HB2 SER 114 2HB SER 114 7.999 -7.352 5.373 495 HB3 SER 114 1HB SER 114 7.059 -8.476 4.397 496 HG SER 114 HG SER 114 7.711 -10.130 5.668 497 H TYR 115 H TYR 115 10.895 -10.430 4.079 498 HA TYR 115 HA TYR 115 12.182 -9.839 6.543 499 HB2 TYR 115 2HB TYR 115 12.980 -11.395 4.100 500 HB3 TYR 115 1HB TYR 115 14.172 -11.098 5.368 501 HD1 TYR 115 1HD TYR 115 10.477 -11.766 5.511 502 HD2 TYR 115 2HD TYR 115 14.423 -13.051 6.624 503 HE1 TYR 115 1HE TYR 115 9.501 -13.584 6.866 504 HE2 TYR 115 2HE TYR 115 13.440 -14.876 7.984 505 HH TYR 115 HH TYR 115 10.932 -16.180 7.770 506 H ILE 116 H ILE 116 12.751 -8.645 3.279 507 HA ILE 116 HA ILE 116 15.192 -7.236 3.972 508 HB ILE 116 HB ILE 116 13.542 -7.679 1.614 509 HG12 ILE 116 2HG1 ILE 116 16.360 -6.607 1.716 510 HG13 ILE 116 1HG1 ILE 116 15.999 -8.283 2.128 511 HG21 ILE 116 1HG2 ILE 116 14.631 -4.882 2.049 512 HG22 ILE 116 2HG2 ILE 116 12.951 -5.332 1.755 513 HG23 ILE 116 3HG2 ILE 116 14.153 -5.530 0.483 514 HD11 ILE 116 1HD1 ILE 116 14.693 -7.420 -0.344 515 HD12 ILE 116 2HD1 ILE 116 15.667 -8.857 -0.031 516 HD13 ILE 116 3HD1 ILE 116 16.451 -7.328 -0.431 517 HA PRO 117 HA PRO 117 13.856 -3.668 6.239 518 HB2 PRO 117 2HB PRO 117 14.863 -2.181 3.832 519 HB3 PRO 117 1HB PRO 117 15.127 -1.843 5.554 520 HG2 PRO 117 2HG PRO 117 16.940 -3.112 3.984 521 HG3 PRO 117 1HG PRO 117 16.809 -3.360 5.731 522 HD2 PRO 117 2HD PRO 117 16.237 -5.254 3.598 523 HD3 PRO 117 1HD PRO 117 16.245 -5.534 5.351 524 HA PRO 118 HA PRO 118 10.091 -3.065 3.666 525 HB2 PRO 118 2HB PRO 118 8.285 -3.997 5.423 526 HB3 PRO 118 1HB PRO 118 9.311 -5.100 4.485 527 HG2 PRO 118 2HG PRO 118 9.465 -4.352 7.339 528 HG3 PRO 118 1HG PRO 118 9.948 -5.851 6.534 529 HD2 PRO 118 2HD PRO 118 11.648 -3.677 7.296 530 HD3 PRO 118 1HD PRO 118 12.105 -5.126 6.377 531 H CYS 119 H CYS 119 8.566 -1.338 3.771 532 HA CYS 119 HA CYS 119 8.900 0.475 6.111 533 HB2 CYS 119 2HB CYS 119 7.366 1.780 4.161 534 HB3 CYS 119 1HB CYS 119 9.085 2.023 4.471 535 H LYS 120 H LYS 120 7.356 0.028 7.636 536 HA LYS 120 HA LYS 120 4.528 -0.119 6.702 537 HB2 LYS 120 2HB LYS 120 4.056 -1.963 8.202 538 HB3 LYS 120 1HB LYS 120 5.411 -2.424 7.172 539 HG2 LYS 120 2HG LYS 120 6.973 -1.694 8.993 540 HG3 LYS 120 1HG LYS 120 5.571 -1.415 10.027 541 HD2 LYS 120 2HD LYS 120 4.905 -3.832 9.568 542 HD3 LYS 120 1HD LYS 120 6.504 -4.041 8.853 543 HE2 LYS 120 2HE LYS 120 6.940 -2.735 11.312 544 HE3 LYS 120 1HE LYS 120 5.760 -4.003 11.647 545 HZ1 LYS 120 1HZ LYS 120 7.953 -4.898 11.862 546 HZ2 LYS 120 2HZ LYS 120 8.397 -4.332 10.323 547 HZ3 LYS 120 3HZ LYS 120 7.240 -5.568 10.477 548 H ARG 121 H ARG 121 3.018 0.774 8.174 549 HA ARG 121 HA ARG 121 3.982 2.838 9.909 550 HB2 ARG 121 2HB ARG 121 1.268 1.496 9.728 551 HB3 ARG 121 1HB ARG 121 1.600 2.944 10.676 552 HG2 ARG 121 2HG ARG 121 2.395 4.074 8.594 553 HG3 ARG 121 1HG ARG 121 1.908 2.649 7.678 554 HD2 ARG 121 2HD ARG 121 0.086 4.398 9.356 555 HD3 ARG 121 1HD ARG 121 0.132 4.334 7.594 556 HE ARG 121 HE ARG 121 -0.381 1.732 8.213 557 HH11 ARG 121 1HH1 ARG 121 -2.427 0.877 8.649 558 HH12 ARG 121 2HH1 ARG 121 -3.665 1.908 9.286 559 HH21 ARG 121 1HH2 ARG 121 -1.654 4.732 9.338 560 HH22 ARG 121 2HH2 ARG 121 -3.227 4.091 9.677 561 H GLU 122 H GLU 122 3.236 -0.537 10.396 562 HA GLU 122 HA GLU 122 3.604 -1.937 12.236 563 HB2 GLU 122 2HB GLU 122 5.741 -0.510 12.389 564 HB3 GLU 122 1HB GLU 122 4.900 0.407 13.638 565 HG2 GLU 122 2HG GLU 122 4.513 -1.710 14.894 566 HG3 GLU 122 1HG GLU 122 5.459 -2.570 13.680 567 H ASN 123 H ASN 123 1.130 -0.713 12.006 568 HA ASN 123 HA ASN 123 0.194 0.746 14.245 569 HB2 ASN 123 2HB ASN 123 -1.352 -1.407 12.773 570 HB3 ASN 123 1HB ASN 123 -2.013 -0.008 13.621 571 HD21 ASN 123 1HD2 ASN 123 -0.177 -0.992 10.739 572 HD22 ASN 123 2HD2 ASN 123 -0.422 0.452 9.881 573 H GLN 124 H GLN 124 0.812 -2.688 13.813 574 HA GLN 124 HA GLN 124 0.940 -4.433 15.374 575 HB2 GLN 124 2HB GLN 124 2.259 -2.637 16.633 576 HB3 GLN 124 1HB GLN 124 0.774 -2.320 17.531 577 HG2 GLN 124 2HG GLN 124 1.996 -3.899 18.839 578 HG3 GLN 124 1HG GLN 124 0.710 -4.815 18.052 579 HE21 GLN 124 1HE2 GLN 124 1.523 -6.781 17.327 580 HE22 GLN 124 2HE2 GLN 124 3.051 -7.010 16.627 581 H LYS 125 H LYS 125 -1.467 -4.359 14.384 582 HA LYS 125 HA LYS 125 -3.507 -3.865 16.444 583 HB2 LYS 125 2HB LYS 125 -3.703 -5.017 13.644 584 HB3 LYS 125 1HB LYS 125 -5.083 -4.670 14.686 585 HG2 LYS 125 2HG LYS 125 -4.345 -2.288 14.804 586 HG3 LYS 125 1HG LYS 125 -3.058 -2.662 13.657 587 HD2 LYS 125 2HD LYS 125 -4.794 -3.444 12.035 588 HD3 LYS 125 1HD LYS 125 -6.039 -2.918 13.167 589 HE2 LYS 125 2HE LYS 125 -5.346 -0.626 12.999 590 HE3 LYS 125 1HE LYS 125 -3.886 -1.070 12.116 591 HZ1 LYS 125 1HZ LYS 125 -6.635 -0.875 11.179 592 HZ2 LYS 125 2HZ LYS 125 -5.708 -2.147 10.542 593 HZ3 LYS 125 3HZ LYS 125 -5.185 -0.541 10.366 594 H ASN 126 H ASN 126 -4.928 -5.598 17.217 595 HA ASN 126 HA ASN 126 -3.498 -7.951 18.014 596 HB2 ASN 126 2HB ASN 126 -6.505 -7.625 17.943 597 HB3 ASN 126 1HB ASN 126 -5.569 -8.679 19.000 598 HD21 ASN 126 1HD2 ASN 126 -3.503 -6.879 19.785 599 HD22 ASN 126 2HD2 ASN 126 -4.192 -5.625 20.698 600 H LEU 127 H LEU 127 -4.057 -10.189 17.420 601 HA LEU 127 HA LEU 127 -4.058 -10.617 14.599 602 HB2 LEU 127 2HB LEU 127 -4.889 -12.612 16.720 603 HB3 LEU 127 1HB LEU 127 -4.224 -12.967 15.126 604 HG LEU 127 HG LEU 127 -2.809 -11.652 17.453 605 HD11 LEU 127 1HD1 LEU 127 -3.100 -14.317 16.703 606 HD12 LEU 127 2HD1 LEU 127 -1.858 -13.673 17.776 607 HD13 LEU 127 3HD1 LEU 127 -1.523 -13.867 16.055 608 HD21 LEU 127 1HD2 LEU 127 -2.116 -11.820 14.525 609 HD22 LEU 127 2HD2 LEU 127 -0.845 -11.740 15.747 610 HD23 LEU 127 3HD2 LEU 127 -2.016 -10.428 15.604 611 H GLU 128 H GLU 128 -6.668 -10.708 16.992 612 HA GLU 128 HA GLU 128 -8.670 -11.799 15.294 613 HB2 GLU 128 2HB GLU 128 -8.903 -11.489 17.766 614 HB3 GLU 128 1HB GLU 128 -9.066 -9.753 17.497 615 HG2 GLU 128 2HG GLU 128 -11.029 -10.201 16.025 616 HG3 GLU 128 1HG GLU 128 -10.897 -11.914 16.420 617 H SER 129 H SER 129 -7.574 -8.456 15.770 618 HA SER 129 HA SER 129 -9.586 -7.186 14.201 619 HB2 SER 129 2HB SER 129 -7.928 -6.002 15.672 620 HB3 SER 129 1HB SER 129 -6.686 -6.343 14.470 621 HG SER 129 HG SER 129 -7.585 -4.942 13.126 622 H VAL 130 H VAL 130 -6.539 -8.746 13.311 623 HA VAL 130 HA VAL 130 -6.518 -7.903 10.575 624 HB VAL 130 HB VAL 130 -5.358 -10.377 11.886 625 HG11 VAL 130 1HG1 VAL 130 -3.864 -10.287 9.792 626 HG12 VAL 130 2HG1 VAL 130 -5.100 -9.237 9.097 627 HG13 VAL 130 3HG1 VAL 130 -5.507 -10.887 9.567 628 HG21 VAL 130 1HG2 VAL 130 -3.260 -9.086 11.780 629 HG22 VAL 130 2HG2 VAL 130 -4.479 -8.201 12.698 630 HG23 VAL 130 3HG2 VAL 130 -4.118 -7.738 11.035 631 H MET 131 H MET 131 -7.994 -10.715 12.189 632 HA MET 131 HA MET 131 -8.801 -12.138 9.887 633 HB2 MET 131 2HB MET 131 -9.066 -13.012 12.186 634 HB3 MET 131 1HB MET 131 -10.320 -11.811 12.492 635 HG2 MET 131 2HG MET 131 -11.414 -13.891 11.921 636 HG3 MET 131 1HG MET 131 -11.622 -12.788 10.563 637 HE1 MET 131 1HE MET 131 -12.296 -14.423 9.104 638 HE2 MET 131 2HE MET 131 -11.218 -15.374 8.086 639 HE3 MET 131 3HE MET 131 -11.103 -13.617 8.078 640 H ASN 132 H ASN 132 -10.418 -9.458 11.576 641 HA ASN 132 HA ASN 132 -12.728 -9.386 9.886 642 HB2 ASN 132 2HB ASN 132 -12.390 -8.161 12.107 643 HB3 ASN 132 1HB ASN 132 -11.450 -6.977 11.199 644 HD21 ASN 132 1HD2 ASN 132 -13.631 -5.849 12.289 645 HD22 ASN 132 2HD2 ASN 132 -14.888 -5.650 11.166 646 H TRP 133 H TRP 133 -9.521 -7.915 9.646 647 HA TRP 133 HA TRP 133 -10.083 -6.257 7.376 648 HB2 TRP 133 2HB TRP 133 -8.111 -5.659 8.449 649 HB3 TRP 133 1HB TRP 133 -7.598 -7.336 8.653 650 HD1 TRP 133 HD TRP 133 -6.621 -8.600 6.501 651 HE1 TRP 133 1HE TRP 133 -5.493 -7.694 4.368 652 HE3 TRP 133 3HE TRP 133 -8.028 -3.700 6.777 653 HZ2 TRP 133 2HZ TRP 133 -5.226 -5.221 2.963 654 HZ3 TRP 133 3HZ TRP 133 -7.321 -2.092 5.030 655 HH2 TRP 133 HH TRP 133 -5.923 -2.845 3.126 656 H GLN 134 H GLN 134 -8.569 -9.500 7.572 657 HA GLN 134 HA GLN 134 -8.232 -9.750 4.749 658 HB2 GLN 134 2HB GLN 134 -7.521 -11.915 5.157 659 HB3 GLN 134 1HB GLN 134 -7.286 -11.194 6.746 660 HG2 GLN 134 2HG GLN 134 -8.404 -13.208 7.216 661 HG3 GLN 134 1HG GLN 134 -9.698 -12.017 7.240 662 HE21 GLN 134 1HE2 GLN 134 -11.459 -13.211 6.400 663 HE22 GLN 134 2HE2 GLN 134 -11.437 -14.007 4.902 664 H GLN 135 H GLN 135 -10.926 -10.752 6.862 665 HA GLN 135 HA GLN 135 -12.446 -11.938 4.706 666 HB2 GLN 135 2HB GLN 135 -12.792 -12.367 7.184 667 HB3 GLN 135 1HB GLN 135 -13.532 -10.770 7.282 668 HG2 GLN 135 2HG GLN 135 -15.193 -11.439 5.577 669 HG3 GLN 135 1HG GLN 135 -14.461 -13.044 5.506 670 HE21 GLN 135 1HE2 GLN 135 -17.114 -13.012 6.241 671 HE22 GLN 135 2HE2 GLN 135 -17.284 -13.300 7.905 672 H TYR 136 H TYR 136 -12.493 -8.772 6.301 673 HA TYR 136 HA TYR 136 -14.627 -7.679 4.698 674 HB2 TYR 136 2HB TYR 136 -14.042 -6.728 6.869 675 HB3 TYR 136 1HB TYR 136 -12.423 -6.338 6.289 676 HD1 TYR 136 1HD TYR 136 -12.114 -4.639 4.485 677 HD2 TYR 136 2HD TYR 136 -15.925 -5.338 6.343 678 HE1 TYR 136 1HE TYR 136 -12.932 -2.461 3.628 679 HE2 TYR 136 2HE TYR 136 -16.745 -3.163 5.481 680 HH TYR 136 HH TYR 136 -15.645 -1.590 3.117 681 H TRP 137 H TRP 137 -11.089 -7.191 4.587 682 HA TRP 137 HA TRP 137 -11.131 -5.550 2.245 683 HB2 TRP 137 2HB TRP 137 -9.229 -5.644 3.827 684 HB3 TRP 137 1HB TRP 137 -8.895 -7.297 3.313 685 HD1 TRP 137 HD TRP 137 -8.432 -3.704 2.292 686 HE1 TRP 137 1HE TRP 137 -7.046 -3.602 0.119 687 HE3 TRP 137 3HE TRP 137 -8.395 -8.634 1.068 688 HZ2 TRP 137 2HZ TRP 137 -6.054 -5.400 -1.884 689 HZ3 TRP 137 3HZ TRP 137 -7.229 -9.430 -0.974 690 HH2 TRP 137 HH TRP 137 -6.058 -7.816 -2.451 691 H LYS 138 H LYS 138 -10.624 -9.056 2.647 692 HA LYS 138 HA LYS 138 -10.072 -9.577 -0.116 693 HB2 LYS 138 2HB LYS 138 -9.595 -11.165 1.754 694 HB3 LYS 138 1HB LYS 138 -11.329 -11.456 1.897 695 HG2 LYS 138 2HG LYS 138 -11.381 -12.202 -0.469 696 HG3 LYS 138 1HG LYS 138 -9.635 -11.970 -0.565 697 HD2 LYS 138 2HD LYS 138 -9.371 -13.590 1.331 698 HD3 LYS 138 1HD LYS 138 -11.106 -13.898 1.253 699 HE2 LYS 138 2HE LYS 138 -9.433 -14.149 -1.233 700 HE3 LYS 138 1HE LYS 138 -9.473 -15.468 -0.063 701 HZ1 LYS 138 1HZ LYS 138 -11.879 -14.225 -1.276 702 HZ2 LYS 138 2HZ LYS 138 -11.843 -15.583 -0.255 703 HZ3 LYS 138 3HZ LYS 138 -11.172 -15.670 -1.813 704 H ASP 139 H ASP 139 -13.122 -9.749 1.727 705 HA ASP 139 HA ASP 139 -14.701 -10.641 -0.495 706 HB2 ASP 139 2HB ASP 139 -15.475 -9.119 2.004 707 HB3 ASP 139 1HB ASP 139 -16.631 -9.815 0.868 708 H GLU 140 H GLU 140 -14.088 -7.367 0.796 709 HA GLU 140 HA GLU 140 -15.740 -6.120 -1.244 710 HB2 GLU 140 2HB GLU 140 -13.704 -4.971 0.684 711 HB3 GLU 140 1HB GLU 140 -14.716 -3.998 -0.385 712 HG2 GLU 140 2HG GLU 140 -16.737 -5.034 0.646 713 HG3 GLU 140 1HG GLU 140 -15.686 -5.888 1.777 714 H ILE 141 H ILE 141 -12.299 -6.783 -0.811 715 HA ILE 141 HA ILE 141 -11.868 -5.760 -3.578 716 HB ILE 141 HB ILE 141 -9.853 -5.905 -1.325 717 HG12 ILE 141 2HG1 ILE 141 -11.204 -3.479 -2.548 718 HG13 ILE 141 1HG1 ILE 141 -11.664 -4.194 -1.001 719 HG21 ILE 141 1HG2 ILE 141 -8.944 -6.121 -3.650 720 HG22 ILE 141 2HG2 ILE 141 -8.412 -4.652 -2.836 721 HG23 ILE 141 3HG2 ILE 141 -9.692 -4.574 -4.047 722 HD11 ILE 141 1HD1 ILE 141 -8.777 -3.694 -1.254 723 HD12 ILE 141 2HD1 ILE 141 -9.875 -3.306 0.071 724 HD13 ILE 141 3HD1 ILE 141 -9.760 -2.231 -1.321 725 H GLY 142 H GLY 142 -11.721 -7.505 -4.903 726 HA2 GLY 142 2HA GLY 142 -10.816 -10.104 -3.976 727 HA3 GLY 142 1HA GLY 142 -11.119 -9.658 -5.659 728 H SER 143 H SER 143 -9.402 -7.398 -5.762 729 HA SER 143 HA SER 143 -6.818 -7.448 -4.905 730 HB2 SER 143 2HB SER 143 -5.829 -8.906 -6.940 731 HB3 SER 143 1HB SER 143 -6.182 -9.612 -5.367 732 HG SER 143 HG SER 143 -8.235 -9.423 -7.262 733 H GLN 144 H GLN 144 -7.894 -5.324 -5.786 734 HA GLN 144 HA GLN 144 -6.732 -4.850 -8.476 735 HB2 GLN 144 2HB GLN 144 -9.585 -4.286 -7.662 736 HB3 GLN 144 1HB GLN 144 -8.821 -3.511 -9.048 737 HG2 GLN 144 2HG GLN 144 -8.241 -5.844 -9.882 738 HG3 GLN 144 1HG GLN 144 -9.310 -6.467 -8.626 739 HE21 GLN 144 1HE2 GLN 144 -9.800 -3.484 -10.551 740 HE22 GLN 144 2HE2 GLN 144 -11.235 -4.010 -11.291 741 HA PRO 145 HA PRO 145 -5.437 -1.541 -5.451 742 HB2 PRO 145 2HB PRO 145 -3.373 -1.319 -7.589 743 HB3 PRO 145 1HB PRO 145 -3.174 -1.377 -5.830 744 HG2 PRO 145 2HG PRO 145 -2.578 -3.461 -7.395 745 HG3 PRO 145 1HG PRO 145 -3.224 -3.658 -5.757 746 HD2 PRO 145 2HD PRO 145 -4.582 -4.072 -8.374 747 HD3 PRO 145 1HD PRO 145 -4.879 -4.859 -6.810 748 H PHE 146 H PHE 146 -5.281 0.864 -5.905 749 HA PHE 146 HA PHE 146 -6.157 1.635 -8.624 750 HB2 PHE 146 2HB PHE 146 -7.898 3.148 -7.649 751 HB3 PHE 146 1HB PHE 146 -8.254 1.437 -7.455 752 HD1 PHE 146 1HD PHE 146 -7.194 0.417 -5.155 753 HD2 PHE 146 2HD PHE 146 -8.257 4.517 -5.847 754 HE1 PHE 146 1HE PHE 146 -7.415 0.771 -2.710 755 HE2 PHE 146 2HE PHE 146 -8.489 4.869 -3.408 756 HZ PHE 146 HZ PHE 146 -8.064 2.999 -1.837 757 H THR 147 H THR 147 -5.660 3.769 -9.209 758 HA THR 147 HA THR 147 -3.712 5.110 -7.393 759 HB THR 147 HB THR 147 -2.766 6.120 -9.433 760 HG1 THR 147 1HG THR 147 -3.585 5.533 -11.424 761 HG21 THR 147 1HG2 THR 147 -1.503 4.255 -9.218 762 HG22 THR 147 2HG2 THR 147 -2.433 3.646 -10.587 763 HG23 THR 147 3HG2 THR 147 -2.910 3.229 -8.940 764 H CYS 148 H CYS 148 -3.811 7.451 -7.348 765 HA CYS 148 HA CYS 148 -6.322 8.633 -8.361 766 HB2 CYS 148 2HB CYS 148 -5.699 9.507 -5.634 767 HB3 CYS 148 1HB CYS 148 -7.231 8.963 -6.310 768 H TYR 149 H TYR 149 -6.226 11.014 -8.350 769 HA TYR 149 HA TYR 149 -3.556 12.217 -7.861 770 HB2 TYR 149 2HB TYR 149 -4.914 12.374 -10.575 771 HB3 TYR 149 1HB TYR 149 -3.435 13.206 -10.105 772 HD1 TYR 149 1HD TYR 149 -1.368 11.934 -9.628 773 HD2 TYR 149 2HD TYR 149 -4.914 10.019 -11.110 774 HE1 TYR 149 1HE TYR 149 -0.032 9.933 -10.240 775 HE2 TYR 149 2HE TYR 149 -3.581 8.020 -11.725 776 HH TYR 149 HH TYR 149 -1.312 6.990 -10.860 777 H PHE 150 H PHE 150 -3.840 14.291 -7.075 778 HA PHE 150 HA PHE 150 -6.374 15.657 -7.741 779 HB2 PHE 150 2HB PHE 150 -7.231 15.656 -5.637 780 HB3 PHE 150 1HB PHE 150 -6.154 14.289 -5.374 781 HD1 PHE 150 1HD PHE 150 -6.844 17.765 -4.616 782 HD2 PHE 150 2HD PHE 150 -3.889 14.666 -4.354 783 HE1 PHE 150 1HE PHE 150 -5.656 19.068 -2.877 784 HE2 PHE 150 2HE PHE 150 -2.681 15.960 -2.618 785 HZ PHE 150 HZ PHE 150 -3.566 18.154 -1.870 786 H ASN 151 H ASN 151 -6.215 17.911 -7.740 787 HA ASN 151 HA ASN 151 -3.597 19.040 -6.873 788 HB2 ASN 151 2HB ASN 151 -3.217 20.114 -8.992 789 HB3 ASN 151 1HB ASN 151 -3.499 18.403 -9.300 790 HD21 ASN 151 1HD2 ASN 151 -3.970 20.437 -11.301 791 HD22 ASN 151 2HD2 ASN 151 -5.636 20.477 -11.619 792 H GLN 152 H GLN 152 -3.755 20.989 -5.979 793 HA GLN 152 HA GLN 152 -6.391 22.318 -5.828 794 HB2 GLN 152 2HB GLN 152 -4.918 21.930 -3.781 795 HB3 GLN 152 1HB GLN 152 -3.804 23.116 -4.460 796 HG2 GLN 152 2HG GLN 152 -5.532 24.832 -4.423 797 HG3 GLN 152 1HG GLN 152 -6.728 23.660 -3.876 798 HE21 GLN 152 1HE2 GLN 152 -6.410 25.815 -2.212 799 HE22 GLN 152 2HE2 GLN 152 -5.520 25.396 -0.829 800 H HIS 153 H HIS 153 -3.751 22.328 -7.820 801 HA HIS 153 HA HIS 153 -2.942 24.931 -8.263 802 HB2 HIS 153 2HB HIS 153 -3.620 22.774 -10.276 803 HB3 HIS 153 1HB HIS 153 -2.788 24.267 -10.695 804 HD1 HIS 153 1HD HIS 153 -0.350 23.864 -10.851 805 HD2 HIS 153 2HD HIS 153 -2.049 21.617 -7.766 806 HE1 HIS 153 1HE HIS 153 1.547 22.588 -9.761 807 HE2 HIS 153 2HE HIS 153 0.525 21.222 -7.884 808 H GLN 154 H GLN 154 -6.053 23.486 -9.177 809 HA GLN 154 HA GLN 154 -6.902 25.810 -10.701 810 HB2 GLN 154 2HB GLN 154 -8.464 23.523 -9.466 811 HB3 GLN 154 1HB GLN 154 -9.160 24.745 -10.525 812 HG2 GLN 154 2HG GLN 154 -7.605 24.094 -12.321 813 HG3 GLN 154 1HG GLN 154 -6.893 22.876 -11.262 814 HE21 GLN 154 1HE2 GLN 154 -8.024 21.968 -13.642 815 HE22 GLN 154 2HE2 GLN 154 -9.480 21.157 -13.324 816 H ARG 155 H ARG 155 -8.290 24.482 -7.696 817 HA ARG 155 HA ARG 155 -7.953 26.930 -6.224 818 HB2 ARG 155 2HB ARG 155 -10.156 26.977 -7.966 819 HB3 ARG 155 1HB ARG 155 -10.838 26.626 -6.378 820 HG2 ARG 155 2HG ARG 155 -10.778 28.991 -6.485 821 HG3 ARG 155 1HG ARG 155 -9.389 28.549 -5.496 822 HD2 ARG 155 2HD ARG 155 -7.860 28.969 -7.250 823 HD3 ARG 155 1HD ARG 155 -9.125 28.931 -8.479 824 HE ARG 155 HE ARG 155 -9.581 31.195 -7.999 825 HH11 ARG 155 1HH1 ARG 155 -9.225 33.122 -6.872 826 HH12 ARG 155 2HH1 ARG 155 -8.298 33.096 -5.409 827 HH21 ARG 155 1HH2 ARG 155 -7.736 29.677 -5.513 828 HH22 ARG 155 2HH2 ARG 155 -7.456 31.146 -4.639 829 HA PRO 156 HA PRO 156 -10.160 23.704 -3.601 830 HB2 PRO 156 2HB PRO 156 -11.818 21.886 -4.701 831 HB3 PRO 156 1HB PRO 156 -12.285 23.584 -4.520 832 HG2 PRO 156 2HG PRO 156 -11.640 22.089 -6.949 833 HG3 PRO 156 1HG PRO 156 -12.518 23.613 -6.764 834 HD2 PRO 156 2HD PRO 156 -9.706 23.207 -7.455 835 HD3 PRO 156 1HD PRO 156 -10.649 24.707 -7.482 836 H ASP 157 H ASP 157 -10.584 21.042 -5.763 837 HA ASP 157 HA ASP 157 -7.925 19.961 -5.648 838 HB2 ASP 157 2HB ASP 157 -9.000 18.051 -4.001 839 HB3 ASP 157 1HB ASP 157 -7.961 19.368 -3.450 840 H ASP 158 H ASP 158 -8.699 19.573 -7.892 841 HA ASP 158 HA ASP 158 -10.952 17.938 -8.524 842 HB2 ASP 158 2HB ASP 158 -8.269 18.186 -9.932 843 HB3 ASP 158 1HB ASP 158 -9.675 17.368 -10.615 844 H VAL 159 H VAL 159 -11.000 15.566 -8.876 845 HA VAL 159 HA VAL 159 -8.722 14.144 -7.556 846 HB VAL 159 HB VAL 159 -10.309 12.714 -6.364 847 HG11 VAL 159 1HG1 VAL 159 -9.535 14.927 -5.402 848 HG12 VAL 159 2HG1 VAL 159 -11.057 14.329 -4.743 849 HG13 VAL 159 3HG1 VAL 159 -11.064 15.618 -5.947 850 HG21 VAL 159 1HG2 VAL 159 -12.325 12.513 -7.409 851 HG22 VAL 159 2HG2 VAL 159 -12.198 14.106 -8.157 852 HG23 VAL 159 3HG2 VAL 159 -12.756 13.955 -6.490 853 H LEU 160 H LEU 160 -8.304 12.060 -8.268 854 HA LEU 160 HA LEU 160 -9.871 11.067 -10.612 855 HB2 LEU 160 2HB LEU 160 -6.900 11.402 -10.287 856 HB3 LEU 160 1HB LEU 160 -7.527 10.129 -11.331 857 HG LEU 160 HG LEU 160 -8.892 11.874 -12.525 858 HD11 LEU 160 1HD1 LEU 160 -7.514 14.215 -11.987 859 HD12 LEU 160 2HD1 LEU 160 -7.736 13.515 -10.386 860 HD13 LEU 160 3HD1 LEU 160 -9.134 13.830 -11.411 861 HD21 LEU 160 1HD2 LEU 160 -7.113 12.521 -13.927 862 HD22 LEU 160 2HD2 LEU 160 -6.493 11.067 -13.143 863 HD23 LEU 160 3HD2 LEU 160 -5.982 12.658 -12.580 864 H LEU 161 H LEU 161 -10.022 8.732 -10.685 865 HA LEU 161 HA LEU 161 -8.765 7.281 -8.416 866 HB2 LEU 161 2HB LEU 161 -11.064 8.078 -7.743 867 HB3 LEU 161 1HB LEU 161 -11.719 7.054 -9.021 868 HG LEU 161 HG LEU 161 -10.145 5.241 -7.828 869 HD11 LEU 161 1HD1 LEU 161 -9.307 6.825 -6.141 870 HD12 LEU 161 2HD1 LEU 161 -10.256 5.550 -5.376 871 HD13 LEU 161 3HD1 LEU 161 -10.958 7.149 -5.615 872 HD21 LEU 161 1HD2 LEU 161 -12.470 4.841 -8.167 873 HD22 LEU 161 2HD2 LEU 161 -12.929 6.135 -7.061 874 HD23 LEU 161 3HD2 LEU 161 -12.204 4.656 -6.434 875 H HIS 162 H HIS 162 -7.661 6.694 -10.679 876 HA HIS 162 HA HIS 162 -9.090 4.866 -12.406 877 HB2 HIS 162 2HB HIS 162 -6.113 5.234 -11.924 878 HB3 HIS 162 1HB HIS 162 -6.800 4.239 -13.207 879 HD1 HIS 162 1HD HIS 162 -5.087 6.637 -14.014 880 HD2 HIS 162 2HD HIS 162 -9.220 6.873 -13.499 881 HE1 HIS 162 1HE HIS 162 -5.865 8.645 -15.353 882 HE2 HIS 162 2HE HIS 162 -8.379 8.795 -15.046 883 H ARG 163 H ARG 163 -9.013 2.539 -12.371 884 HA ARG 163 HA ARG 163 -8.131 1.402 -9.742 885 HB2 ARG 163 2HB ARG 163 -10.405 0.554 -11.553 886 HB3 ARG 163 1HB ARG 163 -9.918 -0.295 -10.085 887 HG2 ARG 163 2HG ARG 163 -10.318 1.796 -8.785 888 HG3 ARG 163 1HG ARG 163 -10.909 2.566 -10.258 889 HD2 ARG 163 2HD ARG 163 -12.610 0.711 -10.447 890 HD3 ARG 163 1HD ARG 163 -12.101 0.162 -8.850 891 HE ARG 163 HE ARG 163 -13.243 2.007 -7.904 892 HH11 ARG 163 1HH1 ARG 163 -14.584 3.820 -8.064 893 HH12 ARG 163 2HH1 ARG 163 -14.841 4.558 -9.610 894 HH21 ARG 163 1HH2 ARG 163 -12.815 2.317 -11.312 895 HH22 ARG 163 2HH2 ARG 163 -13.839 3.707 -11.448 896 H THR 164 H THR 164 -7.288 -0.768 -9.763 897 HA THR 164 HA THR 164 -5.601 -1.338 -12.065 898 HB THR 164 HB THR 164 -6.145 -2.908 -9.538 899 HG1 THR 164 1HG THR 164 -3.731 -1.663 -10.165 900 HG21 THR 164 1HG2 THR 164 -3.684 -3.678 -10.556 901 HG22 THR 164 2HG2 THR 164 -4.701 -3.573 -11.993 902 HG23 THR 164 3HG2 THR 164 -5.174 -4.616 -10.653 903 H HIS 165 H HIS 165 -5.938 -2.884 -13.647 904 HA HIS 165 HA HIS 165 -8.514 -4.406 -13.492 905 HB2 HIS 165 2HB HIS 165 -7.020 -3.354 -15.914 906 HB3 HIS 165 1HB HIS 165 -8.460 -4.370 -15.988 907 HD1 HIS 165 1HD HIS 165 -7.322 -0.893 -15.187 908 HD2 HIS 165 2HD HIS 165 -10.885 -3.064 -15.187 909 HE1 HIS 165 1HE HIS 165 -9.194 0.796 -14.921 910 HE2 HIS 165 2HE HIS 165 -11.364 -0.515 -14.922 911 H ASP 166 H ASP 166 -8.391 -6.613 -13.744 912 HA ASP 166 HA ASP 166 -7.301 -8.705 -13.668 913 HB2 ASP 166 2HB ASP 166 -6.093 -7.409 -16.129 914 HB3 ASP 166 1HB ASP 166 -5.944 -9.124 -15.741 Start of MODEL 11 1 H1 GLN 45 1HT GLN 45 5.960 19.543 -1.669 2 H2 GLN 45 2HT GLN 45 5.304 18.055 -2.161 3 H3 GLN 45 3HT GLN 45 4.522 18.979 -0.968 4 HA GLN 45 HA GLN 45 3.774 18.986 -3.506 5 HB2 GLN 45 2HB GLN 45 3.781 21.334 -1.584 6 HB3 GLN 45 1HB GLN 45 2.751 21.209 -3.009 7 HG2 GLN 45 2HG GLN 45 1.726 19.164 -2.118 8 HG3 GLN 45 1HG GLN 45 2.782 19.236 -0.707 9 HE21 GLN 45 1HE2 GLN 45 -0.049 19.319 -0.387 10 HE22 GLN 45 2HE2 GLN 45 -0.490 20.864 0.160 11 H ASP 46 H ASP 46 6.585 19.082 -3.817 12 HA ASP 46 HA ASP 46 7.677 21.606 -4.467 13 HB2 ASP 46 2HB ASP 46 8.914 19.398 -4.431 14 HB3 ASP 46 1HB ASP 46 8.189 19.043 -5.998 15 H LEU 47 H LEU 47 5.717 19.397 -6.438 16 HA LEU 47 HA LEU 47 5.622 21.398 -8.618 17 HB2 LEU 47 2HB LEU 47 4.300 18.671 -8.444 18 HB3 LEU 47 1HB LEU 47 4.510 19.654 -9.896 19 HG LEU 47 HG LEU 47 6.781 18.557 -8.215 20 HD11 LEU 47 1HD1 LEU 47 5.710 16.715 -9.319 21 HD12 LEU 47 2HD1 LEU 47 7.139 17.115 -10.272 22 HD13 LEU 47 3HD1 LEU 47 5.542 17.630 -10.817 23 HD21 LEU 47 1HD2 LEU 47 7.730 20.377 -9.281 24 HD22 LEU 47 2HD2 LEU 47 6.571 20.336 -10.610 25 HD23 LEU 47 3HD2 LEU 47 7.900 19.177 -10.563 26 H GLN 48 H GLN 48 3.708 22.579 -9.053 27 HA GLN 48 HA GLN 48 1.931 23.034 -6.910 28 HB2 GLN 48 2HB GLN 48 2.263 24.519 -8.954 29 HB3 GLN 48 1HB GLN 48 1.172 23.423 -9.809 30 HG2 GLN 48 2HG GLN 48 -0.184 25.213 -8.942 31 HG3 GLN 48 1HG GLN 48 -0.500 23.797 -7.935 32 HE21 GLN 48 1HE2 GLN 48 0.530 23.743 -5.763 33 HE22 GLN 48 2HE2 GLN 48 1.059 25.181 -5.030 34 H ALA 49 H ALA 49 1.620 20.840 -9.680 35 HA ALA 49 HA ALA 49 -1.038 19.943 -8.951 36 HB1 ALA 49 1HB ALA 49 -0.321 17.920 -10.420 37 HB2 ALA 49 2HB ALA 49 1.137 18.857 -10.743 38 HB3 ALA 49 3HB ALA 49 -0.440 19.497 -11.201 39 H THR 50 H THR 50 -1.588 18.114 -7.656 40 HA THR 50 HA THR 50 0.718 16.997 -6.118 41 HB THR 50 HB THR 50 -2.146 17.158 -5.178 42 HG1 THR 50 1HG THR 50 0.010 18.833 -4.439 43 HG21 THR 50 1HG2 THR 50 -1.094 15.552 -3.863 44 HG22 THR 50 2HG2 THR 50 -0.756 17.021 -2.944 45 HG23 THR 50 3HG2 THR 50 0.482 16.331 -3.988 46 H GLU 51 H GLU 51 0.771 14.808 -5.687 47 HA GLU 51 HA GLU 51 -1.125 13.150 -7.276 48 HB2 GLU 51 2HB GLU 51 1.757 12.567 -6.581 49 HB3 GLU 51 1HB GLU 51 0.710 11.572 -7.592 50 HG2 GLU 51 2HG GLU 51 0.476 13.499 -9.169 51 HG3 GLU 51 1HG GLU 51 1.630 14.399 -8.186 52 H ALA 52 H ALA 52 -2.062 11.390 -6.229 53 HA ALA 52 HA ALA 52 -1.019 10.585 -3.588 54 HB1 ALA 52 1HB ALA 52 -3.382 10.757 -2.641 55 HB2 ALA 52 2HB ALA 52 -3.776 11.757 -4.038 56 HB3 ALA 52 3HB ALA 52 -2.557 12.298 -2.882 57 H ASN 53 H ASN 53 -0.808 8.411 -4.065 58 HA ASN 53 HA ASN 53 -3.014 7.198 -5.641 59 HB2 ASN 53 2HB ASN 53 -0.148 6.738 -5.544 60 HB3 ASN 53 1HB ASN 53 -1.059 5.238 -5.347 61 HD21 ASN 53 1HD2 ASN 53 -2.180 8.101 -7.171 62 HD22 ASN 53 2HD2 ASN 53 -2.190 7.337 -8.686 63 H CYS 54 H CYS 54 -4.347 5.663 -4.819 64 HA CYS 54 HA CYS 54 -3.767 4.711 -2.043 65 HB2 CYS 54 2HB CYS 54 -6.597 5.000 -2.633 66 HB3 CYS 54 1HB CYS 54 -5.680 5.662 -1.284 67 H THR 55 H THR 55 -3.210 2.598 -2.674 68 HA THR 55 HA THR 55 -5.332 1.194 -4.230 69 HB THR 55 HB THR 55 -3.828 0.516 -5.761 70 HG1 THR 55 1HG THR 55 -1.984 -0.604 -5.100 71 HG21 THR 55 1HG2 THR 55 -1.677 2.043 -4.293 72 HG22 THR 55 2HG2 THR 55 -2.945 2.876 -5.182 73 HG23 THR 55 3HG2 THR 55 -1.846 1.792 -6.026 74 H VAL 56 H VAL 56 -5.733 -0.949 -3.771 75 HA VAL 56 HA VAL 56 -4.986 -1.789 -1.038 76 HB VAL 56 HB VAL 56 -7.085 -2.604 -3.043 77 HG11 VAL 56 1HG1 VAL 56 -6.417 -4.752 -2.450 78 HG12 VAL 56 2HG1 VAL 56 -7.602 -4.402 -1.191 79 HG13 VAL 56 3HG1 VAL 56 -5.880 -4.252 -0.846 80 HG21 VAL 56 1HG2 VAL 56 -7.062 -0.954 -0.800 81 HG22 VAL 56 2HG2 VAL 56 -7.766 -2.459 -0.206 82 HG23 VAL 56 3HG2 VAL 56 -8.496 -1.625 -1.578 83 H LEU 57 H LEU 57 -3.058 -2.804 -1.048 84 HA LEU 57 HA LEU 57 -1.546 -3.909 -3.014 85 HB2 LEU 57 2HB LEU 57 -1.548 -4.015 -0.264 86 HB3 LEU 57 1HB LEU 57 -1.745 -5.706 -0.703 87 HG LEU 57 HG LEU 57 0.636 -5.149 -0.483 88 HD11 LEU 57 1HD1 LEU 57 1.283 -6.343 -2.331 89 HD12 LEU 57 2HD1 LEU 57 0.308 -5.373 -3.435 90 HD13 LEU 57 3HD1 LEU 57 -0.454 -6.611 -2.435 91 HD21 LEU 57 1HD2 LEU 57 1.504 -3.217 -1.260 92 HD22 LEU 57 2HD2 LEU 57 -0.143 -2.724 -1.653 93 HD23 LEU 57 3HD2 LEU 57 0.859 -3.509 -2.875 94 H SER 58 H SER 58 -1.424 -5.876 -4.147 95 HA SER 58 HA SER 58 -3.968 -7.389 -4.274 96 HB2 SER 58 2HB SER 58 -2.896 -6.517 -6.380 97 HB3 SER 58 1HB SER 58 -1.528 -7.581 -6.069 98 HG SER 58 HG SER 58 -2.862 -8.748 -7.343 99 H VAL 59 H VAL 59 -3.940 -9.711 -3.975 100 HA VAL 59 HA VAL 59 -1.685 -10.569 -2.260 101 HB VAL 59 HB VAL 59 -4.176 -12.160 -2.891 102 HG11 VAL 59 1HG1 VAL 59 -3.605 -13.428 -1.045 103 HG12 VAL 59 2HG1 VAL 59 -2.784 -12.087 -0.247 104 HG13 VAL 59 3HG1 VAL 59 -1.992 -12.943 -1.570 105 HG21 VAL 59 1HG2 VAL 59 -4.664 -10.962 -0.463 106 HG22 VAL 59 2HG2 VAL 59 -5.329 -10.405 -1.999 107 HG23 VAL 59 3HG2 VAL 59 -3.871 -9.658 -1.347 108 H GLN 60 H GLN 60 -0.017 -11.531 -3.264 109 HA GLN 60 HA GLN 60 -0.574 -13.566 -5.347 110 HB2 GLN 60 2HB GLN 60 1.494 -11.368 -5.651 111 HB3 GLN 60 1HB GLN 60 1.178 -12.666 -6.802 112 HG2 GLN 60 2HG GLN 60 -0.822 -10.546 -5.960 113 HG3 GLN 60 1HG GLN 60 0.061 -10.567 -7.487 114 HE21 GLN 60 1HE2 GLN 60 -2.952 -11.041 -6.613 115 HE22 GLN 60 2HE2 GLN 60 -3.376 -12.415 -7.513 116 H GLN 61 H GLN 61 1.217 -15.085 -5.598 117 HA GLN 61 HA GLN 61 2.577 -15.606 -3.075 118 HB2 GLN 61 2HB GLN 61 2.972 -16.949 -5.761 119 HB3 GLN 61 1HB GLN 61 3.438 -17.594 -4.190 120 HG2 GLN 61 2HG GLN 61 0.618 -17.027 -5.141 121 HG3 GLN 61 1HG GLN 61 1.339 -18.617 -4.887 122 HE21 GLN 61 1HE2 GLN 61 -0.612 -16.334 -3.404 123 HE22 GLN 61 2HE2 GLN 61 -0.361 -16.783 -1.792 124 H ILE 62 H ILE 62 5.047 -16.199 -3.277 125 HA ILE 62 HA ILE 62 6.591 -13.924 -3.529 126 HB ILE 62 HB ILE 62 7.470 -16.743 -4.236 127 HG12 ILE 62 2HG1 ILE 62 7.597 -15.273 -1.585 128 HG13 ILE 62 1HG1 ILE 62 6.349 -16.449 -1.997 129 HG21 ILE 62 1HG2 ILE 62 9.672 -15.754 -3.254 130 HG22 ILE 62 2HG2 ILE 62 8.943 -14.189 -3.604 131 HG23 ILE 62 3HG2 ILE 62 9.237 -15.340 -4.910 132 HD11 ILE 62 1HD1 ILE 62 9.325 -17.028 -2.016 133 HD12 ILE 62 2HD1 ILE 62 8.029 -18.192 -2.289 134 HD13 ILE 62 3HD1 ILE 62 8.232 -17.456 -0.700 135 H GLY 63 H GLY 63 8.392 -13.589 -5.264 136 HA2 GLY 63 2HA GLY 63 9.027 -13.586 -7.599 137 HA3 GLY 63 1HA GLY 63 7.412 -14.170 -8.008 138 H GLU 64 H GLU 64 6.922 -11.895 -5.721 139 HA GLU 64 HA GLU 64 6.680 -9.692 -7.722 140 HB2 GLU 64 2HB GLU 64 4.484 -10.644 -6.973 141 HB3 GLU 64 1HB GLU 64 4.901 -10.200 -5.318 142 HG2 GLU 64 2HG GLU 64 3.531 -8.428 -6.216 143 HG3 GLU 64 1HG GLU 64 5.185 -7.822 -6.120 144 H VAL 65 H VAL 65 7.407 -7.649 -7.034 145 HA VAL 65 HA VAL 65 8.587 -7.546 -4.289 146 HB VAL 65 HB VAL 65 10.421 -6.203 -5.200 147 HG11 VAL 65 1HG1 VAL 65 9.957 -8.738 -6.801 148 HG12 VAL 65 2HG1 VAL 65 10.655 -8.664 -5.183 149 HG13 VAL 65 3HG1 VAL 65 11.515 -7.951 -6.548 150 HG21 VAL 65 1HG2 VAL 65 10.592 -6.046 -7.728 151 HG22 VAL 65 2HG2 VAL 65 9.317 -5.061 -7.012 152 HG23 VAL 65 3HG2 VAL 65 8.915 -6.587 -7.801 153 H PHE 66 H PHE 66 8.400 -5.558 -3.204 154 HA PHE 66 HA PHE 66 6.710 -3.501 -4.548 155 HB2 PHE 66 2HB PHE 66 6.531 -4.508 -1.698 156 HB3 PHE 66 1HB PHE 66 5.665 -3.096 -2.308 157 HD1 PHE 66 1HD PHE 66 5.938 -6.760 -2.422 158 HD2 PHE 66 2HD PHE 66 3.866 -3.323 -3.945 159 HE1 PHE 66 1HE PHE 66 4.169 -8.234 -3.339 160 HE2 PHE 66 2HE PHE 66 2.097 -4.792 -4.860 161 HZ PHE 66 HZ PHE 66 2.245 -7.251 -4.561 162 H GLU 67 H GLU 67 7.022 -1.317 -3.719 163 HA GLU 67 HA GLU 67 9.625 -0.944 -2.297 164 HB2 GLU 67 2HB GLU 67 10.163 0.899 -3.788 165 HB3 GLU 67 1HB GLU 67 9.813 -0.522 -4.769 166 HG2 GLU 67 2HG GLU 67 7.458 0.306 -5.023 167 HG3 GLU 67 1HG GLU 67 7.932 1.782 -4.180 168 H CYS 68 H CYS 68 9.709 0.907 -0.926 169 HA CYS 68 HA CYS 68 7.028 2.084 -0.324 170 HB2 CYS 68 2HB CYS 68 8.576 2.778 1.813 171 HB3 CYS 68 1HB CYS 68 7.598 1.312 1.747 172 H THR 69 H THR 69 7.019 4.434 0.151 173 HA THR 69 HA THR 69 9.303 5.839 -1.174 174 HB THR 69 HB THR 69 7.866 7.023 -2.494 175 HG1 THR 69 1HG THR 69 6.277 8.094 -1.624 176 HG21 THR 69 1HG2 THR 69 5.965 4.819 -1.649 177 HG22 THR 69 2HG2 THR 69 7.280 4.607 -2.806 178 HG23 THR 69 3HG2 THR 69 5.946 5.699 -3.179 179 H PHE 70 H PHE 70 9.832 7.916 -0.381 180 HA PHE 70 HA PHE 70 8.442 8.891 2.037 181 HB2 PHE 70 2HB PHE 70 10.511 9.087 3.326 182 HB3 PHE 70 1HB PHE 70 10.233 7.399 2.897 183 HD1 PHE 70 1HD PHE 70 11.573 6.311 1.123 184 HD2 PHE 70 2HD PHE 70 12.340 10.348 2.375 185 HE1 PHE 70 1HE PHE 70 13.784 6.239 0.001 186 HE2 PHE 70 2HE PHE 70 14.551 10.277 1.252 187 HZ PHE 70 HZ PHE 70 15.273 8.221 0.067 188 H THR 71 H THR 71 9.311 11.113 2.621 189 HA THR 71 HA THR 71 10.491 12.479 0.249 190 HB THR 71 HB THR 71 8.215 13.563 1.932 191 HG1 THR 71 1HG THR 71 8.119 11.729 0.108 192 HG21 THR 71 1HG2 THR 71 8.848 15.512 1.003 193 HG22 THR 71 2HG2 THR 71 8.378 14.843 -0.558 194 HG23 THR 71 3HG2 THR 71 10.047 14.704 -0.005 195 H CYS 72 H CYS 72 11.839 14.251 0.753 196 HA CYS 72 HA CYS 72 12.347 14.694 3.665 197 HB2 CYS 72 2HB CYS 72 14.321 13.635 3.275 198 HB3 CYS 72 1HB CYS 72 14.199 13.836 1.532 199 H GLY 73 H GLY 73 13.513 16.826 4.018 200 HA2 GLY 73 2HA GLY 73 12.134 18.895 2.461 201 HA3 GLY 73 1HA GLY 73 13.098 19.162 3.914 202 H ALA 74 H ALA 74 13.047 20.245 1.014 203 HA ALA 74 HA ALA 74 14.843 21.521 0.028 204 HB1 ALA 74 1HB ALA 74 16.440 20.570 1.815 205 HB2 ALA 74 2HB ALA 74 17.117 20.935 0.230 206 HB3 ALA 74 3HB ALA 74 16.744 19.269 0.660 207 H ASP 75 H ASP 75 12.954 19.752 -1.060 208 HA ASP 75 HA ASP 75 12.494 18.568 -3.027 209 HB2 ASP 75 2HB ASP 75 15.120 19.861 -3.829 210 HB3 ASP 75 1HB ASP 75 14.020 19.052 -4.945 211 H CYS 76 H CYS 76 13.600 17.016 -1.008 212 HA CYS 76 HA CYS 76 15.444 15.199 -2.523 213 HB2 CYS 76 2HB CYS 76 15.807 14.438 0.041 214 HB3 CYS 76 1HB CYS 76 16.768 15.711 -0.715 215 H ARG 77 H ARG 77 14.247 13.494 -3.233 216 HA ARG 77 HA ARG 77 12.383 12.218 -1.282 217 HB2 ARG 77 2HB ARG 77 10.980 11.670 -3.416 218 HB3 ARG 77 1HB ARG 77 10.837 13.278 -2.704 219 HG2 ARG 77 2HG ARG 77 13.035 13.018 -4.649 220 HG3 ARG 77 1HG ARG 77 11.427 12.799 -5.341 221 HD2 ARG 77 2HD ARG 77 12.134 15.128 -3.541 222 HD3 ARG 77 1HD ARG 77 12.268 15.200 -5.299 223 HE ARG 77 HE ARG 77 9.666 14.292 -4.774 224 HH11 ARG 77 1HH1 ARG 77 7.933 15.742 -4.684 225 HH12 ARG 77 2HH1 ARG 77 8.236 17.413 -4.341 226 HH21 ARG 77 1HH2 ARG 77 11.667 17.005 -4.055 227 HH22 ARG 77 2HH2 ARG 77 10.350 18.129 -3.984 228 H GLY 78 H GLY 78 12.280 9.906 -1.491 229 HA2 GLY 78 2HA GLY 78 13.746 8.584 -3.648 230 HA3 GLY 78 1HA GLY 78 14.563 8.491 -2.087 231 H THR 79 H THR 79 13.669 6.176 -3.370 232 HA THR 79 HA THR 79 11.531 5.298 -1.493 233 HB THR 79 HB THR 79 10.544 3.918 -3.276 234 HG1 THR 79 1HG THR 79 12.611 5.112 -4.786 235 HG21 THR 79 1HG2 THR 79 10.423 6.719 -3.057 236 HG22 THR 79 2HG2 THR 79 9.232 5.659 -3.810 237 HG23 THR 79 3HG2 THR 79 10.510 6.382 -4.787 238 H SER 80 H SER 80 11.574 2.938 -1.116 239 HA SER 80 HA SER 80 14.302 1.780 -1.558 240 HB2 SER 80 2HB SER 80 12.419 1.308 0.773 241 HB3 SER 80 1HB SER 80 14.009 0.578 0.569 242 HG SER 80 HG SER 80 14.404 3.120 0.269 243 H GLN 81 H GLN 81 14.345 -0.499 -2.055 244 HA GLN 81 HA GLN 81 11.715 -1.540 -3.013 245 HB2 GLN 81 2HB GLN 81 13.453 -1.099 -4.765 246 HB3 GLN 81 1HB GLN 81 14.479 -2.294 -3.979 247 HG2 GLN 81 2HG GLN 81 13.342 -3.440 -5.749 248 HG3 GLN 81 1HG GLN 81 12.575 -3.950 -4.243 249 HE21 GLN 81 1HE2 GLN 81 10.357 -3.533 -4.011 250 HE22 GLN 81 2HE2 GLN 81 9.446 -2.611 -5.101 251 H TYR 82 H TYR 82 10.992 -3.436 -2.162 252 HA TYR 82 HA TYR 82 12.934 -5.177 -0.733 253 HB2 TYR 82 2HB TYR 82 10.387 -3.981 0.349 254 HB3 TYR 82 1HB TYR 82 11.037 -5.478 1.013 255 HD1 TYR 82 1HD TYR 82 11.032 -2.009 1.396 256 HD2 TYR 82 2HD TYR 82 13.717 -5.362 1.417 257 HE1 TYR 82 1HE TYR 82 12.653 -0.703 2.745 258 HE2 TYR 82 2HE TYR 82 15.337 -4.057 2.768 259 HH TYR 82 HH TYR 82 15.057 -0.688 3.218 260 HA PRO 83 HA PRO 83 11.063 -8.645 -2.786 261 HB2 PRO 83 2HB PRO 83 10.489 -9.788 -0.091 262 HB3 PRO 83 1HB PRO 83 11.320 -10.521 -1.474 263 HG2 PRO 83 2HG PRO 83 12.639 -9.608 0.665 264 HG3 PRO 83 1HG PRO 83 13.313 -9.544 -0.971 265 HD2 PRO 83 2HD PRO 83 12.310 -7.329 0.723 266 HD3 PRO 83 1HD PRO 83 13.467 -7.298 -0.624 267 H CYS 84 H CYS 84 9.026 -10.328 -1.522 268 HA CYS 84 HA CYS 84 6.668 -8.913 -2.373 269 HB2 CYS 84 2HB CYS 84 6.172 -11.117 -2.585 270 HB3 CYS 84 1HB CYS 84 7.330 -11.587 -1.340 271 H VAL 85 H VAL 85 4.913 -8.165 -1.076 272 HA VAL 85 HA VAL 85 5.586 -7.713 1.806 273 HB VAL 85 HB VAL 85 5.734 -5.648 0.349 274 HG11 VAL 85 1HG1 VAL 85 2.750 -5.600 0.265 275 HG12 VAL 85 2HG1 VAL 85 3.581 -6.594 -0.932 276 HG13 VAL 85 3HG1 VAL 85 3.916 -4.864 -0.834 277 HG21 VAL 85 1HG2 VAL 85 4.659 -4.261 1.960 278 HG22 VAL 85 2HG2 VAL 85 5.107 -5.719 2.845 279 HG23 VAL 85 3HG2 VAL 85 3.441 -5.486 2.316 280 H GLN 86 H GLN 86 3.795 -7.812 3.258 281 HA GLN 86 HA GLN 86 1.812 -9.738 2.692 282 HB2 GLN 86 2HB GLN 86 1.719 -7.504 4.737 283 HB3 GLN 86 1HB GLN 86 0.699 -8.943 4.742 284 HG2 GLN 86 2HG GLN 86 2.435 -9.556 6.196 285 HG3 GLN 86 1HG GLN 86 2.956 -10.248 4.660 286 HE21 GLN 86 1HE2 GLN 86 5.073 -9.742 4.099 287 HE22 GLN 86 2HE2 GLN 86 5.922 -8.371 4.629 288 H VAL 87 H VAL 87 -0.597 -8.388 3.630 289 HA VAL 87 HA VAL 87 -1.254 -6.864 1.144 290 HB VAL 87 HB VAL 87 -3.006 -8.680 2.807 291 HG11 VAL 87 1HG1 VAL 87 -4.657 -8.208 0.931 292 HG12 VAL 87 2HG1 VAL 87 -3.598 -6.887 0.437 293 HG13 VAL 87 3HG1 VAL 87 -4.367 -6.854 2.025 294 HG21 VAL 87 1HG2 VAL 87 -1.324 -9.729 1.237 295 HG22 VAL 87 2HG2 VAL 87 -2.128 -8.887 -0.088 296 HG23 VAL 87 3HG2 VAL 87 -3.005 -10.098 0.848 297 H TYR 88 H TYR 88 -2.348 -4.961 1.303 298 HA TYR 88 HA TYR 88 -3.894 -4.131 3.533 299 HB2 TYR 88 2HB TYR 88 -1.586 -4.032 4.548 300 HB3 TYR 88 1HB TYR 88 -1.222 -2.766 3.400 301 HD1 TYR 88 1HD TYR 88 -4.633 -2.213 4.037 302 HD2 TYR 88 2HD TYR 88 -0.810 -1.941 6.003 303 HE1 TYR 88 1HE TYR 88 -5.549 -0.567 5.596 304 HE2 TYR 88 2HE TYR 88 -1.751 -0.275 7.564 305 HH TYR 88 HH TYR 88 -3.903 0.420 8.433 306 H VAL 89 H VAL 89 -2.425 -1.355 3.075 307 HA VAL 89 HA VAL 89 -3.484 -0.806 0.357 308 HB VAL 89 HB VAL 89 -5.258 -0.248 2.035 309 HG11 VAL 89 1HG1 VAL 89 -3.368 0.438 3.728 310 HG12 VAL 89 2HG1 VAL 89 -4.907 1.298 3.749 311 HG13 VAL 89 3HG1 VAL 89 -3.508 2.014 2.949 312 HG21 VAL 89 1HG2 VAL 89 -5.612 2.076 1.221 313 HG22 VAL 89 2HG2 VAL 89 -5.134 0.989 -0.083 314 HG23 VAL 89 3HG2 VAL 89 -3.955 2.098 0.617 315 H ASN 90 H ASN 90 -2.260 0.714 -0.745 316 HA ASN 90 HA ASN 90 0.195 1.633 0.618 317 HB2 ASN 90 2HB ASN 90 -0.714 1.822 -2.268 318 HB3 ASN 90 1HB ASN 90 0.855 2.344 -1.674 319 HD21 ASN 90 1HD2 ASN 90 -0.022 -0.309 0.162 320 HD22 ASN 90 2HD2 ASN 90 0.756 -1.524 -0.730 321 H ASN 91 H ASN 91 0.143 3.622 1.581 322 HA ASN 91 HA ASN 91 -1.954 5.532 0.723 323 HB2 ASN 91 2HB ASN 91 -0.059 5.619 3.090 324 HB3 ASN 91 1HB ASN 91 -1.376 6.753 2.787 325 HD21 ASN 91 1HD2 ASN 91 -3.394 4.941 1.916 326 HD22 ASN 91 2HD2 ASN 91 -3.805 3.919 3.209 327 H SER 92 H SER 92 -0.928 6.160 -1.257 328 HA SER 92 HA SER 92 1.719 7.440 -1.078 329 HB2 SER 92 2HB SER 92 -0.157 6.941 -3.378 330 HB3 SER 92 1HB SER 92 1.368 7.795 -3.551 331 HG SER 92 HG SER 92 1.249 5.276 -2.296 332 H GLU 93 H GLU 93 -1.025 8.446 0.041 333 HA GLU 93 HA GLU 93 -1.475 10.939 -1.389 334 HB2 GLU 93 2HB GLU 93 -3.039 11.454 0.360 335 HB3 GLU 93 1HB GLU 93 -3.187 9.721 0.066 336 HG2 GLU 93 2HG GLU 93 -1.565 9.338 1.957 337 HG3 GLU 93 1HG GLU 93 -1.651 11.064 2.310 338 H SER 94 H SER 94 0.843 9.780 0.751 339 HA SER 94 HA SER 94 2.028 12.463 1.032 340 HB2 SER 94 2HB SER 94 0.534 11.993 3.070 341 HB3 SER 94 1HB SER 94 1.679 10.720 3.480 342 HG SER 94 HG SER 94 3.221 12.202 3.826 343 H ASN 95 H ASN 95 2.609 9.942 -0.393 344 HA ASN 95 HA ASN 95 4.459 8.591 -0.864 345 HB2 ASN 95 2HB ASN 95 5.944 10.486 0.981 346 HB3 ASN 95 1HB ASN 95 6.643 9.459 -0.268 347 HD21 ASN 95 1HD2 ASN 95 5.065 9.865 -2.471 348 HD22 ASN 95 2HD2 ASN 95 5.035 11.505 -2.909 349 H SER 96 H SER 96 2.793 7.572 1.087 350 HA SER 96 HA SER 96 4.748 6.317 2.973 351 HB2 SER 96 2HB SER 96 2.888 6.192 4.632 352 HB3 SER 96 1HB SER 96 3.349 7.848 4.248 353 HG SER 96 HG SER 96 1.587 7.392 2.498 354 H ARG 97 H ARG 97 4.370 4.107 3.443 355 HA ARG 97 HA ARG 97 2.326 2.758 1.735 356 HB2 ARG 97 2HB ARG 97 4.674 2.491 0.869 357 HB3 ARG 97 1HB ARG 97 5.092 1.701 2.390 358 HG2 ARG 97 2HG ARG 97 4.548 -0.167 1.158 359 HG3 ARG 97 1HG ARG 97 2.942 0.230 1.769 360 HD2 ARG 97 2HD ARG 97 2.881 -0.174 -0.662 361 HD3 ARG 97 1HD ARG 97 2.468 1.500 -0.291 362 HE ARG 97 HE ARG 97 5.297 1.238 -0.791 363 HH11 ARG 97 1HH1 ARG 97 6.066 2.051 -2.756 364 HH12 ARG 97 2HH1 ARG 97 4.953 2.355 -4.047 365 HH21 ARG 97 1HH2 ARG 97 2.174 1.316 -2.250 366 HH22 ARG 97 2HH2 ARG 97 2.749 1.938 -3.760 367 H ALA 98 H ALA 98 0.902 1.649 3.006 368 HA ALA 98 HA ALA 98 1.790 0.866 5.742 369 HB1 ALA 98 1HB ALA 98 -1.076 0.667 5.024 370 HB2 ALA 98 2HB ALA 98 -0.407 2.299 5.030 371 HB3 ALA 98 3HB ALA 98 -0.323 1.308 6.485 372 H LEU 99 H LEU 99 2.069 -1.271 6.163 373 HA LEU 99 HA LEU 99 0.802 -3.249 4.307 374 HB2 LEU 99 2HB LEU 99 2.793 -4.713 4.816 375 HB3 LEU 99 1HB LEU 99 3.170 -3.267 3.883 376 HG LEU 99 HG LEU 99 3.380 -2.444 6.549 377 HD11 LEU 99 1HD1 LEU 99 3.360 -4.759 7.311 378 HD12 LEU 99 2HD1 LEU 99 4.992 -4.111 7.479 379 HD13 LEU 99 3HD1 LEU 99 4.604 -5.187 6.137 380 HD21 LEU 99 1HD2 LEU 99 5.883 -2.553 5.977 381 HD22 LEU 99 2HD2 LEU 99 4.866 -1.633 4.870 382 HD23 LEU 99 3HD2 LEU 99 5.389 -3.262 4.441 383 H LEU 100 H LEU 100 -0.355 -4.866 5.259 384 HA LEU 100 HA LEU 100 -0.165 -5.191 8.220 385 HB2 LEU 100 2HB LEU 100 -2.544 -4.799 6.446 386 HB3 LEU 100 1HB LEU 100 -2.713 -5.863 7.832 387 HG LEU 100 HG LEU 100 -1.641 -3.038 7.990 388 HD11 LEU 100 1HD1 LEU 100 -4.414 -4.154 8.431 389 HD12 LEU 100 2HD1 LEU 100 -3.937 -2.845 7.352 390 HD13 LEU 100 3HD1 LEU 100 -3.896 -2.606 9.098 391 HD21 LEU 100 1HD2 LEU 100 -0.933 -3.828 9.996 392 HD22 LEU 100 2HD2 LEU 100 -1.936 -5.273 9.879 393 HD23 LEU 100 3HD2 LEU 100 -2.632 -3.760 10.457 394 H HIS 101 H HIS 101 -0.703 -7.395 8.947 395 HA HIS 101 HA HIS 101 -0.079 -9.394 6.827 396 HB2 HIS 101 2HB HIS 101 -0.184 -9.937 9.793 397 HB3 HIS 101 1HB HIS 101 0.712 -10.809 8.550 398 HD1 HIS 101 1HD HIS 101 1.872 -8.187 7.160 399 HD2 HIS 101 2HD HIS 101 2.107 -9.087 11.226 400 HE1 HIS 101 1HE HIS 101 3.828 -6.862 8.073 401 HE2 HIS 101 2HE HIS 101 3.983 -7.404 10.549 402 H SER 102 H SER 102 -1.801 -10.459 5.983 403 HA SER 102 HA SER 102 -4.436 -10.321 7.136 404 HB2 SER 102 2HB SER 102 -5.093 -11.825 5.355 405 HB3 SER 102 1HB SER 102 -3.932 -10.678 4.694 406 HG SER 102 HG SER 102 -3.191 -12.623 4.055 407 H ASP 103 H ASP 103 -1.845 -12.718 7.244 408 HA ASP 103 HA ASP 103 -2.809 -13.850 9.698 409 HB2 ASP 103 2HB ASP 103 -4.473 -14.763 7.965 410 HB3 ASP 103 1HB ASP 103 -3.120 -15.700 7.329 411 H GLU 104 H GLU 104 -1.397 -15.634 10.410 412 HA GLU 104 HA GLU 104 1.331 -15.247 9.623 413 HB2 GLU 104 2HB GLU 104 0.018 -17.477 11.208 414 HB3 GLU 104 1HB GLU 104 1.758 -17.238 11.072 415 HG2 GLU 104 2HG GLU 104 1.502 -14.961 12.033 416 HG3 GLU 104 1HG GLU 104 -0.225 -15.262 12.232 417 H HIS 105 H HIS 105 -1.169 -17.497 8.597 418 HA HIS 105 HA HIS 105 0.434 -19.478 7.379 419 HB2 HIS 105 2HB HIS 105 -1.986 -19.727 7.602 420 HB3 HIS 105 1HB HIS 105 -2.249 -18.369 6.507 421 HD1 HIS 105 1HD HIS 105 -0.681 -21.844 6.494 422 HD2 HIS 105 2HD HIS 105 -2.279 -19.059 3.837 423 HE1 HIS 105 1HE HIS 105 -0.757 -22.979 4.228 424 HE2 HIS 105 2HE HIS 105 -1.730 -21.293 2.601 425 H GLN 106 H GLN 106 -0.644 -16.327 6.137 426 HA GLN 106 HA GLN 106 0.358 -16.643 3.481 427 HB2 GLN 106 2HB GLN 106 -1.130 -14.768 4.252 428 HB3 GLN 106 1HB GLN 106 0.255 -14.076 5.095 429 HG2 GLN 106 2HG GLN 106 1.491 -13.945 2.960 430 HG3 GLN 106 1HG GLN 106 0.097 -14.621 2.116 431 HE21 GLN 106 1HE2 GLN 106 0.899 -12.121 1.269 432 HE22 GLN 106 2HE2 GLN 106 -0.175 -10.928 1.815 433 H LEU 107 H LEU 107 1.872 -15.499 6.466 434 HA LEU 107 HA LEU 107 4.390 -14.752 5.334 435 HB2 LEU 107 2HB LEU 107 3.637 -14.157 7.646 436 HB3 LEU 107 1HB LEU 107 3.831 -15.845 8.110 437 HG LEU 107 HG LEU 107 6.239 -15.691 7.374 438 HD11 LEU 107 1HD1 LEU 107 6.781 -13.887 6.126 439 HD12 LEU 107 2HD1 LEU 107 6.704 -12.946 7.616 440 HD13 LEU 107 3HD1 LEU 107 5.292 -13.049 6.565 441 HD21 LEU 107 1HD2 LEU 107 6.344 -13.653 9.375 442 HD22 LEU 107 2HD2 LEU 107 6.565 -15.391 9.582 443 HD23 LEU 107 3HD2 LEU 107 4.955 -14.682 9.725 444 H LEU 108 H LEU 108 3.213 -17.803 6.739 445 HA LEU 108 HA LEU 108 5.649 -19.271 6.391 446 HB2 LEU 108 2HB LEU 108 3.677 -19.989 7.802 447 HB3 LEU 108 1HB LEU 108 2.818 -20.358 6.308 448 HG LEU 108 HG LEU 108 4.712 -21.885 5.672 449 HD11 LEU 108 1HD1 LEU 108 6.624 -21.595 6.848 450 HD12 LEU 108 2HD1 LEU 108 5.832 -22.494 8.143 451 HD13 LEU 108 3HD1 LEU 108 5.789 -20.731 8.138 452 HD21 LEU 108 1HD2 LEU 108 3.325 -23.448 6.510 453 HD22 LEU 108 2HD2 LEU 108 2.634 -22.254 7.607 454 HD23 LEU 108 3HD2 LEU 108 4.030 -23.207 8.108 455 H THR 109 H THR 109 2.946 -18.505 4.291 456 HA THR 109 HA THR 109 3.625 -20.336 2.179 457 HB THR 109 HB THR 109 2.052 -17.745 2.123 458 HG1 THR 109 1HG THR 109 0.292 -19.305 2.203 459 HG21 THR 109 1HG2 THR 109 2.538 -19.933 0.150 460 HG22 THR 109 2HG2 THR 109 2.423 -18.193 -0.109 461 HG23 THR 109 3HG2 THR 109 0.964 -19.141 0.174 462 H ASN 110 H ASN 110 4.361 -16.916 2.817 463 HA ASN 110 HA ASN 110 6.521 -17.113 0.769 464 HB2 ASN 110 2HB ASN 110 4.698 -14.728 1.178 465 HB3 ASN 110 1HB ASN 110 6.012 -14.847 0.006 466 HD21 ASN 110 1HD2 ASN 110 5.260 -17.800 -0.432 467 HD22 ASN 110 2HD2 ASN 110 3.903 -17.732 -1.449 468 HA PRO 111 HA PRO 111 7.919 -15.612 5.039 469 HB2 PRO 111 2HB PRO 111 10.197 -17.375 4.349 470 HB3 PRO 111 1HB PRO 111 9.270 -17.269 5.856 471 HG2 PRO 111 2HG PRO 111 9.020 -19.323 4.152 472 HG3 PRO 111 1HG PRO 111 7.671 -18.722 5.130 473 HD2 PRO 111 2HD PRO 111 8.187 -18.360 2.211 474 HD3 PRO 111 1HD PRO 111 6.648 -18.472 3.088 475 H LYS 112 H LYS 112 9.281 -15.708 1.832 476 HA LYS 112 HA LYS 112 11.595 -14.057 2.501 477 HB2 LYS 112 2HB LYS 112 10.383 -14.832 -0.167 478 HB3 LYS 112 1HB LYS 112 11.912 -13.973 0.030 479 HG2 LYS 112 2HG LYS 112 12.757 -15.877 1.410 480 HG3 LYS 112 1HG LYS 112 11.260 -16.745 1.071 481 HD2 LYS 112 2HD LYS 112 11.750 -16.553 -1.372 482 HD3 LYS 112 1HD LYS 112 13.297 -15.807 -0.969 483 HE2 LYS 112 2HE LYS 112 13.489 -18.263 -1.401 484 HE3 LYS 112 1HE LYS 112 14.000 -17.811 0.225 485 HZ1 LYS 112 1HZ LYS 112 11.972 -18.562 1.126 486 HZ2 LYS 112 2HZ LYS 112 12.488 -19.787 0.067 487 HZ3 LYS 112 3HZ LYS 112 11.252 -18.720 -0.402 488 H CYS 113 H CYS 113 8.372 -13.355 2.339 489 HA CYS 113 HA CYS 113 8.301 -10.979 0.752 490 HB2 CYS 113 2HB CYS 113 6.656 -11.831 3.147 491 HB3 CYS 113 1HB CYS 113 6.302 -10.400 2.179 492 H SER 114 H SER 114 9.390 -11.558 4.062 493 HA SER 114 HA SER 114 10.451 -8.788 4.081 494 HB2 SER 114 2HB SER 114 8.454 -9.904 6.033 495 HB3 SER 114 1HB SER 114 9.612 -8.683 6.554 496 HG SER 114 HG SER 114 8.199 -8.298 4.163 497 H TYR 115 H TYR 115 11.925 -11.177 3.781 498 HA TYR 115 HA TYR 115 12.947 -11.998 6.393 499 HB2 TYR 115 2HB TYR 115 14.406 -13.445 5.205 500 HB3 TYR 115 1HB TYR 115 12.923 -13.423 4.253 501 HD1 TYR 115 1HD TYR 115 16.444 -12.400 4.398 502 HD2 TYR 115 2HD TYR 115 12.805 -12.172 2.133 503 HE1 TYR 115 1HE TYR 115 17.720 -11.607 2.425 504 HE2 TYR 115 2HE TYR 115 14.076 -11.380 0.160 505 HH TYR 115 HH TYR 115 17.060 -11.770 -0.376 506 H ILE 116 H ILE 116 13.381 -9.289 4.463 507 HA ILE 116 HA ILE 116 16.015 -8.709 5.768 508 HB ILE 116 HB ILE 116 16.010 -7.073 3.583 509 HG12 ILE 116 2HG1 ILE 116 14.730 -9.677 2.708 510 HG13 ILE 116 1HG1 ILE 116 13.869 -8.146 2.828 511 HG21 ILE 116 1HG2 ILE 116 17.946 -8.329 3.992 512 HG22 ILE 116 2HG2 ILE 116 17.342 -9.083 2.519 513 HG23 ILE 116 3HG2 ILE 116 17.058 -9.849 4.080 514 HD11 ILE 116 1HD1 ILE 116 16.402 -8.287 1.219 515 HD12 ILE 116 2HD1 ILE 116 15.027 -7.199 1.040 516 HD13 ILE 116 3HD1 ILE 116 14.896 -8.878 0.521 517 HA PRO 117 HA PRO 117 14.676 -5.051 7.790 518 HB2 PRO 117 2HB PRO 117 16.119 -3.556 5.629 519 HB3 PRO 117 1HB PRO 117 16.147 -3.299 7.383 520 HG2 PRO 117 2HG PRO 117 18.096 -4.620 6.057 521 HG3 PRO 117 1HG PRO 117 17.663 -4.957 7.739 522 HD2 PRO 117 2HD PRO 117 17.295 -6.658 5.395 523 HD3 PRO 117 1HD PRO 117 17.072 -7.066 7.109 524 HA PRO 118 HA PRO 118 11.321 -4.179 4.752 525 HB2 PRO 118 2HB PRO 118 9.248 -4.435 6.489 526 HB3 PRO 118 1HB PRO 118 10.025 -5.831 5.717 527 HG2 PRO 118 2HG PRO 118 10.271 -4.822 8.485 528 HG3 PRO 118 1HG PRO 118 10.373 -6.477 7.867 529 HD2 PRO 118 2HD PRO 118 12.554 -4.841 8.559 530 HD3 PRO 118 1HD PRO 118 12.638 -6.343 7.616 531 H CYS 119 H CYS 119 10.086 -2.226 4.468 532 HA CYS 119 HA CYS 119 10.755 -0.109 6.437 533 HB2 CYS 119 2HB CYS 119 9.828 1.375 4.541 534 HB3 CYS 119 1HB CYS 119 11.359 0.557 4.238 535 H LYS 120 H LYS 120 9.204 0.045 7.993 536 HA LYS 120 HA LYS 120 6.367 0.254 7.097 537 HB2 LYS 120 2HB LYS 120 5.651 -1.087 9.027 538 HB3 LYS 120 1HB LYS 120 6.758 -2.022 8.019 539 HG2 LYS 120 2HG LYS 120 8.635 -1.313 9.529 540 HG3 LYS 120 1HG LYS 120 7.438 -0.562 10.585 541 HD2 LYS 120 2HD LYS 120 6.288 -2.793 10.754 542 HD3 LYS 120 1HD LYS 120 7.640 -3.497 9.864 543 HE2 LYS 120 2HE LYS 120 8.100 -1.862 12.356 544 HE3 LYS 120 1HE LYS 120 7.736 -3.586 12.450 545 HZ1 LYS 120 1HZ LYS 120 10.179 -2.804 12.286 546 HZ2 LYS 120 2HZ LYS 120 9.841 -2.637 10.629 547 HZ3 LYS 120 3HZ LYS 120 9.674 -4.149 11.385 548 H ARG 121 H ARG 121 5.253 1.907 8.117 549 HA ARG 121 HA ARG 121 6.768 3.812 9.685 550 HB2 ARG 121 2HB ARG 121 3.813 3.616 9.047 551 HB3 ARG 121 1HB ARG 121 4.564 4.986 9.860 552 HG2 ARG 121 2HG ARG 121 6.093 5.253 7.898 553 HG3 ARG 121 1HG ARG 121 5.198 3.975 7.075 554 HD2 ARG 121 2HD ARG 121 4.049 6.603 8.060 555 HD3 ARG 121 1HD ARG 121 4.356 6.170 6.379 556 HE ARG 121 HE ARG 121 2.658 4.181 7.501 557 HH11 ARG 121 1HH1 ARG 121 0.440 4.279 7.082 558 HH12 ARG 121 2HH1 ARG 121 -0.269 5.777 6.581 559 HH21 ARG 121 1HH2 ARG 121 2.722 7.527 6.674 560 HH22 ARG 121 2HH2 ARG 121 1.023 7.617 6.350 561 H GLU 122 H GLU 122 4.382 1.316 10.430 562 HA GLU 122 HA GLU 122 4.867 1.831 13.327 563 HB2 GLU 122 2HB GLU 122 2.557 2.467 12.549 564 HB3 GLU 122 1HB GLU 122 2.303 0.782 12.097 565 HG2 GLU 122 2HG GLU 122 1.372 1.122 14.309 566 HG3 GLU 122 1HG GLU 122 2.823 0.135 14.470 567 H ASN 123 H ASN 123 4.844 -0.100 14.663 568 HA ASN 123 HA ASN 123 6.252 -2.305 13.621 569 HB2 ASN 123 2HB ASN 123 4.335 -2.326 15.965 570 HB3 ASN 123 1HB ASN 123 5.660 -3.458 15.689 571 HD21 ASN 123 1HD2 ASN 123 5.171 0.112 15.885 572 HD22 ASN 123 2HD2 ASN 123 6.608 0.411 16.740 573 H GLN 124 H GLN 124 2.771 -1.764 13.908 574 HA GLN 124 HA GLN 124 0.954 -2.958 13.022 575 HB2 GLN 124 2HB GLN 124 3.108 -3.782 11.051 576 HB3 GLN 124 1HB GLN 124 1.381 -4.062 10.823 577 HG2 GLN 124 2HG GLN 124 0.929 -1.682 10.851 578 HG3 GLN 124 1HG GLN 124 2.606 -1.327 11.265 579 HE21 GLN 124 1HE2 GLN 124 1.258 -0.355 8.852 580 HE22 GLN 124 2HE2 GLN 124 2.074 -1.026 7.523 581 H LYS 125 H LYS 125 1.970 -4.212 15.217 582 HA LYS 125 HA LYS 125 2.935 -6.843 14.958 583 HB2 LYS 125 2HB LYS 125 2.038 -7.251 17.166 584 HB3 LYS 125 1HB LYS 125 2.601 -5.581 17.116 585 HG2 LYS 125 2HG LYS 125 0.257 -4.863 16.586 586 HG3 LYS 125 1HG LYS 125 -0.263 -6.532 16.823 587 HD2 LYS 125 2HD LYS 125 0.813 -6.405 19.132 588 HD3 LYS 125 1HD LYS 125 0.945 -4.665 18.871 589 HE2 LYS 125 2HE LYS 125 -1.120 -4.768 19.920 590 HE3 LYS 125 1HE LYS 125 -1.618 -4.902 18.234 591 HZ1 LYS 125 1HZ LYS 125 -2.575 -6.591 19.813 592 HZ2 LYS 125 2HZ LYS 125 -1.018 -7.267 19.913 593 HZ3 LYS 125 3HZ LYS 125 -1.833 -7.219 18.423 594 H ASN 126 H ASN 126 1.106 -8.629 15.983 595 HA ASN 126 HA ASN 126 -0.709 -8.970 13.663 596 HB2 ASN 126 2HB ASN 126 0.110 -10.821 15.915 597 HB3 ASN 126 1HB ASN 126 -1.058 -11.254 14.668 598 HD21 ASN 126 1HD2 ASN 126 0.164 -10.086 12.387 599 HD22 ASN 126 2HD2 ASN 126 1.648 -10.861 12.097 600 H LEU 127 H LEU 127 -2.897 -8.685 13.843 601 HA LEU 127 HA LEU 127 -4.131 -8.820 16.520 602 HB2 LEU 127 2HB LEU 127 -3.364 -6.399 15.886 603 HB3 LEU 127 1HB LEU 127 -4.745 -6.437 14.791 604 HG LEU 127 HG LEU 127 -6.192 -7.101 16.733 605 HD11 LEU 127 1HD1 LEU 127 -4.693 -6.178 18.901 606 HD12 LEU 127 2HD1 LEU 127 -3.562 -7.193 18.003 607 HD13 LEU 127 3HD1 LEU 127 -5.096 -7.861 18.559 608 HD21 LEU 127 1HD2 LEU 127 -5.906 -4.724 15.936 609 HD22 LEU 127 2HD2 LEU 127 -4.673 -4.515 17.180 610 HD23 LEU 127 3HD2 LEU 127 -6.341 -4.859 17.640 611 H GLU 128 H GLU 128 -6.301 -9.436 16.439 612 HA GLU 128 HA GLU 128 -7.220 -10.828 14.136 613 HB2 GLU 128 2HB GLU 128 -8.791 -9.708 16.477 614 HB3 GLU 128 1HB GLU 128 -9.422 -10.868 15.308 615 HG2 GLU 128 2HG GLU 128 -7.602 -12.445 15.925 616 HG3 GLU 128 1HG GLU 128 -7.046 -11.298 17.143 617 H SER 129 H SER 129 -7.545 -7.479 15.109 618 HA SER 129 HA SER 129 -9.743 -6.713 13.491 619 HB2 SER 129 2HB SER 129 -8.580 -5.252 15.178 620 HB3 SER 129 1HB SER 129 -7.255 -5.065 14.032 621 HG SER 129 HG SER 129 -9.440 -4.585 12.686 622 H VAL 130 H VAL 130 -6.346 -7.248 12.681 623 HA VAL 130 HA VAL 130 -6.420 -6.124 10.054 624 HB VAL 130 HB VAL 130 -4.751 -8.393 11.175 625 HG11 VAL 130 1HG1 VAL 130 -4.750 -6.963 8.523 626 HG12 VAL 130 2HG1 VAL 130 -4.601 -8.690 8.847 627 HG13 VAL 130 3HG1 VAL 130 -3.249 -7.610 9.187 628 HG21 VAL 130 1HG2 VAL 130 -4.457 -6.182 12.265 629 HG22 VAL 130 2HG2 VAL 130 -4.145 -5.458 10.687 630 HG23 VAL 130 3HG2 VAL 130 -3.023 -6.647 11.348 631 H MET 131 H MET 131 -7.258 -9.351 11.284 632 HA MET 131 HA MET 131 -7.612 -10.651 8.790 633 HB2 MET 131 2HB MET 131 -7.865 -11.506 11.297 634 HB3 MET 131 1HB MET 131 -9.567 -11.154 11.004 635 HG2 MET 131 2HG MET 131 -7.804 -12.964 9.328 636 HG3 MET 131 1HG MET 131 -9.094 -13.481 10.414 637 HE1 MET 131 1HE MET 131 -11.444 -11.090 9.697 638 HE2 MET 131 2HE MET 131 -11.328 -12.711 10.379 639 HE3 MET 131 3HE MET 131 -12.307 -12.435 8.939 640 H ASN 132 H ASN 132 -9.765 -8.530 10.633 641 HA ASN 132 HA ASN 132 -12.081 -8.813 9.007 642 HB2 ASN 132 2HB ASN 132 -11.062 -6.482 10.631 643 HB3 ASN 132 1HB ASN 132 -12.653 -6.532 9.889 644 HD21 ASN 132 1HD2 ASN 132 -12.376 -6.383 12.729 645 HD22 ASN 132 2HD2 ASN 132 -12.910 -7.846 13.403 646 H TRP 133 H TRP 133 -9.228 -6.744 8.673 647 HA TRP 133 HA TRP 133 -10.170 -5.060 6.599 648 HB2 TRP 133 2HB TRP 133 -8.100 -4.296 7.173 649 HB3 TRP 133 1HB TRP 133 -7.521 -5.904 7.603 650 HD1 TRP 133 HD TRP 133 -6.731 -7.508 5.544 651 HE1 TRP 133 1HE TRP 133 -5.757 -6.903 3.241 652 HE3 TRP 133 3HE TRP 133 -8.034 -2.573 5.300 653 HZ2 TRP 133 2HZ TRP 133 -5.550 -4.631 1.520 654 HZ3 TRP 133 3HZ TRP 133 -7.427 -1.214 3.319 655 HH2 TRP 133 HH TRP 133 -6.187 -2.238 1.433 656 H GLN 134 H GLN 134 -8.583 -8.243 6.393 657 HA GLN 134 HA GLN 134 -8.617 -8.376 3.525 658 HB2 GLN 134 2HB GLN 134 -7.245 -9.843 5.038 659 HB3 GLN 134 1HB GLN 134 -8.727 -10.683 5.488 660 HG2 GLN 134 2HG GLN 134 -8.996 -10.871 2.839 661 HG3 GLN 134 1HG GLN 134 -7.239 -10.721 2.899 662 HE21 GLN 134 1HE2 GLN 134 -9.921 -12.603 4.377 663 HE22 GLN 134 2HE2 GLN 134 -9.008 -14.014 4.605 664 H GLN 135 H GLN 135 -10.873 -9.523 6.023 665 HA GLN 135 HA GLN 135 -12.703 -10.825 4.280 666 HB2 GLN 135 2HB GLN 135 -12.690 -10.966 6.798 667 HB3 GLN 135 1HB GLN 135 -13.400 -9.353 6.835 668 HG2 GLN 135 2HG GLN 135 -15.232 -10.885 6.977 669 HG3 GLN 135 1HG GLN 135 -15.240 -10.264 5.326 670 HE21 GLN 135 1HE2 GLN 135 -15.418 -11.868 3.762 671 HE22 GLN 135 2HE2 GLN 135 -14.913 -13.478 3.949 672 H TYR 136 H TYR 136 -12.462 -7.435 5.302 673 HA TYR 136 HA TYR 136 -14.919 -6.574 4.107 674 HB2 TYR 136 2HB TYR 136 -13.768 -5.146 5.698 675 HB3 TYR 136 1HB TYR 136 -12.354 -5.052 4.644 676 HD1 TYR 136 1HD TYR 136 -12.574 -3.985 2.367 677 HD2 TYR 136 2HD TYR 136 -15.659 -3.732 5.348 678 HE1 TYR 136 1HE TYR 136 -13.597 -2.085 1.146 679 HE2 TYR 136 2HE TYR 136 -16.680 -1.829 4.127 680 HH TYR 136 HH TYR 136 -15.106 -0.091 1.784 681 H TRP 137 H TRP 137 -11.558 -6.354 2.858 682 HA TRP 137 HA TRP 137 -12.475 -5.427 0.285 683 HB2 TRP 137 2HB TRP 137 -9.805 -6.461 1.248 684 HB3 TRP 137 1HB TRP 137 -10.080 -5.912 -0.402 685 HD1 TRP 137 HD TRP 137 -8.854 -4.641 2.725 686 HE1 TRP 137 1HE TRP 137 -9.064 -2.079 2.892 687 HE3 TRP 137 3HE TRP 137 -12.052 -3.752 -1.148 688 HZ2 TRP 137 2HZ TRP 137 -10.397 0.064 1.559 689 HZ3 TRP 137 3HZ TRP 137 -12.773 -1.445 -1.682 690 HH2 TRP 137 HH TRP 137 -11.950 0.464 -0.335 691 H LYS 138 H LYS 138 -11.817 -8.602 1.650 692 HA LYS 138 HA LYS 138 -11.599 -10.037 -0.799 693 HB2 LYS 138 2HB LYS 138 -11.153 -11.013 1.459 694 HB3 LYS 138 1HB LYS 138 -12.889 -10.998 1.771 695 HG2 LYS 138 2HG LYS 138 -13.239 -12.441 -0.219 696 HG3 LYS 138 1HG LYS 138 -11.492 -12.497 -0.465 697 HD2 LYS 138 2HD LYS 138 -11.256 -13.450 1.844 698 HD3 LYS 138 1HD LYS 138 -13.016 -13.526 1.945 699 HE2 LYS 138 2HE LYS 138 -13.039 -14.959 -0.094 700 HE3 LYS 138 1HE LYS 138 -11.276 -14.943 -0.094 701 HZ1 LYS 138 1HZ LYS 138 -12.929 -15.887 2.181 702 HZ2 LYS 138 2HZ LYS 138 -11.242 -16.008 2.023 703 HZ3 LYS 138 3HZ LYS 138 -12.260 -16.910 1.004 704 H ASP 139 H ASP 139 -14.466 -9.162 1.118 705 HA ASP 139 HA ASP 139 -16.340 -10.451 -0.649 706 HB2 ASP 139 2HB ASP 139 -16.694 -8.185 1.333 707 HB3 ASP 139 1HB ASP 139 -18.024 -8.999 0.509 708 H GLU 140 H GLU 140 -15.178 -7.079 -0.409 709 HA GLU 140 HA GLU 140 -16.818 -6.217 -2.654 710 HB2 GLU 140 2HB GLU 140 -14.488 -4.888 -1.246 711 HB3 GLU 140 1HB GLU 140 -15.491 -4.112 -2.471 712 HG2 GLU 140 2HG GLU 140 -17.495 -4.522 -1.053 713 HG3 GLU 140 1HG GLU 140 -16.447 -5.207 0.191 714 H ILE 141 H ILE 141 -13.373 -6.933 -2.191 715 HA ILE 141 HA ILE 141 -13.191 -7.523 -5.067 716 HB ILE 141 HB ILE 141 -10.905 -6.187 -4.951 717 HG12 ILE 141 2HG1 ILE 141 -12.448 -4.252 -3.327 718 HG13 ILE 141 1HG1 ILE 141 -11.815 -5.629 -2.429 719 HG21 ILE 141 1HG2 ILE 141 -12.135 -4.197 -5.821 720 HG22 ILE 141 2HG2 ILE 141 -13.641 -4.925 -5.269 721 HG23 ILE 141 3HG2 ILE 141 -12.694 -5.710 -6.532 722 HD11 ILE 141 1HD1 ILE 141 -9.559 -5.172 -3.422 723 HD12 ILE 141 2HD1 ILE 141 -10.150 -3.859 -2.406 724 HD13 ILE 141 3HD1 ILE 141 -10.225 -3.716 -4.161 725 H GLY 142 H GLY 142 -10.782 -7.038 -2.475 726 HA2 GLY 142 2HA GLY 142 -9.710 -8.861 -1.275 727 HA3 GLY 142 1HA GLY 142 -10.194 -9.951 -2.574 728 H SER 143 H SER 143 -9.208 -7.421 -4.299 729 HA SER 143 HA SER 143 -6.421 -7.187 -4.025 730 HB2 SER 143 2HB SER 143 -7.308 -9.714 -5.347 731 HB3 SER 143 1HB SER 143 -5.921 -8.876 -6.034 732 HG SER 143 HG SER 143 -5.212 -10.284 -4.442 733 H GLN 144 H GLN 144 -8.014 -5.291 -4.825 734 HA GLN 144 HA GLN 144 -7.554 -5.071 -7.762 735 HB2 GLN 144 2HB GLN 144 -10.008 -5.500 -7.052 736 HB3 GLN 144 1HB GLN 144 -9.962 -3.855 -6.419 737 HG2 GLN 144 2HG GLN 144 -9.196 -4.561 -9.262 738 HG3 GLN 144 1HG GLN 144 -10.814 -4.037 -8.792 739 HE21 GLN 144 1HE2 GLN 144 -11.048 -1.809 -7.956 740 HE22 GLN 144 2HE2 GLN 144 -9.862 -0.638 -8.283 741 HA PRO 145 HA PRO 145 -5.471 -1.683 -5.275 742 HB2 PRO 145 2HB PRO 145 -3.805 -1.880 -7.747 743 HB3 PRO 145 1HB PRO 145 -3.299 -1.710 -6.056 744 HG2 PRO 145 2HG PRO 145 -3.098 -4.034 -7.319 745 HG3 PRO 145 1HG PRO 145 -3.552 -3.950 -5.613 746 HD2 PRO 145 2HD PRO 145 -5.272 -4.531 -7.988 747 HD3 PRO 145 1HD PRO 145 -5.406 -5.134 -6.320 748 H PHE 146 H PHE 146 -5.692 0.561 -5.693 749 HA PHE 146 HA PHE 146 -6.537 1.364 -8.409 750 HB2 PHE 146 2HB PHE 146 -8.262 2.874 -7.380 751 HB3 PHE 146 1HB PHE 146 -8.631 1.158 -7.236 752 HD1 PHE 146 1HD PHE 146 -7.599 0.037 -4.988 753 HD2 PHE 146 2HD PHE 146 -8.537 4.197 -5.520 754 HE1 PHE 146 1HE PHE 146 -7.776 0.313 -2.534 755 HE2 PHE 146 2HE PHE 146 -8.724 4.465 -3.065 756 HZ PHE 146 HZ PHE 146 -8.337 2.528 -1.571 757 H THR 147 H THR 147 -6.073 3.567 -8.909 758 HA THR 147 HA THR 147 -4.088 4.791 -7.047 759 HB THR 147 HB THR 147 -3.087 5.799 -9.056 760 HG1 THR 147 1HG THR 147 -5.353 4.704 -10.171 761 HG21 THR 147 1HG2 THR 147 -1.979 3.861 -9.806 762 HG22 THR 147 2HG2 THR 147 -3.409 2.856 -9.575 763 HG23 THR 147 3HG2 THR 147 -2.515 3.449 -8.177 764 H CYS 148 H CYS 148 -4.089 7.115 -6.952 765 HA CYS 148 HA CYS 148 -6.542 8.419 -7.961 766 HB2 CYS 148 2HB CYS 148 -5.779 9.217 -5.225 767 HB3 CYS 148 1HB CYS 148 -7.374 8.883 -5.892 768 H TYR 149 H TYR 149 -6.338 10.772 -8.019 769 HA TYR 149 HA TYR 149 -3.670 11.915 -7.487 770 HB2 TYR 149 2HB TYR 149 -4.822 11.702 -10.280 771 HB3 TYR 149 1HB TYR 149 -3.566 12.856 -9.847 772 HD1 TYR 149 1HD TYR 149 -4.371 9.296 -10.325 773 HD2 TYR 149 2HD TYR 149 -1.325 12.127 -9.252 774 HE1 TYR 149 1HE TYR 149 -2.643 7.536 -10.593 775 HE2 TYR 149 2HE TYR 149 0.404 10.366 -9.516 776 HH TYR 149 HH TYR 149 0.812 8.286 -10.238 777 H PHE 150 H PHE 150 -3.867 14.084 -6.979 778 HA PHE 150 HA PHE 150 -6.368 15.437 -7.799 779 HB2 PHE 150 2HB PHE 150 -7.232 15.640 -5.705 780 HB3 PHE 150 1HB PHE 150 -6.144 14.320 -5.284 781 HD1 PHE 150 1HD PHE 150 -4.079 14.719 -4.087 782 HD2 PHE 150 2HD PHE 150 -6.641 17.967 -5.223 783 HE1 PHE 150 1HE PHE 150 -2.832 16.224 -2.572 784 HE2 PHE 150 2HE PHE 150 -5.410 19.489 -3.703 785 HZ PHE 150 HZ PHE 150 -3.494 18.616 -2.374 786 H ASN 151 H ASN 151 -6.189 17.724 -7.863 787 HA ASN 151 HA ASN 151 -3.566 18.867 -7.098 788 HB2 ASN 151 2HB ASN 151 -3.282 19.888 -9.340 789 HB3 ASN 151 1HB ASN 151 -3.246 18.128 -9.405 790 HD21 ASN 151 1HD2 ASN 151 -3.869 19.057 -11.804 791 HD22 ASN 151 2HD2 ASN 151 -5.537 19.039 -12.121 792 H GLN 152 H GLN 152 -3.867 20.792 -6.152 793 HA GLN 152 HA GLN 152 -6.511 22.085 -6.288 794 HB2 GLN 152 2HB GLN 152 -5.739 23.397 -4.417 795 HB3 GLN 152 1HB GLN 152 -5.270 21.728 -4.117 796 HG2 GLN 152 2HG GLN 152 -3.022 22.286 -5.151 797 HG3 GLN 152 1HG GLN 152 -3.516 23.979 -5.122 798 HE21 GLN 152 1HE2 GLN 152 -2.189 24.785 -3.437 799 HE22 GLN 152 2HE2 GLN 152 -2.216 24.182 -1.850 800 H HIS 153 H HIS 153 -3.685 22.233 -8.042 801 HA HIS 153 HA HIS 153 -2.989 24.902 -8.335 802 HB2 HIS 153 2HB HIS 153 -2.260 24.357 -10.567 803 HB3 HIS 153 1HB HIS 153 -1.999 22.929 -9.567 804 HD1 HIS 153 1HD HIS 153 -3.026 23.523 -12.800 805 HD2 HIS 153 2HD HIS 153 -4.866 21.475 -9.665 806 HE1 HIS 153 1HE HIS 153 -4.722 21.965 -13.859 807 HE2 HIS 153 2HE HIS 153 -5.848 20.715 -11.961 808 H GLN 154 H GLN 154 -5.887 23.285 -9.573 809 HA GLN 154 HA GLN 154 -6.734 25.490 -11.235 810 HB2 GLN 154 2HB GLN 154 -7.632 23.149 -11.415 811 HB3 GLN 154 1HB GLN 154 -8.470 23.402 -9.883 812 HG2 GLN 154 2HG GLN 154 -9.624 25.378 -10.898 813 HG3 GLN 154 1HG GLN 154 -8.874 24.976 -12.443 814 HE21 GLN 154 1HE2 GLN 154 -10.235 23.768 -13.757 815 HE22 GLN 154 2HE2 GLN 154 -11.398 22.659 -13.208 816 H ARG 155 H ARG 155 -8.194 24.358 -8.181 817 HA ARG 155 HA ARG 155 -8.000 26.928 -6.926 818 HB2 ARG 155 2HB ARG 155 -10.187 26.650 -8.724 819 HB3 ARG 155 1HB ARG 155 -10.846 26.619 -7.088 820 HG2 ARG 155 2HG ARG 155 -8.910 28.709 -8.123 821 HG3 ARG 155 1HG ARG 155 -10.654 28.933 -7.998 822 HD2 ARG 155 2HD ARG 155 -10.160 28.095 -5.490 823 HD3 ARG 155 1HD ARG 155 -8.598 28.829 -5.848 824 HE ARG 155 HE ARG 155 -10.318 30.790 -6.640 825 HH11 ARG 155 1HH1 ARG 155 -11.238 32.338 -5.273 826 HH12 ARG 155 2HH1 ARG 155 -11.459 31.970 -3.594 827 HH21 ARG 155 1HH2 ARG 155 -10.127 28.778 -3.847 828 HH22 ARG 155 2HH2 ARG 155 -10.830 29.954 -2.788 829 HA PRO 156 HA PRO 156 -10.180 23.888 -4.076 830 HB2 PRO 156 2HB PRO 156 -11.849 22.009 -4.984 831 HB3 PRO 156 1HB PRO 156 -12.294 23.723 -5.057 832 HG2 PRO 156 2HG PRO 156 -11.495 21.900 -7.232 833 HG3 PRO 156 1HG PRO 156 -12.501 23.356 -7.288 834 HD2 PRO 156 2HD PRO 156 -9.678 23.121 -7.905 835 HD3 PRO 156 1HD PRO 156 -10.707 24.560 -8.007 836 H ASP 157 H ASP 157 -10.656 21.031 -5.901 837 HA ASP 157 HA ASP 157 -7.972 19.963 -5.732 838 HB2 ASP 157 2HB ASP 157 -8.466 18.296 -3.941 839 HB3 ASP 157 1HB ASP 157 -8.481 19.954 -3.340 840 H ASP 158 H ASP 158 -8.781 19.509 -7.973 841 HA ASP 158 HA ASP 158 -11.012 17.781 -8.481 842 HB2 ASP 158 2HB ASP 158 -8.407 18.116 -10.014 843 HB3 ASP 158 1HB ASP 158 -9.817 17.248 -10.622 844 H VAL 159 H VAL 159 -11.007 15.408 -8.722 845 HA VAL 159 HA VAL 159 -8.581 14.104 -7.546 846 HB VAL 159 HB VAL 159 -10.020 12.654 -6.201 847 HG11 VAL 159 1HG1 VAL 159 -10.067 14.200 -4.549 848 HG12 VAL 159 2HG1 VAL 159 -11.228 15.202 -5.420 849 HG13 VAL 159 3HG1 VAL 159 -9.505 15.351 -5.760 850 HG21 VAL 159 1HG2 VAL 159 -11.987 12.564 -7.623 851 HG22 VAL 159 2HG2 VAL 159 -12.245 14.300 -7.445 852 HG23 VAL 159 3HG2 VAL 159 -12.468 13.228 -6.061 853 H LEU 160 H LEU 160 -8.153 11.998 -8.220 854 HA LEU 160 HA LEU 160 -9.764 10.999 -10.537 855 HB2 LEU 160 2HB LEU 160 -6.792 10.657 -10.031 856 HB3 LEU 160 1HB LEU 160 -7.669 10.031 -11.420 857 HG LEU 160 HG LEU 160 -7.236 12.946 -10.699 858 HD11 LEU 160 1HD1 LEU 160 -5.764 11.088 -12.261 859 HD12 LEU 160 2HD1 LEU 160 -5.508 12.830 -12.137 860 HD13 LEU 160 3HD1 LEU 160 -6.563 12.182 -13.392 861 HD21 LEU 160 1HD2 LEU 160 -9.099 11.601 -12.640 862 HD22 LEU 160 2HD2 LEU 160 -8.408 13.172 -13.046 863 HD23 LEU 160 3HD2 LEU 160 -9.397 12.993 -11.598 864 H LEU 161 H LEU 161 -10.101 8.697 -10.587 865 HA LEU 161 HA LEU 161 -9.128 7.177 -8.221 866 HB2 LEU 161 2HB LEU 161 -11.417 8.133 -7.738 867 HB3 LEU 161 1HB LEU 161 -12.032 7.156 -9.073 868 HG LEU 161 HG LEU 161 -10.673 5.247 -7.750 869 HD11 LEU 161 1HD1 LEU 161 -10.095 7.089 -6.018 870 HD12 LEU 161 2HD1 LEU 161 -10.672 5.536 -5.411 871 HD13 LEU 161 3HD1 LEU 161 -11.769 6.916 -5.491 872 HD21 LEU 161 1HD2 LEU 161 -13.455 6.262 -7.094 873 HD22 LEU 161 2HD2 LEU 161 -12.849 4.657 -6.685 874 HD23 LEU 161 3HD2 LEU 161 -13.030 5.126 -8.375 875 H HIS 162 H HIS 162 -7.887 6.528 -10.384 876 HA HIS 162 HA HIS 162 -9.313 4.774 -12.206 877 HB2 HIS 162 2HB HIS 162 -6.349 5.107 -11.655 878 HB3 HIS 162 1HB HIS 162 -7.016 4.135 -12.967 879 HD1 HIS 162 1HD HIS 162 -5.268 6.531 -13.704 880 HD2 HIS 162 2HD HIS 162 -9.409 6.793 -13.270 881 HE1 HIS 162 1HE HIS 162 -6.002 8.564 -15.028 882 HE2 HIS 162 2HE HIS 162 -8.520 8.733 -14.771 883 H ARG 163 H ARG 163 -8.968 2.425 -12.352 884 HA ARG 163 HA ARG 163 -8.420 1.196 -9.674 885 HB2 ARG 163 2HB ARG 163 -10.319 0.309 -11.866 886 HB3 ARG 163 1HB ARG 163 -9.999 -0.598 -10.386 887 HG2 ARG 163 2HG ARG 163 -10.777 1.341 -9.048 888 HG3 ARG 163 1HG ARG 163 -11.145 2.206 -10.540 889 HD2 ARG 163 2HD ARG 163 -13.197 1.204 -9.758 890 HD3 ARG 163 1HD ARG 163 -12.669 0.295 -11.173 891 HE ARG 163 HE ARG 163 -11.762 -0.797 -8.600 892 HH11 ARG 163 1HH1 ARG 163 -12.549 -2.865 -8.136 893 HH12 ARG 163 2HH1 ARG 163 -13.840 -3.518 -9.087 894 HH21 ARG 163 1HH2 ARG 163 -14.112 -0.723 -11.120 895 HH22 ARG 163 2HH2 ARG 163 -14.726 -2.305 -10.776 896 H THR 164 H THR 164 -7.453 -0.970 -9.729 897 HA THR 164 HA THR 164 -5.734 -1.355 -12.144 898 HB THR 164 HB THR 164 -5.274 -2.547 -9.404 899 HG1 THR 164 1HG THR 164 -4.972 0.011 -10.296 900 HG21 THR 164 1HG2 THR 164 -3.529 -2.064 -11.831 901 HG22 THR 164 2HG2 THR 164 -4.055 -3.626 -11.201 902 HG23 THR 164 3HG2 THR 164 -2.927 -2.635 -10.275 903 H HIS 165 H HIS 165 -5.738 -3.346 -13.183 904 HA HIS 165 HA HIS 165 -7.720 -5.349 -12.164 905 HB2 HIS 165 2HB HIS 165 -6.882 -4.763 -15.021 906 HB3 HIS 165 1HB HIS 165 -8.032 -6.007 -14.529 907 HD1 HIS 165 1HD HIS 165 -10.142 -4.988 -13.035 908 HD2 HIS 165 2HD HIS 165 -8.101 -2.334 -15.524 909 HE1 HIS 165 1HE HIS 165 -11.666 -2.987 -13.357 910 HE2 HIS 165 2HE HIS 165 -10.433 -1.367 -14.869 911 H ASP 166 H ASP 166 -7.016 -7.462 -11.964 912 HA ASP 166 HA ASP 166 -4.144 -7.930 -12.036 913 HB2 ASP 166 2HB ASP 166 -6.489 -9.780 -11.515 914 HB3 ASP 166 1HB ASP 166 -4.800 -10.259 -11.356 Start of MODEL 12 1 H1 GLN 45 1HT GLN 45 3.873 21.248 3.350 2 H2 GLN 45 2HT GLN 45 4.801 22.127 2.230 3 H3 GLN 45 3HT GLN 45 5.564 21.253 3.471 4 HA GLN 45 HA GLN 45 5.072 19.197 2.515 5 HB2 GLN 45 2HB GLN 45 3.194 20.760 0.716 6 HB3 GLN 45 1HB GLN 45 3.540 19.037 0.551 7 HG2 GLN 45 2HG GLN 45 2.675 18.623 2.810 8 HG3 GLN 45 1HG GLN 45 2.368 20.348 3.021 9 HE21 GLN 45 1HE2 GLN 45 0.225 18.477 3.192 10 HE22 GLN 45 2HE2 GLN 45 -0.800 18.699 1.858 11 H ASP 46 H ASP 46 5.506 18.539 -0.003 12 HA ASP 46 HA ASP 46 7.882 20.141 -0.747 13 HB2 ASP 46 2HB ASP 46 6.873 17.440 -1.687 14 HB3 ASP 46 1HB ASP 46 8.335 18.216 -2.298 15 H LEU 47 H LEU 47 5.629 18.366 -2.835 16 HA LEU 47 HA LEU 47 5.629 20.633 -4.718 17 HB2 LEU 47 2HB LEU 47 4.191 17.968 -4.909 18 HB3 LEU 47 1HB LEU 47 4.483 19.107 -6.225 19 HG LEU 47 HG LEU 47 6.652 17.706 -4.635 20 HD11 LEU 47 1HD1 LEU 47 7.021 16.580 -6.906 21 HD12 LEU 47 2HD1 LEU 47 5.420 17.174 -7.344 22 HD13 LEU 47 3HD1 LEU 47 5.606 16.055 -5.994 23 HD21 LEU 47 1HD2 LEU 47 6.617 19.721 -6.869 24 HD22 LEU 47 2HD2 LEU 47 7.953 18.577 -6.742 25 HD23 LEU 47 3HD2 LEU 47 7.618 19.692 -5.419 26 H GLN 48 H GLN 48 3.732 21.846 -5.193 27 HA GLN 48 HA GLN 48 1.943 22.347 -3.093 28 HB2 GLN 48 2HB GLN 48 2.190 23.914 -4.947 29 HB3 GLN 48 1HB GLN 48 1.542 22.732 -6.080 30 HG2 GLN 48 2HG GLN 48 0.008 24.653 -5.030 31 HG3 GLN 48 1HG GLN 48 -0.638 23.053 -5.379 32 HE21 GLN 48 1HE2 GLN 48 -1.154 21.670 -3.582 33 HE22 GLN 48 2HE2 GLN 48 -1.114 22.209 -1.972 34 H ALA 49 H ALA 49 0.073 21.509 -5.856 35 HA ALA 49 HA ALA 49 -0.755 18.934 -4.616 36 HB1 ALA 49 1HB ALA 49 -3.149 19.614 -5.145 37 HB2 ALA 49 2HB ALA 49 -2.537 21.251 -5.384 38 HB3 ALA 49 3HB ALA 49 -2.399 20.481 -3.807 39 H THR 50 H THR 50 -1.222 17.342 -6.154 40 HA THR 50 HA THR 50 -1.982 17.928 -8.865 41 HB THR 50 HB THR 50 0.888 17.018 -8.532 42 HG1 THR 50 1HG THR 50 0.553 19.231 -7.959 43 HG21 THR 50 1HG2 THR 50 0.934 16.759 -10.790 44 HG22 THR 50 2HG2 THR 50 -0.102 18.157 -11.069 45 HG23 THR 50 3HG2 THR 50 -0.815 16.607 -10.623 46 H GLU 51 H GLU 51 0.300 15.524 -7.562 47 HA GLU 51 HA GLU 51 -1.621 13.423 -8.428 48 HB2 GLU 51 2HB GLU 51 1.359 13.223 -7.960 49 HB3 GLU 51 1HB GLU 51 0.320 11.959 -8.621 50 HG2 GLU 51 2HG GLU 51 -0.273 13.488 -10.507 51 HG3 GLU 51 1HG GLU 51 0.874 14.665 -9.870 52 H ALA 52 H ALA 52 -2.281 11.868 -7.061 53 HA ALA 52 HA ALA 52 -1.027 11.461 -4.430 54 HB1 ALA 52 1HB ALA 52 -3.529 11.537 -3.523 55 HB2 ALA 52 2HB ALA 52 -3.743 12.670 -4.857 56 HB3 ALA 52 3HB ALA 52 -2.563 13.012 -3.591 57 H ASN 53 H ASN 53 -0.746 9.232 -4.664 58 HA ASN 53 HA ASN 53 -2.908 7.762 -6.056 59 HB2 ASN 53 2HB ASN 53 -0.053 6.996 -5.486 60 HB3 ASN 53 1HB ASN 53 -1.238 5.880 -6.158 61 HD21 ASN 53 1HD2 ASN 53 -2.666 7.747 -7.838 62 HD22 ASN 53 2HD2 ASN 53 -1.617 8.238 -9.079 63 H CYS 54 H CYS 54 -4.037 6.108 -5.172 64 HA CYS 54 HA CYS 54 -3.483 5.434 -2.315 65 HB2 CYS 54 2HB CYS 54 -6.104 5.296 -2.246 66 HB3 CYS 54 1HB CYS 54 -5.338 6.874 -2.099 67 H THR 55 H THR 55 -2.676 3.340 -2.820 68 HA THR 55 HA THR 55 -4.573 1.669 -4.398 69 HB THR 55 HB THR 55 -2.912 1.060 -5.782 70 HG1 THR 55 1HG THR 55 -1.572 0.601 -3.348 71 HG21 THR 55 1HG2 THR 55 -2.336 3.497 -5.358 72 HG22 THR 55 2HG2 THR 55 -0.998 2.502 -5.926 73 HG23 THR 55 3HG2 THR 55 -1.117 2.929 -4.219 74 H VAL 56 H VAL 56 -4.738 -0.500 -3.922 75 HA VAL 56 HA VAL 56 -3.897 -1.242 -1.160 76 HB VAL 56 HB VAL 56 -6.349 -1.833 -2.794 77 HG11 VAL 56 1HG1 VAL 56 -6.731 -3.653 -0.941 78 HG12 VAL 56 2HG1 VAL 56 -4.971 -3.669 -0.856 79 HG13 VAL 56 3HG1 VAL 56 -5.783 -4.059 -2.373 80 HG21 VAL 56 1HG2 VAL 56 -6.424 -1.710 0.154 81 HG22 VAL 56 2HG2 VAL 56 -7.432 -0.880 -1.031 82 HG23 VAL 56 3HG2 VAL 56 -5.846 -0.234 -0.617 83 H LEU 57 H LEU 57 -2.152 -2.542 -1.312 84 HA LEU 57 HA LEU 57 -1.160 -3.746 -3.623 85 HB2 LEU 57 2HB LEU 57 0.011 -3.559 -1.398 86 HB3 LEU 57 1HB LEU 57 -0.945 -4.934 -0.852 87 HG LEU 57 HG LEU 57 -0.054 -6.231 -2.832 88 HD11 LEU 57 1HD1 LEU 57 1.098 -3.615 -3.376 89 HD12 LEU 57 2HD1 LEU 57 0.999 -5.029 -4.423 90 HD13 LEU 57 3HD1 LEU 57 2.342 -4.861 -3.295 91 HD21 LEU 57 1HD2 LEU 57 0.971 -6.797 -0.804 92 HD22 LEU 57 2HD2 LEU 57 1.679 -5.194 -0.607 93 HD23 LEU 57 3HD2 LEU 57 2.347 -6.313 -1.794 94 H SER 58 H SER 58 -1.292 -5.889 -4.466 95 HA SER 58 HA SER 58 -3.907 -7.172 -3.945 96 HB2 SER 58 2HB SER 58 -3.572 -8.324 -6.032 97 HB3 SER 58 1HB SER 58 -3.091 -6.652 -6.305 98 HG SER 58 HG SER 58 -1.121 -7.306 -6.631 99 H VAL 59 H VAL 59 -3.956 -9.488 -3.453 100 HA VAL 59 HA VAL 59 -1.533 -10.289 -1.945 101 HB VAL 59 HB VAL 59 -4.181 -11.747 -2.051 102 HG11 VAL 59 1HG1 VAL 59 -2.039 -12.762 -1.042 103 HG12 VAL 59 2HG1 VAL 59 -3.468 -12.732 -0.009 104 HG13 VAL 59 3HG1 VAL 59 -2.192 -11.535 0.215 105 HG21 VAL 59 1HG2 VAL 59 -4.845 -10.424 -0.083 106 HG22 VAL 59 2HG2 VAL 59 -4.550 -9.359 -1.459 107 HG23 VAL 59 3HG2 VAL 59 -3.343 -9.504 -0.180 108 H GLN 60 H GLN 60 -0.080 -11.552 -2.958 109 HA GLN 60 HA GLN 60 -1.040 -13.698 -4.760 110 HB2 GLN 60 2HB GLN 60 1.064 -11.646 -5.507 111 HB3 GLN 60 1HB GLN 60 0.679 -13.087 -6.450 112 HG2 GLN 60 2HG GLN 60 -1.648 -12.300 -6.703 113 HG3 GLN 60 1HG GLN 60 -1.261 -10.857 -5.767 114 HE21 GLN 60 1HE2 GLN 60 -2.173 -10.319 -8.276 115 HE22 GLN 60 2HE2 GLN 60 -0.906 -9.870 -9.314 116 H GLN 61 H GLN 61 0.577 -15.386 -5.067 117 HA GLN 61 HA GLN 61 2.134 -15.879 -2.678 118 HB2 GLN 61 2HB GLN 61 2.232 -17.337 -5.328 119 HB3 GLN 61 1HB GLN 61 2.784 -17.955 -3.774 120 HG2 GLN 61 2HG GLN 61 -0.064 -17.239 -4.523 121 HG3 GLN 61 1HG GLN 61 0.575 -18.864 -4.268 122 HE21 GLN 61 1HE2 GLN 61 -1.112 -16.422 -2.723 123 HE22 GLN 61 2HE2 GLN 61 -0.757 -16.830 -1.117 124 H ILE 62 H ILE 62 4.515 -16.531 -2.893 125 HA ILE 62 HA ILE 62 6.173 -14.389 -3.450 126 HB ILE 62 HB ILE 62 6.874 -17.312 -3.876 127 HG12 ILE 62 2HG1 ILE 62 7.134 -15.600 -1.387 128 HG13 ILE 62 1HG1 ILE 62 5.821 -16.745 -1.659 129 HG21 ILE 62 1HG2 ILE 62 9.146 -16.360 -3.041 130 HG22 ILE 62 2HG2 ILE 62 8.493 -14.793 -3.513 131 HG23 ILE 62 3HG2 ILE 62 8.691 -16.067 -4.718 132 HD11 ILE 62 1HD1 ILE 62 7.121 -18.494 -1.080 133 HD12 ILE 62 2HD1 ILE 62 8.317 -17.322 -0.530 134 HD13 ILE 62 3HD1 ILE 62 8.407 -17.971 -2.167 135 H GLY 63 H GLY 63 7.909 -14.329 -5.268 136 HA2 GLY 63 2HA GLY 63 8.474 -14.635 -7.595 137 HA3 GLY 63 1HA GLY 63 6.840 -15.233 -7.885 138 H GLU 64 H GLU 64 6.643 -12.550 -5.918 139 HA GLU 64 HA GLU 64 6.189 -10.765 -8.267 140 HB2 GLU 64 2HB GLU 64 4.767 -10.822 -5.595 141 HB3 GLU 64 1HB GLU 64 4.507 -9.602 -6.841 142 HG2 GLU 64 2HG GLU 64 4.085 -12.582 -7.206 143 HG3 GLU 64 1HG GLU 64 2.809 -11.395 -6.952 144 H VAL 65 H VAL 65 6.992 -8.675 -8.152 145 HA VAL 65 HA VAL 65 8.743 -8.087 -5.801 146 HB VAL 65 HB VAL 65 9.124 -7.185 -8.668 147 HG11 VAL 65 1HG1 VAL 65 10.597 -5.729 -7.792 148 HG12 VAL 65 2HG1 VAL 65 11.485 -7.075 -7.075 149 HG13 VAL 65 3HG1 VAL 65 10.195 -6.286 -6.167 150 HG21 VAL 65 1HG2 VAL 65 9.642 -9.702 -7.469 151 HG22 VAL 65 2HG2 VAL 65 11.200 -8.890 -7.618 152 HG23 VAL 65 3HG2 VAL 65 10.193 -9.134 -9.045 153 H PHE 66 H PHE 66 8.416 -6.149 -4.787 154 HA PHE 66 HA PHE 66 6.566 -4.205 -6.095 155 HB2 PHE 66 2HB PHE 66 6.716 -4.936 -3.160 156 HB3 PHE 66 1HB PHE 66 5.658 -3.708 -3.858 157 HD1 PHE 66 1HD PHE 66 6.218 -7.274 -3.363 158 HD2 PHE 66 2HD PHE 66 3.865 -4.363 -5.465 159 HE1 PHE 66 1HE PHE 66 4.561 -9.025 -3.932 160 HE2 PHE 66 2HE PHE 66 2.204 -6.115 -6.032 161 HZ PHE 66 HZ PHE 66 2.550 -8.448 -5.265 162 H GLU 67 H GLU 67 6.885 -1.954 -5.361 163 HA GLU 67 HA GLU 67 9.718 -1.486 -4.539 164 HB2 GLU 67 2HB GLU 67 9.705 0.515 -5.868 165 HB3 GLU 67 1HB GLU 67 9.044 -0.775 -6.873 166 HG2 GLU 67 2HG GLU 67 6.738 -0.036 -6.189 167 HG3 GLU 67 1HG GLU 67 7.477 1.345 -5.375 168 H CYS 68 H CYS 68 10.134 0.216 -3.048 169 HA CYS 68 HA CYS 68 7.744 1.038 -1.448 170 HB2 CYS 68 2HB CYS 68 9.575 -0.274 -0.280 171 HB3 CYS 68 1HB CYS 68 10.658 1.079 -0.595 172 H THR 69 H THR 69 7.766 3.320 -0.686 173 HA THR 69 HA THR 69 9.263 5.066 -2.594 174 HB THR 69 HB THR 69 7.273 5.964 -3.121 175 HG1 THR 69 1HG THR 69 6.432 6.404 -0.521 176 HG21 THR 69 1HG2 THR 69 6.370 3.717 -2.555 177 HG22 THR 69 2HG2 THR 69 5.205 5.001 -2.235 178 HG23 THR 69 3HG2 THR 69 6.096 4.267 -0.901 179 H PHE 70 H PHE 70 10.222 6.934 -1.819 180 HA PHE 70 HA PHE 70 10.105 7.453 1.108 181 HB2 PHE 70 2HB PHE 70 12.639 7.236 -0.550 182 HB3 PHE 70 1HB PHE 70 12.573 7.843 1.104 183 HD1 PHE 70 1HD PHE 70 13.247 5.007 -0.795 184 HD2 PHE 70 2HD PHE 70 11.128 6.217 2.738 185 HE1 PHE 70 1HE PHE 70 13.351 2.686 0.058 186 HE2 PHE 70 2HE PHE 70 11.234 3.892 3.595 187 HZ PHE 70 HZ PHE 70 12.345 2.125 2.255 188 H THR 71 H THR 71 10.657 9.706 1.608 189 HA THR 71 HA THR 71 10.664 11.487 -0.784 190 HB THR 71 HB THR 71 9.051 11.951 1.737 191 HG1 THR 71 1HG THR 71 8.388 10.922 -0.809 192 HG21 THR 71 1HG2 THR 71 8.916 14.055 0.953 193 HG22 THR 71 2HG2 THR 71 8.107 13.427 -0.483 194 HG23 THR 71 3HG2 THR 71 9.861 13.619 -0.472 195 H CYS 72 H CYS 72 12.099 13.140 -0.665 196 HA CYS 72 HA CYS 72 13.219 13.892 1.983 197 HB2 CYS 72 2HB CYS 72 15.290 13.105 1.542 198 HB3 CYS 72 1HB CYS 72 14.588 12.238 0.177 199 H GLY 73 H GLY 73 14.590 15.970 1.689 200 HA2 GLY 73 2HA GLY 73 13.008 17.809 0.033 201 HA3 GLY 73 1HA GLY 73 14.271 18.271 1.175 202 H ALA 74 H ALA 74 14.469 19.614 -1.092 203 HA ALA 74 HA ALA 74 16.095 20.133 -2.721 204 HB1 ALA 74 1HB ALA 74 18.146 19.099 -2.599 205 HB2 ALA 74 2HB ALA 74 17.439 17.488 -2.469 206 HB3 ALA 74 3HB ALA 74 17.490 18.546 -1.059 207 H ASP 75 H ASP 75 13.616 18.348 -3.047 208 HA ASP 75 HA ASP 75 12.559 17.201 -4.789 209 HB2 ASP 75 2HB ASP 75 14.808 18.487 -6.371 210 HB3 ASP 75 1HB ASP 75 13.406 17.695 -7.084 211 H CYS 76 H CYS 76 14.255 15.650 -3.224 212 HA CYS 76 HA CYS 76 15.439 13.790 -5.250 213 HB2 CYS 76 2HB CYS 76 17.328 13.643 -4.019 214 HB3 CYS 76 1HB CYS 76 16.743 15.036 -3.111 215 H ARG 77 H ARG 77 14.461 11.827 -5.304 216 HA ARG 77 HA ARG 77 12.779 11.037 -2.954 217 HB2 ARG 77 2HB ARG 77 12.299 10.187 -5.816 218 HB3 ARG 77 1HB ARG 77 11.191 10.071 -4.448 219 HG2 ARG 77 2HG ARG 77 12.162 12.637 -5.745 220 HG3 ARG 77 1HG ARG 77 10.545 11.949 -5.887 221 HD2 ARG 77 2HD ARG 77 10.745 12.052 -3.194 222 HD3 ARG 77 1HD ARG 77 11.794 13.409 -3.614 223 HE ARG 77 HE ARG 77 9.193 13.397 -4.980 224 HH11 ARG 77 1HH1 ARG 77 7.875 15.166 -4.488 225 HH12 ARG 77 2HH1 ARG 77 8.283 16.188 -3.151 226 HH21 ARG 77 1HH2 ARG 77 11.122 14.388 -2.300 227 HH22 ARG 77 2HH2 ARG 77 10.122 15.746 -1.911 228 H GLY 78 H GLY 78 12.696 8.685 -2.559 229 HA2 GLY 78 2HA GLY 78 14.932 7.184 -3.843 230 HA3 GLY 78 1HA GLY 78 14.770 7.198 -2.090 231 H THR 79 H THR 79 14.484 5.056 -4.288 232 HA THR 79 HA THR 79 11.957 3.909 -3.202 233 HB THR 79 HB THR 79 11.344 3.053 -5.368 234 HG1 THR 79 1HG THR 79 13.785 2.953 -5.859 235 HG21 THR 79 1HG2 THR 79 10.728 5.039 -6.417 236 HG22 THR 79 2HG2 THR 79 12.267 5.823 -6.058 237 HG23 THR 79 3HG2 THR 79 11.073 5.596 -4.779 238 H SER 80 H SER 80 11.979 1.536 -3.159 239 HA SER 80 HA SER 80 14.689 0.332 -3.526 240 HB2 SER 80 2HB SER 80 12.907 -0.008 -1.098 241 HB3 SER 80 1HB SER 80 14.392 -0.909 -1.394 242 HG SER 80 HG SER 80 14.395 1.902 -1.485 243 H GLN 81 H GLN 81 14.642 -1.934 -4.018 244 HA GLN 81 HA GLN 81 11.939 -2.947 -4.789 245 HB2 GLN 81 2HB GLN 81 14.655 -3.378 -6.041 246 HB3 GLN 81 1HB GLN 81 13.262 -4.387 -6.430 247 HG2 GLN 81 2HG GLN 81 13.074 -1.383 -6.578 248 HG3 GLN 81 1HG GLN 81 13.728 -2.313 -7.928 249 HE21 GLN 81 1HE2 GLN 81 10.809 -2.090 -5.825 250 HE22 GLN 81 2HE2 GLN 81 9.745 -2.704 -6.992 251 H TYR 82 H TYR 82 11.347 -4.980 -4.065 252 HA TYR 82 HA TYR 82 13.354 -6.732 -2.806 253 HB2 TYR 82 2HB TYR 82 11.618 -6.769 -0.767 254 HB3 TYR 82 1HB TYR 82 12.943 -5.603 -0.827 255 HD1 TYR 82 1HD TYR 82 9.334 -6.096 -1.087 256 HD2 TYR 82 2HD TYR 82 12.535 -3.282 -1.611 257 HE1 TYR 82 1HE TYR 82 7.692 -4.239 -1.170 258 HE2 TYR 82 2HE TYR 82 10.894 -1.429 -1.696 259 HH TYR 82 HH TYR 82 7.628 -1.828 -0.779 260 HA PRO 83 HA PRO 83 10.752 -10.074 -4.167 261 HB2 PRO 83 2HB PRO 83 10.536 -11.010 -1.346 262 HB3 PRO 83 1HB PRO 83 11.056 -11.895 -2.792 263 HG2 PRO 83 2HG PRO 83 12.784 -11.030 -0.940 264 HG3 PRO 83 1HG PRO 83 13.197 -11.128 -2.659 265 HD2 PRO 83 2HD PRO 83 12.689 -8.730 -0.991 266 HD3 PRO 83 1HD PRO 83 13.643 -8.895 -2.480 267 H CYS 84 H CYS 84 8.769 -11.382 -2.394 268 HA CYS 84 HA CYS 84 6.515 -9.675 -2.947 269 HB2 CYS 84 2HB CYS 84 5.493 -11.667 -2.714 270 HB3 CYS 84 1HB CYS 84 6.959 -12.364 -2.021 271 H VAL 85 H VAL 85 5.194 -8.528 -1.454 272 HA VAL 85 HA VAL 85 6.412 -8.058 1.237 273 HB VAL 85 HB VAL 85 6.849 -6.190 -0.383 274 HG11 VAL 85 1HG1 VAL 85 4.610 -6.538 -1.556 275 HG12 VAL 85 2HG1 VAL 85 5.044 -4.864 -1.217 276 HG13 VAL 85 3HG1 VAL 85 3.872 -5.695 -0.195 277 HG21 VAL 85 1HG2 VAL 85 5.678 -6.068 2.255 278 HG22 VAL 85 2HG2 VAL 85 5.211 -4.645 1.323 279 HG23 VAL 85 3HG2 VAL 85 6.917 -5.031 1.547 280 H GLN 86 H GLN 86 4.884 -7.606 2.923 281 HA GLN 86 HA GLN 86 2.494 -9.038 2.923 282 HB2 GLN 86 2HB GLN 86 3.586 -6.789 4.536 283 HB3 GLN 86 1HB GLN 86 1.858 -7.099 4.683 284 HG2 GLN 86 2HG GLN 86 3.017 -8.422 6.358 285 HG3 GLN 86 1HG GLN 86 2.388 -9.515 5.129 286 HE21 GLN 86 1HE2 GLN 86 3.900 -10.830 4.040 287 HE22 GLN 86 2HE2 GLN 86 5.583 -10.673 4.193 288 H VAL 87 H VAL 87 0.241 -7.731 3.370 289 HA VAL 87 HA VAL 87 -0.096 -5.912 1.010 290 HB VAL 87 HB VAL 87 -1.055 -8.211 0.730 291 HG11 VAL 87 1HG1 VAL 87 -3.277 -7.501 2.572 292 HG12 VAL 87 2HG1 VAL 87 -1.772 -8.041 3.314 293 HG13 VAL 87 3HG1 VAL 87 -2.611 -9.082 2.164 294 HG21 VAL 87 1HG2 VAL 87 -3.527 -7.153 0.412 295 HG22 VAL 87 2HG2 VAL 87 -2.198 -6.841 -0.703 296 HG23 VAL 87 3HG2 VAL 87 -2.584 -5.672 0.557 297 H TYR 88 H TYR 88 -1.465 -4.154 1.222 298 HA TYR 88 HA TYR 88 -3.286 -3.720 3.340 299 HB2 TYR 88 2HB TYR 88 -1.240 -3.601 4.711 300 HB3 TYR 88 1HB TYR 88 -0.650 -2.295 3.714 301 HD1 TYR 88 1HD TYR 88 -4.210 -1.907 4.006 302 HD2 TYR 88 2HD TYR 88 -0.544 -1.390 6.206 303 HE1 TYR 88 1HE TYR 88 -5.325 -0.311 5.500 304 HE2 TYR 88 2HE TYR 88 -1.682 0.213 7.698 305 HH TYR 88 HH TYR 88 -4.645 0.453 8.226 306 H VAL 89 H VAL 89 -2.000 -0.744 3.274 307 HA VAL 89 HA VAL 89 -3.039 -0.103 0.555 308 HB VAL 89 HB VAL 89 -4.822 0.278 2.247 309 HG11 VAL 89 1HG1 VAL 89 -2.996 0.911 4.004 310 HG12 VAL 89 2HG1 VAL 89 -4.538 1.767 4.043 311 HG13 VAL 89 3HG1 VAL 89 -3.124 2.527 3.311 312 HG21 VAL 89 1HG2 VAL 89 -5.285 2.625 1.579 313 HG22 VAL 89 2HG2 VAL 89 -4.733 1.659 0.211 314 HG23 VAL 89 3HG2 VAL 89 -3.624 2.777 1.004 315 H ASN 90 H ASN 90 -1.879 1.384 -0.537 316 HA ASN 90 HA ASN 90 0.478 2.539 0.814 317 HB2 ASN 90 2HB ASN 90 -0.356 2.538 -2.103 318 HB3 ASN 90 1HB ASN 90 1.180 3.131 -1.479 319 HD21 ASN 90 1HD2 ASN 90 0.236 0.493 0.393 320 HD22 ASN 90 2HD2 ASN 90 1.110 -0.719 -0.410 321 H ASN 91 H ASN 91 0.333 4.590 1.608 322 HA ASN 91 HA ASN 91 -1.869 6.310 0.611 323 HB2 ASN 91 2HB ASN 91 -0.011 6.664 2.983 324 HB3 ASN 91 1HB ASN 91 -1.376 7.709 2.587 325 HD21 ASN 91 1HD2 ASN 91 -3.319 5.785 1.855 326 HD22 ASN 91 2HD2 ASN 91 -3.685 4.822 3.204 327 H SER 92 H SER 92 -0.854 6.862 -1.406 328 HA SER 92 HA SER 92 1.717 8.313 -1.261 329 HB2 SER 92 2HB SER 92 0.604 8.394 -3.878 330 HB3 SER 92 1HB SER 92 2.001 7.479 -3.321 331 HG SER 92 HG SER 92 0.316 5.966 -2.476 332 H GLU 93 H GLU 93 -1.163 9.229 -0.388 333 HA GLU 93 HA GLU 93 -1.748 11.494 -2.087 334 HB2 GLU 93 2HB GLU 93 -3.316 12.146 -0.391 335 HB3 GLU 93 1HB GLU 93 -3.344 10.384 -0.424 336 HG2 GLU 93 2HG GLU 93 -1.670 10.393 1.458 337 HG3 GLU 93 1HG GLU 93 -1.873 12.142 1.559 338 H SER 94 H SER 94 0.691 10.806 0.129 339 HA SER 94 HA SER 94 1.642 13.603 0.030 340 HB2 SER 94 2HB SER 94 0.345 13.362 2.167 341 HB3 SER 94 1HB SER 94 1.438 12.064 2.637 342 HG SER 94 HG SER 94 2.938 14.075 1.857 343 H ASN 95 H ASN 95 2.447 10.535 1.704 344 HA ASN 95 HA ASN 95 4.532 9.645 0.104 345 HB2 ASN 95 2HB ASN 95 6.488 10.618 1.609 346 HB3 ASN 95 1HB ASN 95 5.886 11.531 0.230 347 HD21 ASN 95 1HD2 ASN 95 6.798 13.399 1.664 348 HD22 ASN 95 2HD2 ASN 95 5.732 14.078 2.797 349 H SER 96 H SER 96 2.715 8.419 1.781 350 HA SER 96 HA SER 96 4.497 7.249 3.883 351 HB2 SER 96 2HB SER 96 1.557 7.924 4.068 352 HB3 SER 96 1HB SER 96 2.377 6.865 5.213 353 HG SER 96 HG SER 96 3.283 8.545 6.085 354 H ARG 97 H ARG 97 4.327 5.014 4.186 355 HA ARG 97 HA ARG 97 2.613 3.549 2.237 356 HB2 ARG 97 2HB ARG 97 4.942 3.416 1.516 357 HB3 ARG 97 1HB ARG 97 5.445 2.927 3.130 358 HG2 ARG 97 2HG ARG 97 5.359 0.943 1.763 359 HG3 ARG 97 1HG ARG 97 3.991 0.872 2.869 360 HD2 ARG 97 2HD ARG 97 2.470 1.578 1.150 361 HD3 ARG 97 1HD ARG 97 3.790 1.962 0.051 362 HE ARG 97 HE ARG 97 2.722 -0.711 0.612 363 HH11 ARG 97 1HH1 ARG 97 3.621 -2.370 -0.633 364 HH12 ARG 97 2HH1 ARG 97 5.067 -2.067 -1.539 365 HH21 ARG 97 1HH2 ARG 97 5.338 1.234 -0.513 366 HH22 ARG 97 2HH2 ARG 97 6.038 -0.027 -1.471 367 H ALA 98 H ALA 98 1.117 2.386 3.350 368 HA ALA 98 HA ALA 98 1.733 1.594 6.148 369 HB1 ALA 98 1HB ALA 98 -0.977 1.109 5.065 370 HB2 ALA 98 2HB ALA 98 -0.490 2.802 5.133 371 HB3 ALA 98 3HB ALA 98 -0.490 1.826 6.602 372 H LEU 99 H LEU 99 2.244 -0.496 6.550 373 HA LEU 99 HA LEU 99 1.468 -2.560 4.521 374 HB2 LEU 99 2HB LEU 99 3.920 -2.123 4.668 375 HB3 LEU 99 1HB LEU 99 3.869 -2.561 6.373 376 HG LEU 99 HG LEU 99 2.932 -4.800 5.701 377 HD11 LEU 99 1HD1 LEU 99 2.125 -4.915 3.592 378 HD12 LEU 99 2HD1 LEU 99 3.806 -5.041 3.077 379 HD13 LEU 99 3HD1 LEU 99 3.005 -3.471 3.091 380 HD21 LEU 99 1HD2 LEU 99 5.640 -3.759 5.187 381 HD22 LEU 99 2HD2 LEU 99 5.281 -5.266 4.347 382 HD23 LEU 99 3HD2 LEU 99 5.135 -5.182 6.102 383 H LEU 100 H LEU 100 0.230 -4.215 5.268 384 HA LEU 100 HA LEU 100 0.080 -4.649 8.224 385 HB2 LEU 100 2HB LEU 100 -1.958 -3.487 7.281 386 HB3 LEU 100 1HB LEU 100 -2.231 -4.912 6.281 387 HG LEU 100 HG LEU 100 -2.242 -6.300 8.382 388 HD11 LEU 100 1HD1 LEU 100 -1.189 -5.111 10.068 389 HD12 LEU 100 2HD1 LEU 100 -2.868 -4.713 10.426 390 HD13 LEU 100 3HD1 LEU 100 -1.860 -3.566 9.544 391 HD21 LEU 100 1HD2 LEU 100 -4.519 -5.601 9.049 392 HD22 LEU 100 2HD2 LEU 100 -4.334 -5.573 7.295 393 HD23 LEU 100 3HD2 LEU 100 -4.290 -4.067 8.211 394 H HIS 101 H HIS 101 0.042 -6.826 8.852 395 HA HIS 101 HA HIS 101 0.774 -8.743 6.723 396 HB2 HIS 101 2HB HIS 101 0.518 -9.444 9.638 397 HB3 HIS 101 1HB HIS 101 1.616 -10.110 8.430 398 HD1 HIS 101 1HD HIS 101 2.346 -7.087 7.404 399 HD2 HIS 101 2HD HIS 101 2.771 -8.637 11.252 400 HE1 HIS 101 1HE HIS 101 4.109 -5.681 8.550 401 HE2 HIS 101 2HE HIS 101 4.375 -6.611 10.896 402 H SER 102 H SER 102 -0.798 -9.928 5.772 403 HA SER 102 HA SER 102 -3.518 -9.970 6.617 404 HB2 SER 102 2HB SER 102 -2.095 -12.082 4.968 405 HB3 SER 102 1HB SER 102 -3.827 -11.759 4.994 406 HG SER 102 HG SER 102 -3.138 -9.541 4.346 407 H ASP 103 H ASP 103 -0.822 -12.178 7.230 408 HA ASP 103 HA ASP 103 -1.948 -13.052 9.725 409 HB2 ASP 103 2HB ASP 103 -3.330 -14.306 7.926 410 HB3 ASP 103 1HB ASP 103 -1.855 -15.230 7.645 411 H GLU 104 H GLU 104 -0.461 -14.462 10.850 412 HA GLU 104 HA GLU 104 2.293 -14.018 10.168 413 HB2 GLU 104 2HB GLU 104 1.436 -14.427 12.493 414 HB3 GLU 104 1HB GLU 104 1.167 -16.113 12.052 415 HG2 GLU 104 2HG GLU 104 3.583 -16.308 11.467 416 HG3 GLU 104 1HG GLU 104 3.825 -14.655 12.027 417 H HIS 105 H HIS 105 0.067 -16.705 9.609 418 HA HIS 105 HA HIS 105 1.908 -18.700 8.844 419 HB2 HIS 105 2HB HIS 105 -0.827 -18.100 7.677 420 HB3 HIS 105 1HB HIS 105 0.063 -19.604 7.439 421 HD1 HIS 105 1HD HIS 105 -2.588 -19.894 8.829 422 HD2 HIS 105 2HD HIS 105 0.926 -19.073 10.922 423 HE1 HIS 105 1HE HIS 105 -2.990 -20.630 11.222 424 HE2 HIS 105 2HE HIS 105 -0.856 -20.135 12.505 425 H GLN 106 H GLN 106 0.573 -16.007 6.956 426 HA GLN 106 HA GLN 106 1.719 -16.750 4.445 427 HB2 GLN 106 2HB GLN 106 -0.014 -14.954 4.789 428 HB3 GLN 106 1HB GLN 106 1.257 -13.932 5.463 429 HG2 GLN 106 2HG GLN 106 2.521 -14.093 3.358 430 HG3 GLN 106 1HG GLN 106 1.272 -15.139 2.680 431 HE21 GLN 106 1HE2 GLN 106 1.714 -12.828 1.265 432 HE22 GLN 106 2HE2 GLN 106 0.469 -11.703 1.530 433 H LEU 107 H LEU 107 2.958 -14.820 7.141 434 HA LEU 107 HA LEU 107 5.428 -14.055 5.901 435 HB2 LEU 107 2HB LEU 107 4.521 -13.010 7.980 436 HB3 LEU 107 1HB LEU 107 4.853 -14.508 8.846 437 HG LEU 107 HG LEU 107 7.266 -14.287 8.177 438 HD11 LEU 107 1HD1 LEU 107 7.669 -12.839 6.483 439 HD12 LEU 107 2HD1 LEU 107 7.505 -11.563 7.689 440 HD13 LEU 107 3HD1 LEU 107 6.119 -12.028 6.703 441 HD21 LEU 107 1HD2 LEU 107 7.037 -11.786 9.568 442 HD22 LEU 107 2HD2 LEU 107 7.470 -13.366 10.221 443 HD23 LEU 107 3HD2 LEU 107 5.777 -12.873 10.154 444 H LEU 108 H LEU 108 4.526 -16.815 7.957 445 HA LEU 108 HA LEU 108 7.150 -18.007 7.974 446 HB2 LEU 108 2HB LEU 108 4.441 -19.347 8.292 447 HB3 LEU 108 1HB LEU 108 5.998 -20.022 8.776 448 HG LEU 108 HG LEU 108 4.714 -17.514 9.892 449 HD11 LEU 108 1HD1 LEU 108 5.434 -19.643 11.746 450 HD12 LEU 108 2HD1 LEU 108 4.294 -20.204 10.524 451 HD13 LEU 108 3HD1 LEU 108 3.890 -18.818 11.539 452 HD21 LEU 108 1HD2 LEU 108 6.973 -17.022 10.084 453 HD22 LEU 108 2HD2 LEU 108 7.445 -18.721 10.131 454 HD23 LEU 108 3HD2 LEU 108 6.740 -17.961 11.559 455 H THR 109 H THR 109 4.456 -18.027 5.757 456 HA THR 109 HA THR 109 5.276 -20.310 4.209 457 HB THR 109 HB THR 109 3.599 -17.911 3.406 458 HG1 THR 109 1HG THR 109 2.660 -20.422 4.272 459 HG21 THR 109 1HG2 THR 109 2.611 -20.040 2.063 460 HG22 THR 109 2HG2 THR 109 4.315 -20.483 2.139 461 HG23 THR 109 3HG2 THR 109 3.834 -18.954 1.404 462 H ASN 110 H ASN 110 5.807 -16.808 3.917 463 HA ASN 110 HA ASN 110 8.034 -17.409 2.027 464 HB2 ASN 110 2HB ASN 110 7.383 -15.240 0.853 465 HB3 ASN 110 1HB ASN 110 6.302 -16.610 0.600 466 HD21 ASN 110 1HD2 ASN 110 6.424 -14.748 3.630 467 HD22 ASN 110 2HD2 ASN 110 4.867 -14.088 3.483 468 HA PRO 111 HA PRO 111 9.212 -14.782 5.791 469 HB2 PRO 111 2HB PRO 111 11.649 -16.446 5.425 470 HB3 PRO 111 1HB PRO 111 10.777 -16.034 6.914 471 HG2 PRO 111 2HG PRO 111 10.638 -18.466 5.810 472 HG3 PRO 111 1HG PRO 111 9.267 -17.731 6.658 473 HD2 PRO 111 2HD PRO 111 9.671 -18.123 3.730 474 HD3 PRO 111 1HD PRO 111 8.167 -18.074 4.671 475 H LYS 112 H LYS 112 10.515 -15.453 2.647 476 HA LYS 112 HA LYS 112 12.637 -13.443 2.830 477 HB2 LYS 112 2HB LYS 112 11.536 -14.992 0.471 478 HB3 LYS 112 1HB LYS 112 12.948 -13.938 0.410 479 HG2 LYS 112 2HG LYS 112 14.015 -15.329 2.190 480 HG3 LYS 112 1HG LYS 112 12.633 -16.425 2.117 481 HD2 LYS 112 2HD LYS 112 13.099 -16.781 -0.313 482 HD3 LYS 112 1HD LYS 112 14.548 -15.789 -0.147 483 HE2 LYS 112 2HE LYS 112 15.013 -18.245 0.029 484 HE3 LYS 112 1HE LYS 112 15.492 -17.343 1.467 485 HZ1 LYS 112 1HZ LYS 112 13.482 -18.007 2.561 486 HZ2 LYS 112 2HZ LYS 112 14.261 -19.397 1.972 487 HZ3 LYS 112 3HZ LYS 112 12.906 -18.771 1.159 488 H CYS 113 H CYS 113 9.348 -13.205 2.572 489 HA CYS 113 HA CYS 113 9.014 -11.311 0.458 490 HB2 CYS 113 2HB CYS 113 7.440 -11.944 2.946 491 HB3 CYS 113 1HB CYS 113 6.967 -10.609 1.896 492 H SER 114 H SER 114 9.996 -10.908 3.842 493 HA SER 114 HA SER 114 10.652 -8.078 3.178 494 HB2 SER 114 2HB SER 114 8.611 -7.769 4.324 495 HB3 SER 114 1HB SER 114 8.958 -9.063 5.468 496 HG SER 114 HG SER 114 9.435 -7.243 6.560 497 H TYR 115 H TYR 115 12.487 -10.239 3.329 498 HA TYR 115 HA TYR 115 13.687 -10.400 5.953 499 HB2 TYR 115 2HB TYR 115 15.443 -11.609 4.908 500 HB3 TYR 115 1HB TYR 115 14.001 -12.022 3.986 501 HD1 TYR 115 1HD TYR 115 13.511 -10.669 1.849 502 HD2 TYR 115 2HD TYR 115 17.312 -10.645 3.848 503 HE1 TYR 115 1HE TYR 115 14.595 -9.846 -0.223 504 HE2 TYR 115 2HE TYR 115 18.396 -9.820 1.777 505 HH TYR 115 HH TYR 115 16.684 -8.549 -0.811 506 H ILE 116 H ILE 116 13.786 -8.067 3.411 507 HA ILE 116 HA ILE 116 16.198 -6.760 4.567 508 HB ILE 116 HB ILE 116 15.567 -5.153 2.511 509 HG12 ILE 116 2HG1 ILE 116 14.616 -6.469 0.662 510 HG13 ILE 116 1HG1 ILE 116 14.404 -7.848 1.740 511 HG21 ILE 116 1HG2 ILE 116 16.826 -7.082 1.092 512 HG22 ILE 116 2HG2 ILE 116 17.130 -7.667 2.726 513 HG23 ILE 116 3HG2 ILE 116 17.654 -6.051 2.257 514 HD11 ILE 116 1HD1 ILE 116 13.215 -5.202 2.508 515 HD12 ILE 116 2HD1 ILE 116 12.674 -6.827 2.925 516 HD13 ILE 116 3HD1 ILE 116 12.393 -6.193 1.305 517 HA PRO 117 HA PRO 117 14.281 -3.572 6.924 518 HB2 PRO 117 2HB PRO 117 15.266 -1.690 4.811 519 HB3 PRO 117 1HB PRO 117 15.386 -1.561 6.577 520 HG2 PRO 117 2HG PRO 117 17.444 -2.357 5.040 521 HG3 PRO 117 1HG PRO 117 17.195 -2.943 6.691 522 HD2 PRO 117 2HD PRO 117 16.933 -4.409 4.158 523 HD3 PRO 117 1HD PRO 117 17.039 -5.042 5.814 524 HA PRO 118 HA PRO 118 10.658 -3.177 4.113 525 HB2 PRO 118 2HB PRO 118 8.760 -3.905 5.879 526 HB3 PRO 118 1HB PRO 118 9.817 -5.104 5.107 527 HG2 PRO 118 2HG PRO 118 9.927 -3.975 7.852 528 HG3 PRO 118 1HG PRO 118 10.274 -5.617 7.292 529 HD2 PRO 118 2HD PRO 118 12.197 -3.660 7.841 530 HD3 PRO 118 1HD PRO 118 12.471 -5.127 6.877 531 H CYS 119 H CYS 119 9.105 -1.483 3.943 532 HA CYS 119 HA CYS 119 9.337 0.618 6.038 533 HB2 CYS 119 2HB CYS 119 7.852 1.671 3.925 534 HB3 CYS 119 1HB CYS 119 9.575 1.928 4.203 535 H LYS 120 H LYS 120 7.763 0.366 7.557 536 HA LYS 120 HA LYS 120 4.965 -0.024 6.596 537 HB2 LYS 120 2HB LYS 120 4.553 -1.592 8.437 538 HB3 LYS 120 1HB LYS 120 5.866 -2.188 7.417 539 HG2 LYS 120 2HG LYS 120 7.493 -1.118 9.017 540 HG3 LYS 120 1HG LYS 120 6.129 -0.760 10.077 541 HD2 LYS 120 2HD LYS 120 5.573 -3.225 10.047 542 HD3 LYS 120 1HD LYS 120 7.097 -3.492 9.202 543 HE2 LYS 120 2HE LYS 120 6.888 -2.077 11.872 544 HE3 LYS 120 1HE LYS 120 7.254 -3.793 11.699 545 HZ1 LYS 120 1HZ LYS 120 8.887 -2.220 9.990 546 HZ2 LYS 120 2HZ LYS 120 9.345 -3.329 11.194 547 HZ3 LYS 120 3HZ LYS 120 9.042 -1.707 11.599 548 H ARG 121 H ARG 121 3.468 1.246 7.674 549 HA ARG 121 HA ARG 121 4.371 3.473 9.230 550 HB2 ARG 121 2HB ARG 121 2.210 3.293 7.900 551 HB3 ARG 121 1HB ARG 121 1.573 2.326 9.224 552 HG2 ARG 121 2HG ARG 121 2.104 4.201 10.794 553 HG3 ARG 121 1HG ARG 121 2.583 5.178 9.404 554 HD2 ARG 121 2HD ARG 121 -0.158 3.948 9.824 555 HD3 ARG 121 1HD ARG 121 0.247 5.648 10.058 556 HE ARG 121 HE ARG 121 -0.072 4.287 7.471 557 HH11 ARG 121 1HH1 ARG 121 -0.018 5.667 5.683 558 HH12 ARG 121 2HH1 ARG 121 0.524 7.300 5.881 559 HH21 ARG 121 1HH2 ARG 121 1.124 6.969 9.280 560 HH22 ARG 121 2HH2 ARG 121 1.171 8.037 7.918 561 H GLU 122 H GLU 122 2.824 0.417 10.122 562 HA GLU 122 HA GLU 122 3.876 0.760 12.877 563 HB2 GLU 122 2HB GLU 122 1.022 -0.020 12.204 564 HB3 GLU 122 1HB GLU 122 1.722 -0.012 13.823 565 HG2 GLU 122 2HG GLU 122 2.191 2.416 13.583 566 HG3 GLU 122 1HG GLU 122 1.409 2.391 12.003 567 H ASN 123 H ASN 123 4.278 -1.253 13.940 568 HA ASN 123 HA ASN 123 5.074 -3.409 12.262 569 HB2 ASN 123 2HB ASN 123 4.345 -3.586 15.194 570 HB3 ASN 123 1HB ASN 123 5.441 -4.645 14.306 571 HD21 ASN 123 1HD2 ASN 123 5.120 -1.480 15.808 572 HD22 ASN 123 2HD2 ASN 123 6.750 -1.030 15.648 573 H GLN 124 H GLN 124 2.167 -2.958 14.251 574 HA GLN 124 HA GLN 124 0.479 -4.433 12.463 575 HB2 GLN 124 2HB GLN 124 1.809 -6.349 13.375 576 HB3 GLN 124 1HB GLN 124 1.250 -5.923 14.992 577 HG2 GLN 124 2HG GLN 124 -1.081 -6.258 14.291 578 HG3 GLN 124 1HG GLN 124 -0.544 -6.650 12.657 579 HE21 GLN 124 1HE2 GLN 124 -1.983 -8.637 13.882 580 HE22 GLN 124 2HE2 GLN 124 -0.972 -9.897 14.399 581 H LYS 125 H LYS 125 -1.723 -4.296 13.142 582 HA LYS 125 HA LYS 125 -2.182 -2.345 15.294 583 HB2 LYS 125 2HB LYS 125 -4.094 -3.731 13.389 584 HB3 LYS 125 1HB LYS 125 -4.552 -2.465 14.528 585 HG2 LYS 125 2HG LYS 125 -2.896 -0.944 13.442 586 HG3 LYS 125 1HG LYS 125 -2.571 -2.201 12.249 587 HD2 LYS 125 2HD LYS 125 -4.997 -2.190 11.640 588 HD3 LYS 125 1HD LYS 125 -5.231 -0.833 12.745 589 HE2 LYS 125 2HE LYS 125 -3.718 -0.920 10.150 590 HE3 LYS 125 1HE LYS 125 -4.899 0.265 10.710 591 HZ1 LYS 125 1HZ LYS 125 -2.537 1.025 10.745 592 HZ2 LYS 125 2HZ LYS 125 -2.244 -0.111 11.974 593 HZ3 LYS 125 3HZ LYS 125 -3.344 1.159 12.230 594 H ASN 126 H ASN 126 -4.089 -5.262 14.547 595 HA ASN 126 HA ASN 126 -3.476 -6.467 17.140 596 HB2 ASN 126 2HB ASN 126 -5.666 -6.306 18.107 597 HB3 ASN 126 1HB ASN 126 -5.212 -4.670 17.627 598 HD21 ASN 126 1HD2 ASN 126 -7.907 -5.045 17.857 599 HD22 ASN 126 2HD2 ASN 126 -8.643 -5.182 16.334 600 H LEU 127 H LEU 127 -4.787 -8.552 17.384 601 HA LEU 127 HA LEU 127 -4.628 -10.056 14.949 602 HB2 LEU 127 2HB LEU 127 -5.807 -10.635 17.665 603 HB3 LEU 127 1HB LEU 127 -5.913 -11.803 16.349 604 HG LEU 127 HG LEU 127 -3.913 -12.075 17.910 605 HD11 LEU 127 1HD1 LEU 127 -2.488 -11.696 15.455 606 HD12 LEU 127 2HD1 LEU 127 -4.108 -12.273 15.071 607 HD13 LEU 127 3HD1 LEU 127 -3.077 -13.203 16.155 608 HD21 LEU 127 1HD2 LEU 127 -2.080 -10.540 17.716 609 HD22 LEU 127 2HD2 LEU 127 -3.515 -9.563 18.018 610 HD23 LEU 127 3HD2 LEU 127 -2.855 -9.682 16.386 611 H GLU 128 H GLU 128 -7.342 -8.536 16.637 612 HA GLU 128 HA GLU 128 -9.456 -9.735 15.168 613 HB2 GLU 128 2HB GLU 128 -9.741 -8.295 17.199 614 HB3 GLU 128 1HB GLU 128 -9.364 -6.888 16.204 615 HG2 GLU 128 2HG GLU 128 -11.269 -7.474 14.707 616 HG3 GLU 128 1HG GLU 128 -11.678 -8.802 15.794 617 H SER 129 H SER 129 -7.350 -7.009 14.369 618 HA SER 129 HA SER 129 -8.807 -6.041 12.122 619 HB2 SER 129 2HB SER 129 -6.696 -5.019 11.414 620 HB3 SER 129 1HB SER 129 -6.903 -4.828 13.150 621 HG SER 129 HG SER 129 -5.594 -7.108 12.196 622 H VAL 130 H VAL 130 -6.546 -8.735 12.452 623 HA VAL 130 HA VAL 130 -6.079 -9.198 9.685 624 HB VAL 130 HB VAL 130 -6.184 -11.102 12.035 625 HG11 VAL 130 1HG1 VAL 130 -5.795 -11.570 9.120 626 HG12 VAL 130 2HG1 VAL 130 -6.443 -12.650 10.355 627 HG13 VAL 130 3HG1 VAL 130 -4.701 -12.415 10.215 628 HG21 VAL 130 1HG2 VAL 130 -3.996 -9.677 10.505 629 HG22 VAL 130 2HG2 VAL 130 -3.666 -11.048 11.565 630 HG23 VAL 130 3HG2 VAL 130 -4.358 -9.567 12.228 631 H MET 131 H MET 131 -8.677 -10.439 11.816 632 HA MET 131 HA MET 131 -9.912 -12.001 9.731 633 HB2 MET 131 2HB MET 131 -10.345 -12.266 12.213 634 HB3 MET 131 1HB MET 131 -11.286 -10.776 12.140 635 HG2 MET 131 2HG MET 131 -12.082 -12.581 10.015 636 HG3 MET 131 1HG MET 131 -12.206 -13.376 11.583 637 HE1 MET 131 1HE MET 131 -13.658 -10.658 9.181 638 HE2 MET 131 2HE MET 131 -15.294 -11.025 9.725 639 HE3 MET 131 3HE MET 131 -14.218 -12.335 9.252 640 H ASN 132 H ASN 132 -10.520 -8.751 11.026 641 HA ASN 132 HA ASN 132 -12.694 -8.107 9.286 642 HB2 ASN 132 2HB ASN 132 -11.936 -6.834 11.370 643 HB3 ASN 132 1HB ASN 132 -10.673 -6.127 10.361 644 HD21 ASN 132 1HD2 ASN 132 -11.905 -4.030 10.860 645 HD22 ASN 132 2HD2 ASN 132 -13.233 -3.638 9.878 646 H TRP 133 H TRP 133 -9.180 -7.821 8.932 647 HA TRP 133 HA TRP 133 -9.164 -6.270 6.547 648 HB2 TRP 133 2HB TRP 133 -7.067 -6.525 7.597 649 HB3 TRP 133 1HB TRP 133 -7.240 -8.278 7.707 650 HD1 TRP 133 HD TRP 133 -6.324 -5.498 5.272 651 HE1 TRP 133 1HE TRP 133 -5.291 -6.544 3.155 652 HE3 TRP 133 3HE TRP 133 -7.192 -10.438 6.219 653 HZ2 TRP 133 2HZ TRP 133 -4.886 -9.135 2.016 654 HZ3 TRP 133 3HZ TRP 133 -6.472 -12.173 4.603 655 HH2 TRP 133 HH TRP 133 -5.321 -11.530 2.504 656 H GLN 134 H GLN 134 -9.150 -9.824 6.951 657 HA GLN 134 HA GLN 134 -9.107 -10.432 4.170 658 HB2 GLN 134 2HB GLN 134 -8.761 -12.090 6.020 659 HB3 GLN 134 1HB GLN 134 -10.491 -12.018 6.353 660 HG2 GLN 134 2HG GLN 134 -10.383 -12.427 3.608 661 HG3 GLN 134 1HG GLN 134 -9.071 -13.433 4.225 662 HE21 GLN 134 1HE2 GLN 134 -12.540 -12.703 4.854 663 HE22 GLN 134 2HE2 GLN 134 -12.924 -14.264 5.400 664 H GLN 135 H GLN 135 -11.873 -10.020 6.394 665 HA GLN 135 HA GLN 135 -13.857 -10.428 4.333 666 HB2 GLN 135 2HB GLN 135 -14.247 -10.641 6.827 667 HB3 GLN 135 1HB GLN 135 -14.187 -8.879 6.917 668 HG2 GLN 135 2HG GLN 135 -16.034 -8.772 5.242 669 HG3 GLN 135 1HG GLN 135 -16.136 -10.532 5.289 670 HE21 GLN 135 1HE2 GLN 135 -18.450 -9.349 6.042 671 HE22 GLN 135 2HE2 GLN 135 -18.648 -9.359 7.728 672 H TYR 136 H TYR 136 -12.403 -7.557 5.813 673 HA TYR 136 HA TYR 136 -13.952 -5.646 4.315 674 HB2 TYR 136 2HB TYR 136 -12.856 -5.047 6.411 675 HB3 TYR 136 1HB TYR 136 -11.276 -5.395 5.711 676 HD1 TYR 136 1HD TYR 136 -14.032 -3.004 5.908 677 HD2 TYR 136 2HD TYR 136 -10.359 -3.972 3.900 678 HE1 TYR 136 1HE TYR 136 -13.904 -0.689 5.027 679 HE2 TYR 136 2HE TYR 136 -10.230 -1.656 3.022 680 HH TYR 136 HH TYR 136 -11.062 0.527 3.463 681 H TRP 137 H TRP 137 -10.555 -6.715 3.942 682 HA TRP 137 HA TRP 137 -10.102 -5.208 1.552 683 HB2 TRP 137 2HB TRP 137 -8.255 -6.018 2.927 684 HB3 TRP 137 1HB TRP 137 -8.715 -7.688 2.597 685 HD1 TRP 137 HD TRP 137 -6.904 -4.741 1.110 686 HE1 TRP 137 1HE TRP 137 -5.839 -5.437 -1.134 687 HE3 TRP 137 3HE TRP 137 -9.058 -9.307 0.514 688 HZ2 TRP 137 2HZ TRP 137 -5.901 -7.658 -2.945 689 HZ3 TRP 137 3HZ TRP 137 -8.547 -10.704 -1.471 690 HH2 TRP 137 HH TRP 137 -6.969 -9.883 -3.200 691 H LYS 138 H LYS 138 -11.027 -8.623 2.019 692 HA LYS 138 HA LYS 138 -10.948 -9.231 -0.793 693 HB2 LYS 138 2HB LYS 138 -10.844 -10.941 1.029 694 HB3 LYS 138 1HB LYS 138 -12.548 -10.632 1.364 695 HG2 LYS 138 2HG LYS 138 -13.099 -11.245 -0.980 696 HG3 LYS 138 1HG LYS 138 -11.398 -11.616 -1.264 697 HD2 LYS 138 2HD LYS 138 -11.512 -13.280 0.615 698 HD3 LYS 138 1HD LYS 138 -13.249 -12.985 0.707 699 HE2 LYS 138 2HE LYS 138 -11.961 -13.745 -1.908 700 HE3 LYS 138 1HE LYS 138 -12.417 -14.983 -0.737 701 HZ1 LYS 138 1HZ LYS 138 -14.072 -13.435 -2.474 702 HZ2 LYS 138 2HZ LYS 138 -14.585 -13.330 -0.858 703 HZ3 LYS 138 3HZ LYS 138 -14.439 -14.847 -1.611 704 H ASP 139 H ASP 139 -13.654 -8.412 1.383 705 HA ASP 139 HA ASP 139 -15.678 -8.661 -0.629 706 HB2 ASP 139 2HB ASP 139 -15.616 -7.024 1.916 707 HB3 ASP 139 1HB ASP 139 -17.057 -7.279 0.931 708 H GLU 140 H GLU 140 -13.863 -5.799 0.523 709 HA GLU 140 HA GLU 140 -15.258 -4.040 -1.322 710 HB2 GLU 140 2HB GLU 140 -12.731 -3.647 0.302 711 HB3 GLU 140 1HB GLU 140 -13.520 -2.378 -0.637 712 HG2 GLU 140 2HG GLU 140 -15.611 -2.772 0.681 713 HG3 GLU 140 1HG GLU 140 -14.719 -3.919 1.682 714 H ILE 141 H ILE 141 -12.081 -5.628 -1.264 715 HA ILE 141 HA ILE 141 -11.866 -4.980 -4.164 716 HB ILE 141 HB ILE 141 -9.590 -5.108 -2.178 717 HG12 ILE 141 2HG1 ILE 141 -10.716 -2.698 -3.630 718 HG13 ILE 141 1HG1 ILE 141 -11.117 -3.107 -1.959 719 HG21 ILE 141 1HG2 ILE 141 -9.691 -5.342 -5.021 720 HG22 ILE 141 2HG2 ILE 141 -8.264 -5.260 -3.988 721 HG23 ILE 141 3HG2 ILE 141 -8.972 -3.779 -4.635 722 HD11 ILE 141 1HD1 ILE 141 -8.230 -3.113 -2.577 723 HD12 ILE 141 2HD1 ILE 141 -9.081 -2.457 -1.178 724 HD13 ILE 141 3HD1 ILE 141 -9.003 -1.530 -2.678 725 H GLY 142 H GLY 142 -12.066 -6.880 -5.246 726 HA2 GLY 142 2HA GLY 142 -11.561 -9.456 -4.074 727 HA3 GLY 142 1HA GLY 142 -11.745 -9.144 -5.803 728 H SER 143 H SER 143 -9.629 -7.167 -5.921 729 HA SER 143 HA SER 143 -7.126 -7.734 -4.963 730 HB2 SER 143 2HB SER 143 -6.949 -9.980 -5.478 731 HB3 SER 143 1HB SER 143 -8.046 -9.859 -6.850 732 HG SER 143 HG SER 143 -5.540 -10.046 -7.058 733 H GLN 144 H GLN 144 -7.521 -5.417 -5.747 734 HA GLN 144 HA GLN 144 -6.099 -5.029 -8.263 735 HB2 GLN 144 2HB GLN 144 -8.066 -3.586 -9.163 736 HB3 GLN 144 1HB GLN 144 -8.145 -5.338 -9.356 737 HG2 GLN 144 2HG GLN 144 -9.734 -5.588 -7.666 738 HG3 GLN 144 1HG GLN 144 -9.286 -4.072 -6.883 739 HE21 GLN 144 1HE2 GLN 144 -9.575 -3.915 -10.338 740 HE22 GLN 144 2HE2 GLN 144 -11.089 -3.148 -10.388 741 HA PRO 145 HA PRO 145 -5.224 -1.626 -5.259 742 HB2 PRO 145 2HB PRO 145 -3.170 -1.059 -7.334 743 HB3 PRO 145 1HB PRO 145 -2.982 -1.234 -5.580 744 HG2 PRO 145 2HG PRO 145 -2.175 -3.115 -7.316 745 HG3 PRO 145 1HG PRO 145 -2.764 -3.499 -5.693 746 HD2 PRO 145 2HD PRO 145 -4.108 -3.885 -8.319 747 HD3 PRO 145 1HD PRO 145 -4.306 -4.790 -6.805 748 H PHE 146 H PHE 146 -4.997 0.857 -5.751 749 HA PHE 146 HA PHE 146 -6.153 1.590 -8.354 750 HB2 PHE 146 2HB PHE 146 -7.867 3.030 -7.273 751 HB3 PHE 146 1HB PHE 146 -8.126 1.317 -6.978 752 HD1 PHE 146 1HD PHE 146 -8.128 4.462 -5.515 753 HD2 PHE 146 2HD PHE 146 -6.812 0.444 -4.737 754 HE1 PHE 146 1HE PHE 146 -8.165 4.920 -3.085 755 HE2 PHE 146 2HE PHE 146 -6.834 0.914 -2.307 756 HZ PHE 146 HZ PHE 146 -7.513 3.149 -1.477 757 H THR 147 H THR 147 -5.932 3.848 -8.873 758 HA THR 147 HA THR 147 -3.859 5.232 -7.227 759 HB THR 147 HB THR 147 -2.891 6.099 -9.277 760 HG1 THR 147 1HG THR 147 -4.522 4.484 -10.851 761 HG21 THR 147 1HG2 THR 147 -1.709 4.187 -9.115 762 HG22 THR 147 2HG2 THR 147 -2.732 3.587 -10.420 763 HG23 THR 147 3HG2 THR 147 -3.147 3.237 -8.741 764 H CYS 148 H CYS 148 -3.976 7.559 -7.317 765 HA CYS 148 HA CYS 148 -6.518 8.667 -8.329 766 HB2 CYS 148 2HB CYS 148 -6.317 10.015 -5.980 767 HB3 CYS 148 1HB CYS 148 -7.292 8.559 -6.171 768 H TYR 149 H TYR 149 -6.448 11.074 -8.378 769 HA TYR 149 HA TYR 149 -3.727 12.256 -8.214 770 HB2 TYR 149 2HB TYR 149 -5.420 12.428 -10.731 771 HB3 TYR 149 1HB TYR 149 -3.878 13.232 -10.461 772 HD1 TYR 149 1HD TYR 149 -1.806 11.863 -10.099 773 HD2 TYR 149 2HD TYR 149 -5.517 10.128 -11.387 774 HE1 TYR 149 1HE TYR 149 -0.593 9.838 -10.864 775 HE2 TYR 149 2HE TYR 149 -4.307 8.102 -12.152 776 HH TYR 149 HH TYR 149 -1.999 7.503 -12.869 777 H PHE 150 H PHE 150 -3.858 14.454 -7.596 778 HA PHE 150 HA PHE 150 -6.507 15.727 -7.812 779 HB2 PHE 150 2HB PHE 150 -7.059 15.590 -5.631 780 HB3 PHE 150 1HB PHE 150 -5.763 14.410 -5.475 781 HD1 PHE 150 1HD PHE 150 -3.507 15.110 -4.724 782 HD2 PHE 150 2HD PHE 150 -6.814 17.841 -4.839 783 HE1 PHE 150 1HE PHE 150 -2.266 16.666 -3.251 784 HE2 PHE 150 2HE PHE 150 -5.590 19.406 -3.357 785 HZ PHE 150 HZ PHE 150 -3.306 18.814 -2.558 786 H ASN 151 H ASN 151 -6.471 17.976 -7.716 787 HA ASN 151 HA ASN 151 -3.851 19.292 -7.265 788 HB2 ASN 151 2HB ASN 151 -3.919 20.459 -9.384 789 HB3 ASN 151 1HB ASN 151 -4.031 18.728 -9.697 790 HD21 ASN 151 1HD2 ASN 151 -5.037 20.738 -11.536 791 HD22 ASN 151 2HD2 ASN 151 -6.723 20.562 -11.617 792 H GLN 152 H GLN 152 -4.186 21.007 -5.988 793 HA GLN 152 HA GLN 152 -6.887 22.153 -5.677 794 HB2 GLN 152 2HB GLN 152 -5.593 21.667 -3.647 795 HB3 GLN 152 1HB GLN 152 -4.276 22.687 -4.220 796 HG2 GLN 152 2HG GLN 152 -5.638 24.666 -4.064 797 HG3 GLN 152 1HG GLN 152 -7.089 23.712 -3.756 798 HE21 GLN 152 1HE2 GLN 152 -6.526 25.605 -1.846 799 HE22 GLN 152 2HE2 GLN 152 -5.890 24.888 -0.444 800 H HIS 153 H HIS 153 -4.172 22.663 -7.579 801 HA HIS 153 HA HIS 153 -3.718 25.401 -7.662 802 HB2 HIS 153 2HB HIS 153 -3.960 23.468 -9.982 803 HB3 HIS 153 1HB HIS 153 -3.267 25.083 -10.101 804 HD1 HIS 153 1HD HIS 153 -0.863 25.371 -9.379 805 HD2 HIS 153 2HD HIS 153 -2.452 21.712 -8.166 806 HE1 HIS 153 1HE HIS 153 1.064 24.038 -8.407 807 HE2 HIS 153 2HE HIS 153 0.107 21.808 -7.669 808 H GLN 154 H GLN 154 -6.543 23.651 -8.873 809 HA GLN 154 HA GLN 154 -7.648 25.884 -10.327 810 HB2 GLN 154 2HB GLN 154 -8.973 23.460 -9.074 811 HB3 GLN 154 1HB GLN 154 -9.782 24.593 -10.154 812 HG2 GLN 154 2HG GLN 154 -8.182 24.075 -11.939 813 HG3 GLN 154 1HG GLN 154 -7.318 22.976 -10.862 814 HE21 GLN 154 1HE2 GLN 154 -8.461 22.016 -13.295 815 HE22 GLN 154 2HE2 GLN 154 -9.753 20.983 -12.915 816 H ARG 155 H ARG 155 -8.837 24.442 -7.281 817 HA ARG 155 HA ARG 155 -8.753 26.936 -5.863 818 HB2 ARG 155 2HB ARG 155 -11.015 26.609 -7.562 819 HB3 ARG 155 1HB ARG 155 -11.574 26.436 -5.896 820 HG2 ARG 155 2HG ARG 155 -9.805 28.709 -6.839 821 HG3 ARG 155 1HG ARG 155 -11.563 28.813 -6.748 822 HD2 ARG 155 2HD ARG 155 -11.576 28.887 -4.460 823 HD3 ARG 155 1HD ARG 155 -10.192 27.805 -4.314 824 HE ARG 155 HE ARG 155 -8.753 29.696 -4.417 825 HH11 ARG 155 1HH1 ARG 155 -8.422 31.931 -4.357 826 HH12 ARG 155 2HH1 ARG 155 -9.749 32.997 -4.677 827 HH21 ARG 155 1HH2 ARG 155 -12.029 30.437 -5.193 828 HH22 ARG 155 2HH2 ARG 155 -11.791 32.151 -5.150 829 HA PRO 156 HA PRO 156 -10.566 23.588 -3.104 830 HB2 PRO 156 2HB PRO 156 -12.162 21.662 -4.042 831 HB3 PRO 156 1HB PRO 156 -12.712 23.346 -3.990 832 HG2 PRO 156 2HG PRO 156 -11.921 21.706 -6.308 833 HG3 PRO 156 1HG PRO 156 -13.015 23.094 -6.226 834 HD2 PRO 156 2HD PRO 156 -10.220 23.077 -6.993 835 HD3 PRO 156 1HD PRO 156 -11.342 24.450 -6.959 836 H ASP 157 H ASP 157 -10.956 20.835 -5.109 837 HA ASP 157 HA ASP 157 -8.216 19.915 -5.111 838 HB2 ASP 157 2HB ASP 157 -8.528 18.122 -3.404 839 HB3 ASP 157 1HB ASP 157 -8.626 19.735 -2.702 840 H ASP 158 H ASP 158 -9.169 19.597 -7.342 841 HA ASP 158 HA ASP 158 -11.300 17.768 -7.857 842 HB2 ASP 158 2HB ASP 158 -10.146 19.240 -9.576 843 HB3 ASP 158 1HB ASP 158 -8.801 18.098 -9.550 844 H VAL 159 H VAL 159 -11.231 15.434 -8.141 845 HA VAL 159 HA VAL 159 -8.648 14.163 -7.342 846 HB VAL 159 HB VAL 159 -10.126 14.368 -5.354 847 HG11 VAL 159 1HG1 VAL 159 -11.957 12.399 -6.723 848 HG12 VAL 159 2HG1 VAL 159 -12.233 14.137 -6.842 849 HG13 VAL 159 3HG1 VAL 159 -12.256 13.345 -5.267 850 HG21 VAL 159 1HG2 VAL 159 -9.245 12.413 -4.647 851 HG22 VAL 159 2HG2 VAL 159 -8.769 12.103 -6.316 852 HG23 VAL 159 3HG2 VAL 159 -10.307 11.489 -5.709 853 H LEU 160 H LEU 160 -8.272 12.117 -8.162 854 HA LEU 160 HA LEU 160 -10.247 11.092 -10.168 855 HB2 LEU 160 2HB LEU 160 -7.243 11.254 -10.216 856 HB3 LEU 160 1HB LEU 160 -8.073 10.023 -11.159 857 HG LEU 160 HG LEU 160 -9.447 11.823 -12.222 858 HD11 LEU 160 1HD1 LEU 160 -9.505 13.695 -10.892 859 HD12 LEU 160 2HD1 LEU 160 -8.130 14.151 -11.897 860 HD13 LEU 160 3HD1 LEU 160 -7.863 13.453 -10.301 861 HD21 LEU 160 1HD2 LEU 160 -7.852 12.216 -13.835 862 HD22 LEU 160 2HD2 LEU 160 -6.987 10.982 -12.920 863 HD23 LEU 160 3HD2 LEU 160 -6.627 12.688 -12.659 864 H LEU 161 H LEU 161 -10.518 8.779 -10.188 865 HA LEU 161 HA LEU 161 -9.153 7.313 -7.973 866 HB2 LEU 161 2HB LEU 161 -11.462 8.081 -7.297 867 HB3 LEU 161 1HB LEU 161 -12.105 7.061 -8.584 868 HG LEU 161 HG LEU 161 -10.507 5.259 -7.395 869 HD11 LEU 161 1HD1 LEU 161 -11.369 7.151 -5.186 870 HD12 LEU 161 2HD1 LEU 161 -9.708 6.824 -5.684 871 HD13 LEU 161 3HD1 LEU 161 -10.672 5.550 -4.936 872 HD21 LEU 161 1HD2 LEU 161 -12.895 4.968 -7.810 873 HD22 LEU 161 2HD2 LEU 161 -13.285 6.070 -6.492 874 HD23 LEU 161 3HD2 LEU 161 -12.532 4.514 -6.147 875 H HIS 162 H HIS 162 -8.045 6.761 -10.238 876 HA HIS 162 HA HIS 162 -9.464 4.887 -11.942 877 HB2 HIS 162 2HB HIS 162 -6.497 5.432 -11.600 878 HB3 HIS 162 1HB HIS 162 -7.184 4.405 -12.858 879 HD1 HIS 162 1HD HIS 162 -5.660 6.921 -13.711 880 HD2 HIS 162 2HD HIS 162 -9.775 6.878 -13.023 881 HE1 HIS 162 1HE HIS 162 -6.623 8.883 -14.995 882 HE2 HIS 162 2HE HIS 162 -9.127 8.865 -14.582 883 H ARG 163 H ARG 163 -9.120 2.562 -12.008 884 HA ARG 163 HA ARG 163 -8.154 1.451 -9.398 885 HB2 ARG 163 2HB ARG 163 -9.796 -0.316 -9.639 886 HB3 ARG 163 1HB ARG 163 -10.614 1.237 -9.817 887 HG2 ARG 163 2HG ARG 163 -10.325 0.992 -12.321 888 HG3 ARG 163 1HG ARG 163 -9.774 -0.658 -12.025 889 HD2 ARG 163 2HD ARG 163 -11.920 -1.105 -10.817 890 HD3 ARG 163 1HD ARG 163 -12.472 0.505 -11.279 891 HE ARG 163 HE ARG 163 -12.789 -0.284 -13.494 892 HH11 ARG 163 1HH1 ARG 163 -12.880 -1.959 -15.010 893 HH12 ARG 163 2HH1 ARG 163 -12.125 -3.476 -14.652 894 HH21 ARG 163 1HH2 ARG 163 -10.997 -2.478 -11.529 895 HH22 ARG 163 2HH2 ARG 163 -11.060 -3.769 -12.681 896 H THR 164 H THR 164 -7.146 -0.686 -9.496 897 HA THR 164 HA THR 164 -5.364 -0.970 -11.777 898 HB THR 164 HB THR 164 -5.836 -2.790 -9.404 899 HG1 THR 164 1HG THR 164 -4.487 -1.525 -8.426 900 HG21 THR 164 1HG2 THR 164 -3.256 -3.149 -10.428 901 HG22 THR 164 2HG2 THR 164 -4.301 -3.112 -11.848 902 HG23 THR 164 3HG2 THR 164 -4.604 -4.278 -10.560 903 H HIS 165 H HIS 165 -5.499 -2.460 -13.447 904 HA HIS 165 HA HIS 165 -8.017 -4.072 -13.556 905 HB2 HIS 165 2HB HIS 165 -6.273 -3.048 -15.818 906 HB3 HIS 165 1HB HIS 165 -7.755 -3.982 -16.011 907 HD1 HIS 165 1HD HIS 165 -9.958 -2.805 -14.849 908 HD2 HIS 165 2HD HIS 165 -6.717 -0.318 -15.687 909 HE1 HIS 165 1HE HIS 165 -10.848 -0.431 -14.819 910 HE2 HIS 165 2HE HIS 165 -8.884 1.090 -15.327 911 H ASP 166 H ASP 166 -7.841 -6.276 -13.827 912 HA ASP 166 HA ASP 166 -5.379 -7.595 -13.271 913 HB2 ASP 166 2HB ASP 166 -7.655 -8.593 -12.949 914 HB3 ASP 166 1HB ASP 166 -7.790 -8.752 -14.701 Start of MODEL 13 1 H1 GLN 45 1HT GLN 45 5.854 18.527 -3.033 2 H2 GLN 45 2HT GLN 45 4.254 18.086 -2.672 3 H3 GLN 45 3HT GLN 45 5.388 18.286 -1.421 4 HA GLN 45 HA GLN 45 3.671 20.200 -2.527 5 HB2 GLN 45 2HB GLN 45 5.916 20.351 -0.492 6 HB3 GLN 45 1HB GLN 45 4.699 21.603 -0.736 7 HG2 GLN 45 2HG GLN 45 2.917 20.010 -0.171 8 HG3 GLN 45 1HG GLN 45 4.110 18.728 0.030 9 HE21 GLN 45 1HE2 GLN 45 2.433 19.485 2.208 10 HE22 GLN 45 2HE2 GLN 45 3.389 20.232 3.395 11 H ASP 46 H ASP 46 6.961 19.467 -3.267 12 HA ASP 46 HA ASP 46 7.972 22.017 -3.975 13 HB2 ASP 46 2HB ASP 46 9.284 19.867 -3.957 14 HB3 ASP 46 1HB ASP 46 8.488 19.431 -5.469 15 H LEU 47 H LEU 47 6.026 19.720 -5.856 16 HA LEU 47 HA LEU 47 5.757 21.726 -8.023 17 HB2 LEU 47 2HB LEU 47 4.653 18.904 -7.866 18 HB3 LEU 47 1HB LEU 47 4.753 19.921 -9.304 19 HG LEU 47 HG LEU 47 7.151 19.006 -7.693 20 HD11 LEU 47 1HD1 LEU 47 7.549 17.589 -9.775 21 HD12 LEU 47 2HD1 LEU 47 5.878 17.936 -10.220 22 HD13 LEU 47 3HD1 LEU 47 6.231 17.061 -8.729 23 HD21 LEU 47 1HD2 LEU 47 6.739 20.629 -10.198 24 HD22 LEU 47 2HD2 LEU 47 8.226 19.705 -9.976 25 HD23 LEU 47 3HD2 LEU 47 7.789 20.966 -8.821 26 H GLN 48 H GLN 48 3.787 22.812 -8.346 27 HA GLN 48 HA GLN 48 1.983 22.984 -6.162 28 HB2 GLN 48 2HB GLN 48 1.388 23.656 -9.060 29 HB3 GLN 48 1HB GLN 48 0.530 24.275 -7.649 30 HG2 GLN 48 2HG GLN 48 3.488 24.706 -8.146 31 HG3 GLN 48 1HG GLN 48 2.242 25.869 -8.586 32 HE21 GLN 48 1HE2 GLN 48 1.083 24.430 -5.813 33 HE22 GLN 48 2HE2 GLN 48 1.724 25.492 -4.655 34 H ALA 49 H ALA 49 1.889 21.010 -9.095 35 HA ALA 49 HA ALA 49 -0.750 19.943 -8.590 36 HB1 ALA 49 1HB ALA 49 0.265 17.992 -10.051 37 HB2 ALA 49 2HB ALA 49 1.589 19.130 -10.298 38 HB3 ALA 49 3HB ALA 49 -0.047 19.562 -10.792 39 H THR 50 H THR 50 -1.300 18.082 -7.356 40 HA THR 50 HA THR 50 0.970 16.938 -5.787 41 HB THR 50 HB THR 50 -1.896 17.146 -4.864 42 HG1 THR 50 1HG THR 50 -0.723 19.186 -5.198 43 HG21 THR 50 1HG2 THR 50 -0.518 16.929 -2.624 44 HG22 THR 50 2HG2 THR 50 0.699 16.216 -3.678 45 HG23 THR 50 3HG2 THR 50 -0.903 15.490 -3.569 46 H GLU 51 H GLU 51 0.963 14.746 -5.372 47 HA GLU 51 HA GLU 51 -0.941 13.147 -7.016 48 HB2 GLU 51 2HB GLU 51 1.913 12.481 -6.270 49 HB3 GLU 51 1HB GLU 51 0.864 11.542 -7.331 50 HG2 GLU 51 2HG GLU 51 0.721 13.520 -8.861 51 HG3 GLU 51 1HG GLU 51 1.878 14.357 -7.829 52 H ALA 52 H ALA 52 -1.933 11.399 -5.993 53 HA ALA 52 HA ALA 52 -0.945 10.574 -3.336 54 HB1 ALA 52 1HB ALA 52 -2.495 12.267 -2.643 55 HB2 ALA 52 2HB ALA 52 -3.348 10.733 -2.463 56 HB3 ALA 52 3HB ALA 52 -3.677 11.767 -3.854 57 H ASN 53 H ASN 53 -0.702 8.412 -3.831 58 HA ASN 53 HA ASN 53 -2.852 7.174 -5.456 59 HB2 ASN 53 2HB ASN 53 -0.043 6.280 -4.841 60 HB3 ASN 53 1HB ASN 53 -1.224 5.242 -5.639 61 HD21 ASN 53 1HD2 ASN 53 -2.549 7.305 -7.203 62 HD22 ASN 53 2HD2 ASN 53 -1.449 7.846 -8.374 63 H CYS 54 H CYS 54 -4.169 5.619 -4.682 64 HA CYS 54 HA CYS 54 -3.639 4.630 -1.912 65 HB2 CYS 54 2HB CYS 54 -6.461 4.906 -2.569 66 HB3 CYS 54 1HB CYS 54 -5.585 5.543 -1.182 67 H THR 55 H THR 55 -3.028 2.535 -2.603 68 HA THR 55 HA THR 55 -5.112 1.128 -4.199 69 HB THR 55 HB THR 55 -3.587 0.725 -5.799 70 HG1 THR 55 1HG THR 55 -1.830 -0.591 -5.273 71 HG21 THR 55 1HG2 THR 55 -1.395 1.799 -5.700 72 HG22 THR 55 2HG2 THR 55 -1.562 2.026 -3.961 73 HG23 THR 55 3HG2 THR 55 -2.619 2.899 -5.069 74 H VAL 56 H VAL 56 -5.513 -1.009 -3.750 75 HA VAL 56 HA VAL 56 -4.606 -1.936 -1.086 76 HB VAL 56 HB VAL 56 -6.774 -2.788 -3.019 77 HG11 VAL 56 1HG1 VAL 56 -5.405 -4.371 -0.905 78 HG12 VAL 56 2HG1 VAL 56 -6.215 -4.914 -2.374 79 HG13 VAL 56 3HG1 VAL 56 -7.165 -4.471 -0.956 80 HG21 VAL 56 1HG2 VAL 56 -7.427 -2.557 -0.194 81 HG22 VAL 56 2HG2 VAL 56 -8.146 -1.734 -1.576 82 HG23 VAL 56 3HG2 VAL 56 -6.699 -1.073 -0.809 83 H LEU 57 H LEU 57 -2.649 -2.952 -1.259 84 HA LEU 57 HA LEU 57 -1.399 -3.970 -3.492 85 HB2 LEU 57 2HB LEU 57 -0.525 -3.860 -1.078 86 HB3 LEU 57 1HB LEU 57 -1.291 -5.433 -0.853 87 HG LEU 57 HG LEU 57 -0.014 -6.227 -2.902 88 HD11 LEU 57 1HD1 LEU 57 1.100 -4.680 -4.101 89 HD12 LEU 57 2HD1 LEU 57 2.169 -4.424 -2.722 90 HD13 LEU 57 3HD1 LEU 57 0.723 -3.436 -2.910 91 HD21 LEU 57 1HD2 LEU 57 1.157 -7.134 -1.197 92 HD22 LEU 57 2HD2 LEU 57 0.940 -5.696 -0.198 93 HD23 LEU 57 3HD2 LEU 57 2.266 -5.773 -1.357 94 H SER 58 H SER 58 -1.245 -6.078 -4.446 95 HA SER 58 HA SER 58 -3.787 -7.586 -4.284 96 HB2 SER 58 2HB SER 58 -3.131 -8.583 -6.382 97 HB3 SER 58 1HB SER 58 -2.814 -6.855 -6.511 98 HG SER 58 HG SER 58 -1.117 -8.759 -6.926 99 H VAL 59 H VAL 59 -3.657 -9.967 -4.039 100 HA VAL 59 HA VAL 59 -1.347 -10.688 -2.308 101 HB VAL 59 HB VAL 59 -3.892 -12.271 -2.716 102 HG11 VAL 59 1HG1 VAL 59 -3.238 -13.465 -0.840 103 HG12 VAL 59 2HG1 VAL 59 -2.292 -12.128 -0.189 104 HG13 VAL 59 3HG1 VAL 59 -1.660 -13.084 -1.529 105 HG21 VAL 59 1HG2 VAL 59 -5.016 -10.598 -1.690 106 HG22 VAL 59 2HG2 VAL 59 -3.530 -9.677 -1.459 107 HG23 VAL 59 3HG2 VAL 59 -4.015 -10.881 -0.265 108 H GLN 60 H GLN 60 0.260 -11.789 -3.284 109 HA GLN 60 HA GLN 60 -0.424 -13.926 -5.217 110 HB2 GLN 60 2HB GLN 60 1.571 -11.714 -5.777 111 HB3 GLN 60 1HB GLN 60 1.332 -13.139 -6.785 112 HG2 GLN 60 2HG GLN 60 -1.021 -12.489 -7.152 113 HG3 GLN 60 1HG GLN 60 -0.781 -11.057 -6.150 114 HE21 GLN 60 1HE2 GLN 60 -1.571 -10.586 -8.759 115 HE22 GLN 60 2HE2 GLN 60 -0.273 -9.986 -9.675 116 H GLN 61 H GLN 61 1.344 -15.472 -5.479 117 HA GLN 61 HA GLN 61 2.820 -15.885 -3.013 118 HB2 GLN 61 2HB GLN 61 3.121 -17.315 -5.664 119 HB3 GLN 61 1HB GLN 61 3.656 -17.903 -4.093 120 HG2 GLN 61 2HG GLN 61 0.794 -17.384 -4.945 121 HG3 GLN 61 1HG GLN 61 1.536 -18.962 -4.677 122 HE21 GLN 61 1HE2 GLN 61 -0.364 -16.645 -3.180 123 HE22 GLN 61 2HE2 GLN 61 -0.045 -17.047 -1.566 124 H ILE 62 H ILE 62 5.267 -16.415 -3.209 125 HA ILE 62 HA ILE 62 6.785 -14.145 -3.649 126 HB ILE 62 HB ILE 62 7.672 -17.006 -4.148 127 HG12 ILE 62 2HG1 ILE 62 7.843 -15.327 -1.631 128 HG13 ILE 62 1HG1 ILE 62 6.584 -16.528 -1.921 129 HG21 ILE 62 1HG2 ILE 62 9.417 -15.644 -4.963 130 HG22 ILE 62 2HG2 ILE 62 9.885 -15.943 -3.291 131 HG23 ILE 62 3HG2 ILE 62 9.146 -14.406 -3.735 132 HD11 ILE 62 1HD1 ILE 62 9.548 -16.962 -1.573 133 HD12 ILE 62 2HD1 ILE 62 8.537 -18.170 -2.367 134 HD13 ILE 62 3HD1 ILE 62 8.218 -17.715 -0.693 135 H GLY 63 H GLY 63 8.549 -13.909 -5.431 136 HA2 GLY 63 2HA GLY 63 9.167 -14.095 -7.760 137 HA3 GLY 63 1HA GLY 63 7.570 -14.755 -8.103 138 H GLU 64 H GLU 64 7.043 -12.236 -6.059 139 HA GLU 64 HA GLU 64 6.811 -10.269 -8.294 140 HB2 GLU 64 2HB GLU 64 4.594 -11.203 -7.576 141 HB3 GLU 64 1HB GLU 64 4.895 -10.552 -5.963 142 HG2 GLU 64 2HG GLU 64 5.162 -8.281 -6.976 143 HG3 GLU 64 1HG GLU 64 4.714 -8.963 -8.540 144 H VAL 65 H VAL 65 7.394 -8.140 -7.791 145 HA VAL 65 HA VAL 65 8.501 -7.721 -5.046 146 HB VAL 65 HB VAL 65 10.177 -6.247 -6.058 147 HG11 VAL 65 1HG1 VAL 65 11.476 -8.052 -6.424 148 HG12 VAL 65 2HG1 VAL 65 10.611 -8.428 -7.914 149 HG13 VAL 65 3HG1 VAL 65 10.019 -9.044 -6.371 150 HG21 VAL 65 1HG2 VAL 65 8.407 -6.614 -8.402 151 HG22 VAL 65 2HG2 VAL 65 10.133 -6.660 -8.757 152 HG23 VAL 65 3HG2 VAL 65 9.432 -5.246 -7.970 153 H PHE 66 H PHE 66 8.118 -5.673 -4.102 154 HA PHE 66 HA PHE 66 6.114 -3.978 -5.530 155 HB2 PHE 66 2HB PHE 66 6.293 -4.566 -2.561 156 HB3 PHE 66 1HB PHE 66 5.114 -3.498 -3.328 157 HD1 PHE 66 1HD PHE 66 6.087 -6.958 -2.690 158 HD2 PHE 66 2HD PHE 66 3.410 -4.420 -4.889 159 HE1 PHE 66 1HE PHE 66 4.641 -8.910 -3.179 160 HE2 PHE 66 2HE PHE 66 1.961 -6.373 -5.377 161 HZ PHE 66 HZ PHE 66 2.576 -8.619 -4.522 162 H GLU 67 H GLU 67 6.191 -1.676 -4.925 163 HA GLU 67 HA GLU 67 8.955 -0.873 -4.139 164 HB2 GLU 67 2HB GLU 67 8.653 1.110 -5.467 165 HB3 GLU 67 1HB GLU 67 8.130 -0.259 -6.448 166 HG2 GLU 67 2HG GLU 67 5.771 0.190 -5.702 167 HG3 GLU 67 1HG GLU 67 6.353 1.653 -4.908 168 H CYS 68 H CYS 68 9.223 0.899 -2.704 169 HA CYS 68 HA CYS 68 6.838 1.428 -0.984 170 HB2 CYS 68 2HB CYS 68 8.821 0.347 0.109 171 HB3 CYS 68 1HB CYS 68 9.781 1.765 -0.311 172 H THR 69 H THR 69 6.669 3.708 -0.169 173 HA THR 69 HA THR 69 7.872 5.638 -2.112 174 HB THR 69 HB THR 69 5.758 6.155 -2.683 175 HG1 THR 69 1HG THR 69 5.348 6.769 0.052 176 HG21 THR 69 1HG2 THR 69 3.825 5.078 -1.588 177 HG22 THR 69 2HG2 THR 69 4.876 4.516 -0.287 178 HG23 THR 69 3HG2 THR 69 5.096 3.904 -1.927 179 H PHE 70 H PHE 70 8.717 7.540 -1.284 180 HA PHE 70 HA PHE 70 8.224 8.277 1.517 181 HB2 PHE 70 2HB PHE 70 10.570 8.254 2.173 182 HB3 PHE 70 1HB PHE 70 10.090 6.632 1.671 183 HD1 PHE 70 1HD PHE 70 12.122 9.572 0.872 184 HD2 PHE 70 2HD PHE 70 10.811 5.724 -0.516 185 HE1 PHE 70 1HE PHE 70 13.914 9.580 -0.842 186 HE2 PHE 70 2HE PHE 70 12.604 5.733 -2.229 187 HZ PHE 70 HZ PHE 70 14.154 7.660 -2.393 188 H THR 71 H THR 71 9.225 10.400 2.016 189 HA THR 71 HA THR 71 9.945 11.957 -0.417 190 HB THR 71 HB THR 71 8.101 12.942 1.779 191 HG1 THR 71 1HG THR 71 6.478 12.373 0.529 192 HG21 THR 71 1HG2 THR 71 8.542 14.958 0.892 193 HG22 THR 71 2HG2 THR 71 7.878 14.398 -0.644 194 HG23 THR 71 3HG2 THR 71 9.601 14.222 -0.311 195 H CYS 72 H CYS 72 11.391 13.719 0.006 196 HA CYS 72 HA CYS 72 12.526 13.759 2.773 197 HB2 CYS 72 2HB CYS 72 14.331 12.767 1.807 198 HB3 CYS 72 1HB CYS 72 13.853 13.246 0.183 199 H GLY 73 H GLY 73 13.722 15.822 3.216 200 HA2 GLY 73 2HA GLY 73 12.127 18.083 2.246 201 HA3 GLY 73 1HA GLY 73 13.335 18.143 3.531 202 H ALA 74 H ALA 74 12.813 19.682 0.922 203 HA ALA 74 HA ALA 74 14.444 21.093 -0.165 204 HB1 ALA 74 1HB ALA 74 16.304 19.839 1.116 205 HB2 ALA 74 2HB ALA 74 16.694 20.468 -0.481 206 HB3 ALA 74 3HB ALA 74 16.344 18.756 -0.277 207 H ASP 75 H ASP 75 12.323 19.551 -1.143 208 HA ASP 75 HA ASP 75 11.452 18.722 -3.149 209 HB2 ASP 75 2HB ASP 75 13.949 20.069 -4.223 210 HB3 ASP 75 1HB ASP 75 12.622 19.478 -5.221 211 H CYS 76 H CYS 76 12.818 16.824 -1.649 212 HA CYS 76 HA CYS 76 14.227 15.238 -3.768 213 HB2 CYS 76 2HB CYS 76 15.112 14.089 -1.502 214 HB3 CYS 76 1HB CYS 76 15.930 15.471 -2.235 215 H ARG 77 H ARG 77 12.817 13.689 -4.440 216 HA ARG 77 HA ARG 77 11.362 12.146 -2.342 217 HB2 ARG 77 2HB ARG 77 9.502 11.964 -4.165 218 HB3 ARG 77 1HB ARG 77 9.597 13.442 -3.202 219 HG2 ARG 77 2HG ARG 77 11.300 13.462 -5.607 220 HG3 ARG 77 1HG ARG 77 9.571 13.377 -5.947 221 HD2 ARG 77 2HD ARG 77 10.793 15.389 -4.041 222 HD3 ARG 77 1HD ARG 77 10.480 15.728 -5.743 223 HE ARG 77 HE ARG 77 8.459 15.495 -3.631 224 HH11 ARG 77 1HH1 ARG 77 6.349 15.968 -4.290 225 HH12 ARG 77 2HH1 ARG 77 5.988 16.078 -5.980 226 HH21 ARG 77 1HH2 ARG 77 9.232 15.386 -6.989 227 HH22 ARG 77 2HH2 ARG 77 7.620 15.748 -7.508 228 H GLY 78 H GLY 78 11.044 9.897 -2.917 229 HA2 GLY 78 2HA GLY 78 11.859 8.882 -5.504 230 HA3 GLY 78 1HA GLY 78 13.129 8.643 -4.303 231 H THR 79 H THR 79 12.140 6.388 -5.337 232 HA THR 79 HA THR 79 10.414 5.308 -3.160 233 HB THR 79 HB THR 79 9.221 3.935 -4.741 234 HG1 THR 79 1HG THR 79 10.105 3.441 -6.561 235 HG21 THR 79 1HG2 THR 79 7.885 5.615 -5.450 236 HG22 THR 79 2HG2 THR 79 9.170 6.336 -6.418 237 HG23 THR 79 3HG2 THR 79 9.058 6.694 -4.696 238 H SER 80 H SER 80 10.743 2.961 -2.813 239 HA SER 80 HA SER 80 13.477 2.075 -3.659 240 HB2 SER 80 2HB SER 80 12.043 1.431 -1.064 241 HB3 SER 80 1HB SER 80 13.669 0.924 -1.510 242 HG SER 80 HG SER 80 13.590 3.517 -1.859 243 H GLN 81 H GLN 81 13.690 -0.228 -4.059 244 HA GLN 81 HA GLN 81 11.074 -1.545 -4.645 245 HB2 GLN 81 2HB GLN 81 12.520 -1.008 -6.622 246 HB3 GLN 81 1HB GLN 81 13.749 -2.073 -5.949 247 HG2 GLN 81 2HG GLN 81 12.507 -3.384 -7.523 248 HG3 GLN 81 1HG GLN 81 11.996 -3.906 -5.917 249 HE21 GLN 81 1HE2 GLN 81 9.798 -3.682 -5.398 250 HE22 GLN 81 2HE2 GLN 81 8.668 -2.891 -6.380 251 H TYR 82 H TYR 82 10.663 -3.484 -3.674 252 HA TYR 82 HA TYR 82 12.937 -4.973 -2.469 253 HB2 TYR 82 2HB TYR 82 10.336 -4.368 -1.032 254 HB3 TYR 82 1HB TYR 82 11.699 -5.277 -0.381 255 HD1 TYR 82 1HD TYR 82 14.061 -3.935 -0.750 256 HD2 TYR 82 2HD TYR 82 10.169 -2.171 -0.304 257 HE1 TYR 82 1HE TYR 82 15.106 -1.822 0.022 258 HE2 TYR 82 2HE TYR 82 11.216 -0.058 0.467 259 HH TYR 82 HH TYR 82 13.326 1.102 0.332 260 HA PRO 83 HA PRO 83 11.107 -8.637 -4.219 261 HB2 PRO 83 2HB PRO 83 11.144 -9.834 -1.487 262 HB3 PRO 83 1HB PRO 83 11.807 -10.463 -3.005 263 HG2 PRO 83 2HG PRO 83 13.357 -9.412 -1.097 264 HG3 PRO 83 1HG PRO 83 13.735 -9.262 -2.820 265 HD2 PRO 83 2HD PRO 83 12.763 -7.190 -0.933 266 HD3 PRO 83 1HD PRO 83 13.698 -7.016 -2.433 267 H CYS 84 H CYS 84 9.477 -10.519 -2.674 268 HA CYS 84 HA CYS 84 6.898 -9.254 -3.013 269 HB2 CYS 84 2HB CYS 84 6.457 -11.454 -3.267 270 HB3 CYS 84 1HB CYS 84 7.924 -11.924 -2.407 271 H VAL 85 H VAL 85 5.454 -8.542 -1.436 272 HA VAL 85 HA VAL 85 6.476 -8.444 1.373 273 HB VAL 85 HB VAL 85 6.644 -6.269 0.006 274 HG11 VAL 85 1HG1 VAL 85 4.674 -5.096 -0.503 275 HG12 VAL 85 2HG1 VAL 85 3.700 -6.068 0.603 276 HG13 VAL 85 3HG1 VAL 85 4.261 -6.758 -0.917 277 HG21 VAL 85 1HG2 VAL 85 5.878 -4.927 1.945 278 HG22 VAL 85 2HG2 VAL 85 6.782 -6.348 2.464 279 HG23 VAL 85 3HG2 VAL 85 5.024 -6.336 2.571 280 H GLN 86 H GLN 86 4.680 -8.087 2.973 281 HA GLN 86 HA GLN 86 2.602 -9.964 2.732 282 HB2 GLN 86 2HB GLN 86 2.520 -7.436 4.401 283 HB3 GLN 86 1HB GLN 86 1.632 -8.931 4.700 284 HG2 GLN 86 2HG GLN 86 4.652 -8.660 4.685 285 HG3 GLN 86 1HG GLN 86 3.647 -8.796 6.125 286 HE21 GLN 86 1HE2 GLN 86 5.663 -10.656 4.390 287 HE22 GLN 86 2HE2 GLN 86 4.890 -12.163 4.505 288 H VAL 87 H VAL 87 0.213 -8.581 3.427 289 HA VAL 87 HA VAL 87 -0.417 -7.206 0.837 290 HB VAL 87 HB VAL 87 -2.267 -8.909 2.528 291 HG11 VAL 87 1HG1 VAL 87 -2.583 -7.774 -0.267 292 HG12 VAL 87 2HG1 VAL 87 -3.342 -7.105 1.178 293 HG13 VAL 87 3HG1 VAL 87 -3.778 -8.720 0.618 294 HG21 VAL 87 1HG2 VAL 87 -1.490 -10.717 1.427 295 HG22 VAL 87 2HG2 VAL 87 -0.192 -9.708 0.788 296 HG23 VAL 87 3HG2 VAL 87 -1.687 -9.906 -0.127 297 H TYR 88 H TYR 88 -1.577 -5.287 0.944 298 HA TYR 88 HA TYR 88 -3.163 -4.444 3.157 299 HB2 TYR 88 2HB TYR 88 -1.463 -2.654 3.949 300 HB3 TYR 88 1HB TYR 88 -1.275 -4.299 4.501 301 HD1 TYR 88 1HD TYR 88 -0.079 -1.875 1.939 302 HD2 TYR 88 2HD TYR 88 0.635 -5.593 3.966 303 HE1 TYR 88 1HE TYR 88 2.176 -2.000 0.923 304 HE2 TYR 88 2HE TYR 88 2.879 -5.717 2.944 305 HH TYR 88 HH TYR 88 4.137 -3.054 0.953 306 H VAL 89 H VAL 89 -2.048 -1.574 2.889 307 HA VAL 89 HA VAL 89 -2.771 -1.072 0.066 308 HB VAL 89 HB VAL 89 -4.811 -0.814 1.503 309 HG11 VAL 89 1HG1 VAL 89 -3.495 -0.031 3.512 310 HG12 VAL 89 2HG1 VAL 89 -4.911 0.952 3.140 311 HG13 VAL 89 3HG1 VAL 89 -3.301 1.522 2.698 312 HG21 VAL 89 1HG2 VAL 89 -5.048 0.496 -0.388 313 HG22 VAL 89 2HG2 VAL 89 -3.581 1.418 -0.062 314 HG23 VAL 89 3HG2 VAL 89 -5.057 1.760 0.840 315 H ASN 90 H ASN 90 -1.531 0.543 -0.831 316 HA ASN 90 HA ASN 90 0.508 1.779 0.912 317 HB2 ASN 90 2HB ASN 90 0.280 2.199 -2.056 318 HB3 ASN 90 1HB ASN 90 1.724 2.162 -1.050 319 HD21 ASN 90 1HD2 ASN 90 0.931 -0.282 0.415 320 HD22 ASN 90 2HD2 ASN 90 1.077 -1.565 -0.687 321 H ASN 91 H ASN 91 0.102 3.785 1.743 322 HA ASN 91 HA ASN 91 -1.939 5.466 0.387 323 HB2 ASN 91 2HB ASN 91 -0.651 5.691 3.125 324 HB3 ASN 91 1HB ASN 91 -1.858 6.812 2.491 325 HD21 ASN 91 1HD2 ASN 91 -2.370 5.257 4.846 326 HD22 ASN 91 2HD2 ASN 91 -3.597 4.140 4.490 327 H SER 92 H SER 92 -0.523 6.122 -1.345 328 HA SER 92 HA SER 92 1.951 7.545 -0.667 329 HB2 SER 92 2HB SER 92 0.871 7.787 -3.405 330 HB3 SER 92 1HB SER 92 2.486 7.337 -2.867 331 HG SER 92 HG SER 92 1.493 5.302 -2.205 332 H GLU 93 H GLU 93 -0.594 8.590 0.364 333 HA GLU 93 HA GLU 93 -1.481 10.855 -1.144 334 HB2 GLU 93 2HB GLU 93 -1.402 10.521 1.873 335 HB3 GLU 93 1HB GLU 93 -2.425 11.644 0.974 336 HG2 GLU 93 2HG GLU 93 -3.483 9.701 -0.178 337 HG3 GLU 93 1HG GLU 93 -2.519 8.618 0.829 338 H SER 94 H SER 94 1.423 10.167 0.429 339 HA SER 94 HA SER 94 2.636 12.671 -0.271 340 HB2 SER 94 2HB SER 94 3.064 13.544 1.987 341 HB3 SER 94 1HB SER 94 1.329 13.447 1.701 342 HG SER 94 HG SER 94 1.635 11.230 2.686 343 H ASN 95 H ASN 95 2.685 9.853 1.875 344 HA ASN 95 HA ASN 95 4.920 8.582 0.857 345 HB2 ASN 95 2HB ASN 95 6.610 9.342 2.742 346 HB3 ASN 95 1HB ASN 95 6.478 10.271 1.253 347 HD21 ASN 95 1HD2 ASN 95 3.709 10.509 3.316 348 HD22 ASN 95 2HD2 ASN 95 4.060 12.034 3.973 349 H SER 96 H SER 96 2.508 7.915 2.193 350 HA SER 96 HA SER 96 3.558 6.597 4.673 351 HB2 SER 96 2HB SER 96 0.916 7.868 4.056 352 HB3 SER 96 1HB SER 96 0.973 6.517 5.185 353 HG SER 96 HG SER 96 2.175 7.684 6.541 354 H ARG 97 H ARG 97 3.182 4.404 4.897 355 HA ARG 97 HA ARG 97 1.607 3.065 2.753 356 HB2 ARG 97 2HB ARG 97 4.060 2.877 2.298 357 HB3 ARG 97 1HB ARG 97 4.252 2.082 3.860 358 HG2 ARG 97 2HG ARG 97 2.111 0.888 2.270 359 HG3 ARG 97 1HG ARG 97 3.673 0.812 1.455 360 HD2 ARG 97 2HD ARG 97 3.330 0.012 4.347 361 HD3 ARG 97 1HD ARG 97 3.118 -1.134 3.026 362 HE ARG 97 HE ARG 97 5.652 -0.158 4.011 363 HH11 ARG 97 1HH1 ARG 97 7.495 -0.809 2.876 364 HH12 ARG 97 2HH1 ARG 97 7.330 -1.432 1.268 365 HH21 ARG 97 1HH2 ARG 97 3.880 -1.091 1.205 366 HH22 ARG 97 2HH2 ARG 97 5.283 -1.592 0.323 367 H ALA 98 H ALA 98 0.170 1.595 3.563 368 HA ALA 98 HA ALA 98 0.263 1.039 6.474 369 HB1 ALA 98 1HB ALA 98 -1.977 1.219 6.295 370 HB2 ALA 98 2HB ALA 98 -1.992 -0.189 5.233 371 HB3 ALA 98 3HB ALA 98 -1.831 1.429 4.550 372 H LEU 99 H LEU 99 0.911 -0.951 7.212 373 HA LEU 99 HA LEU 99 1.274 -3.117 5.175 374 HB2 LEU 99 2HB LEU 99 3.365 -2.155 6.107 375 HB3 LEU 99 1HB LEU 99 2.833 -2.616 7.725 376 HG LEU 99 HG LEU 99 2.564 -4.995 6.435 377 HD11 LEU 99 1HD1 LEU 99 5.151 -3.973 5.319 378 HD12 LEU 99 2HD1 LEU 99 3.661 -3.670 4.428 379 HD13 LEU 99 3HD1 LEU 99 4.161 -5.325 4.776 380 HD21 LEU 99 1HD2 LEU 99 5.021 -3.807 7.749 381 HD22 LEU 99 2HD2 LEU 99 4.842 -5.524 7.392 382 HD23 LEU 99 3HD2 LEU 99 3.744 -4.741 8.528 383 H LEU 100 H LEU 100 -0.046 -4.833 5.469 384 HA LEU 100 HA LEU 100 -0.907 -5.525 8.234 385 HB2 LEU 100 2HB LEU 100 -2.554 -5.762 5.698 386 HB3 LEU 100 1HB LEU 100 -3.080 -6.128 7.331 387 HG LEU 100 HG LEU 100 -2.202 -3.394 6.375 388 HD11 LEU 100 1HD1 LEU 100 -4.936 -4.592 6.896 389 HD12 LEU 100 2HD1 LEU 100 -4.330 -3.945 5.373 390 HD13 LEU 100 3HD1 LEU 100 -4.647 -2.862 6.728 391 HD21 LEU 100 1HD2 LEU 100 -3.622 -3.042 8.682 392 HD22 LEU 100 2HD2 LEU 100 -1.865 -3.157 8.618 393 HD23 LEU 100 3HD2 LEU 100 -2.826 -4.580 9.014 394 H HIS 101 H HIS 101 -1.030 -7.797 8.634 395 HA HIS 101 HA HIS 101 0.407 -9.451 6.616 396 HB2 HIS 101 2HB HIS 101 -0.303 -10.244 9.449 397 HB3 HIS 101 1HB HIS 101 0.934 -10.945 8.405 398 HD1 HIS 101 1HD HIS 101 2.542 -8.647 7.457 399 HD2 HIS 101 2HD HIS 101 1.043 -8.762 11.347 400 HE1 HIS 101 1HE HIS 101 3.979 -7.073 8.825 401 HE2 HIS 101 2HE HIS 101 3.076 -7.135 11.196 402 H SER 102 H SER 102 -0.877 -10.694 5.313 403 HA SER 102 HA SER 102 -3.682 -10.977 5.641 404 HB2 SER 102 2HB SER 102 -2.316 -11.423 3.532 405 HB3 SER 102 1HB SER 102 -1.908 -12.984 4.235 406 HG SER 102 HG SER 102 -4.130 -12.252 2.955 407 H ASP 103 H ASP 103 -1.032 -13.181 6.544 408 HA ASP 103 HA ASP 103 -2.445 -14.170 8.834 409 HB2 ASP 103 2HB ASP 103 -3.697 -15.266 6.863 410 HB3 ASP 103 1HB ASP 103 -2.228 -16.213 6.621 411 H GLU 104 H GLU 104 -1.164 -15.785 9.981 412 HA GLU 104 HA GLU 104 1.661 -15.393 9.699 413 HB2 GLU 104 2HB GLU 104 0.512 -16.033 11.834 414 HB3 GLU 104 1HB GLU 104 0.241 -17.640 11.161 415 HG2 GLU 104 2HG GLU 104 2.702 -17.888 10.849 416 HG3 GLU 104 1HG GLU 104 2.931 -16.325 11.634 417 H HIS 105 H HIS 105 -0.555 -17.847 8.482 418 HA HIS 105 HA HIS 105 1.327 -19.828 7.741 419 HB2 HIS 105 2HB HIS 105 -1.084 -20.224 7.654 420 HB3 HIS 105 1HB HIS 105 -1.257 -19.012 6.383 421 HD1 HIS 105 1HD HIS 105 0.489 -22.348 6.993 422 HD2 HIS 105 2HD HIS 105 -0.852 -19.984 3.833 423 HE1 HIS 105 1HE HIS 105 0.813 -23.720 4.884 424 HE2 HIS 105 2HE HIS 105 -0.003 -22.290 2.954 425 H GLN 106 H GLN 106 0.259 -16.906 6.017 426 HA GLN 106 HA GLN 106 1.668 -17.431 3.588 427 HB2 GLN 106 2HB GLN 106 -0.046 -15.612 3.902 428 HB3 GLN 106 1HB GLN 106 1.161 -14.708 4.819 429 HG2 GLN 106 2HG GLN 106 2.676 -14.740 2.872 430 HG3 GLN 106 1HG GLN 106 1.473 -15.645 1.951 431 HE21 GLN 106 1HE2 GLN 106 2.174 -13.252 0.825 432 HE22 GLN 106 2HE2 GLN 106 0.965 -12.083 1.060 433 H LEU 107 H LEU 107 2.641 -15.843 6.598 434 HA LEU 107 HA LEU 107 5.206 -14.945 5.774 435 HB2 LEU 107 2HB LEU 107 4.124 -14.345 7.943 436 HB3 LEU 107 1HB LEU 107 4.402 -15.991 8.507 437 HG LEU 107 HG LEU 107 6.863 -15.644 8.075 438 HD11 LEU 107 1HD1 LEU 107 5.801 -12.920 7.377 439 HD12 LEU 107 2HD1 LEU 107 7.055 -13.867 6.575 440 HD13 LEU 107 3HD1 LEU 107 7.400 -13.063 8.107 441 HD21 LEU 107 1HD2 LEU 107 5.203 -14.656 10.190 442 HD22 LEU 107 2HD2 LEU 107 6.539 -13.528 9.964 443 HD23 LEU 107 3HD2 LEU 107 6.868 -15.229 10.289 444 H LEU 108 H LEU 108 4.170 -18.067 7.146 445 HA LEU 108 HA LEU 108 6.792 -19.255 7.122 446 HB2 LEU 108 2HB LEU 108 4.086 -20.616 6.878 447 HB3 LEU 108 1HB LEU 108 5.599 -21.391 7.342 448 HG LEU 108 HG LEU 108 4.170 -19.195 8.869 449 HD11 LEU 108 1HD1 LEU 108 3.859 -20.923 10.573 450 HD12 LEU 108 2HD1 LEU 108 4.734 -22.090 9.582 451 HD13 LEU 108 3HD1 LEU 108 3.171 -21.472 9.043 452 HD21 LEU 108 1HD2 LEU 108 6.895 -20.427 9.090 453 HD22 LEU 108 2HD2 LEU 108 6.047 -19.990 10.573 454 HD23 LEU 108 3HD2 LEU 108 6.397 -18.756 9.363 455 H THR 109 H THR 109 4.231 -18.872 4.760 456 HA THR 109 HA THR 109 5.326 -20.663 2.782 457 HB THR 109 HB THR 109 3.461 -18.292 2.468 458 HG1 THR 109 1HG THR 109 2.600 -20.940 2.493 459 HG21 THR 109 1HG2 THR 109 2.964 -20.416 0.645 460 HG22 THR 109 2HG2 THR 109 4.687 -20.045 0.585 461 HG23 THR 109 3HG2 THR 109 3.500 -18.775 0.289 462 H ASN 110 H ASN 110 5.529 -17.168 3.374 463 HA ASN 110 HA ASN 110 7.871 -17.089 1.523 464 HB2 ASN 110 2HB ASN 110 5.902 -14.813 1.758 465 HB3 ASN 110 1HB ASN 110 7.124 -15.079 0.517 466 HD21 ASN 110 1HD2 ASN 110 4.233 -14.736 0.026 467 HD22 ASN 110 2HD2 ASN 110 3.693 -16.170 -0.702 468 HA PRO 111 HA PRO 111 8.680 -15.447 5.897 469 HB2 PRO 111 2HB PRO 111 11.279 -16.730 5.215 470 HB3 PRO 111 1HB PRO 111 10.356 -16.794 6.727 471 HG2 PRO 111 2HG PRO 111 10.461 -18.864 5.037 472 HG3 PRO 111 1HG PRO 111 9.019 -18.498 5.995 473 HD2 PRO 111 2HD PRO 111 9.485 -18.103 3.080 474 HD3 PRO 111 1HD PRO 111 7.970 -18.407 3.955 475 H LYS 112 H LYS 112 10.485 -15.407 2.867 476 HA LYS 112 HA LYS 112 12.312 -13.311 3.481 477 HB2 LYS 112 2HB LYS 112 11.037 -14.075 0.837 478 HB3 LYS 112 1HB LYS 112 12.410 -12.979 1.009 479 HG2 LYS 112 2HG LYS 112 13.671 -14.808 2.154 480 HG3 LYS 112 1HG LYS 112 12.321 -15.895 1.837 481 HD2 LYS 112 2HD LYS 112 12.574 -15.428 -0.605 482 HD3 LYS 112 1HD LYS 112 14.002 -14.461 -0.239 483 HE2 LYS 112 2HE LYS 112 14.332 -16.929 1.116 484 HE3 LYS 112 1HE LYS 112 13.792 -17.320 -0.518 485 HZ1 LYS 112 1HZ LYS 112 15.740 -16.705 -1.348 486 HZ2 LYS 112 2HZ LYS 112 16.330 -16.615 0.243 487 HZ3 LYS 112 3HZ LYS 112 15.720 -15.225 -0.520 488 H CYS 113 H CYS 113 8.936 -13.274 2.492 489 HA CYS 113 HA CYS 113 8.873 -10.412 1.974 490 HB2 CYS 113 2HB CYS 113 6.536 -12.227 2.606 491 HB3 CYS 113 1HB CYS 113 6.504 -10.702 1.723 492 H SER 114 H SER 114 9.676 -9.407 3.863 493 HA SER 114 HA SER 114 8.037 -8.360 5.754 494 HB2 SER 114 2HB SER 114 8.634 -10.043 7.750 495 HB3 SER 114 1HB SER 114 7.182 -10.248 6.774 496 HG SER 114 HG SER 114 9.661 -11.594 6.615 497 H TYR 115 H TYR 115 11.002 -10.335 5.871 498 HA TYR 115 HA TYR 115 12.367 -8.588 7.710 499 HB2 TYR 115 2HB TYR 115 13.520 -10.559 5.713 500 HB3 TYR 115 1HB TYR 115 14.383 -9.854 7.081 501 HD1 TYR 115 1HD TYR 115 12.295 -12.539 5.998 502 HD2 TYR 115 2HD TYR 115 13.313 -10.170 9.431 503 HE1 TYR 115 1HE TYR 115 11.363 -14.292 7.483 504 HE2 TYR 115 2HE TYR 115 12.386 -11.923 10.918 505 HH TYR 115 HH TYR 115 10.371 -13.999 10.276 506 H ILE 116 H ILE 116 12.059 -8.657 4.210 507 HA ILE 116 HA ILE 116 14.214 -6.919 3.563 508 HB ILE 116 HB ILE 116 12.649 -6.301 1.579 509 HG12 ILE 116 2HG1 ILE 116 11.079 -8.717 2.252 510 HG13 ILE 116 1HG1 ILE 116 10.722 -7.303 3.242 511 HG21 ILE 116 1HG2 ILE 116 12.748 -9.014 1.064 512 HG22 ILE 116 2HG2 ILE 116 13.990 -8.814 2.299 513 HG23 ILE 116 3HG2 ILE 116 14.077 -7.884 0.802 514 HD11 ILE 116 1HD1 ILE 116 10.272 -5.966 1.265 515 HD12 ILE 116 2HD1 ILE 116 9.313 -7.443 1.172 516 HD13 ILE 116 3HD1 ILE 116 10.784 -7.285 0.212 517 HA PRO 117 HA PRO 117 13.391 -2.951 5.370 518 HB2 PRO 117 2HB PRO 117 13.350 -2.052 2.509 519 HB3 PRO 117 1HB PRO 117 14.166 -1.321 3.904 520 HG2 PRO 117 2HG PRO 117 15.441 -2.872 2.094 521 HG3 PRO 117 1HG PRO 117 15.932 -2.749 3.790 522 HD2 PRO 117 2HD PRO 117 14.794 -5.047 2.391 523 HD3 PRO 117 1HD PRO 117 15.495 -4.974 4.023 524 HA PRO 118 HA PRO 118 8.943 -3.032 4.225 525 HB2 PRO 118 2HB PRO 118 7.934 -3.560 6.663 526 HB3 PRO 118 1HB PRO 118 8.686 -4.833 5.682 527 HG2 PRO 118 2HG PRO 118 9.713 -3.449 8.079 528 HG3 PRO 118 1HG PRO 118 10.056 -5.077 7.475 529 HD2 PRO 118 2HD PRO 118 11.659 -2.723 7.132 530 HD3 PRO 118 1HD PRO 118 11.953 -4.337 6.454 531 H CYS 119 H CYS 119 7.617 -1.208 4.235 532 HA CYS 119 HA CYS 119 8.349 0.977 6.124 533 HB2 CYS 119 2HB CYS 119 6.437 1.418 3.870 534 HB3 CYS 119 1HB CYS 119 7.660 2.504 4.527 535 H LYS 120 H LYS 120 7.076 0.880 7.940 536 HA LYS 120 HA LYS 120 4.137 0.566 7.519 537 HB2 LYS 120 2HB LYS 120 4.025 -0.860 9.538 538 HB3 LYS 120 1HB LYS 120 5.023 -1.596 8.283 539 HG2 LYS 120 2HG LYS 120 7.045 -0.599 9.401 540 HG3 LYS 120 1HG LYS 120 5.991 -0.081 10.718 541 HD2 LYS 120 2HD LYS 120 5.322 -2.425 11.109 542 HD3 LYS 120 1HD LYS 120 6.381 -2.944 9.798 543 HE2 LYS 120 2HE LYS 120 7.138 -2.806 12.428 544 HE3 LYS 120 1HE LYS 120 8.256 -2.745 11.067 545 HZ1 LYS 120 1HZ LYS 120 8.466 -0.905 12.737 546 HZ2 LYS 120 2HZ LYS 120 6.962 -0.330 12.194 547 HZ3 LYS 120 3HZ LYS 120 8.281 -0.406 11.126 548 H ARG 121 H ARG 121 2.904 1.956 8.741 549 HA ARG 121 HA ARG 121 4.211 4.137 10.110 550 HB2 ARG 121 2HB ARG 121 1.306 3.276 10.019 551 HB3 ARG 121 1HB ARG 121 1.877 4.797 10.704 552 HG2 ARG 121 2HG ARG 121 2.909 5.344 8.485 553 HG3 ARG 121 1HG ARG 121 2.157 3.891 7.827 554 HD2 ARG 121 2HD ARG 121 0.709 6.254 9.060 555 HD3 ARG 121 1HD ARG 121 0.746 5.830 7.351 556 HE ARG 121 HE ARG 121 -0.750 4.015 7.798 557 HH11 ARG 121 1HH1 ARG 121 -2.339 3.107 9.118 558 HH12 ARG 121 2HH1 ARG 121 -2.399 3.528 10.797 559 HH21 ARG 121 1HH2 ARG 121 0.321 5.667 10.638 560 HH22 ARG 121 2HH2 ARG 121 -0.898 4.976 11.654 561 H GLU 122 H GLU 122 2.563 1.185 11.136 562 HA GLU 122 HA GLU 122 3.194 1.862 13.969 563 HB2 GLU 122 2HB GLU 122 0.812 1.376 13.428 564 HB3 GLU 122 1HB GLU 122 1.293 -0.230 12.881 565 HG2 GLU 122 2HG GLU 122 2.200 -0.722 15.122 566 HG3 GLU 122 1HG GLU 122 1.692 0.875 15.675 567 H ASN 123 H ASN 123 4.545 0.531 15.143 568 HA ASN 123 HA ASN 123 6.411 -1.131 13.802 569 HB2 ASN 123 2HB ASN 123 6.676 -0.066 16.089 570 HB3 ASN 123 1HB ASN 123 5.657 -1.357 16.724 571 HD21 ASN 123 1HD2 ASN 123 6.619 -3.546 15.162 572 HD22 ASN 123 2HD2 ASN 123 8.238 -3.838 15.580 573 H GLN 124 H GLN 124 3.433 -1.983 15.554 574 HA GLN 124 HA GLN 124 3.455 -4.576 14.122 575 HB2 GLN 124 2HB GLN 124 3.085 -5.869 16.137 576 HB3 GLN 124 1HB GLN 124 4.554 -4.917 16.358 577 HG2 GLN 124 2HG GLN 124 3.120 -3.159 17.491 578 HG3 GLN 124 1HG GLN 124 1.797 -4.324 17.460 579 HE21 GLN 124 1HE2 GLN 124 1.672 -4.891 19.677 580 HE22 GLN 124 2HE2 GLN 124 2.965 -5.554 20.553 581 H LYS 125 H LYS 125 1.326 -5.621 14.155 582 HA LYS 125 HA LYS 125 -0.900 -3.808 14.953 583 HB2 LYS 125 2HB LYS 125 -0.599 -5.276 12.319 584 HB3 LYS 125 1HB LYS 125 -2.067 -4.446 12.837 585 HG2 LYS 125 2HG LYS 125 -0.798 -2.335 13.024 586 HG3 LYS 125 1HG LYS 125 0.654 -3.165 12.463 587 HD2 LYS 125 2HD LYS 125 -0.553 -3.768 10.365 588 HD3 LYS 125 1HD LYS 125 -1.925 -2.806 10.915 589 HE2 LYS 125 2HE LYS 125 -0.102 -0.925 11.214 590 HE3 LYS 125 1HE LYS 125 0.798 -1.895 10.050 591 HZ1 LYS 125 1HZ LYS 125 -0.834 -1.624 8.443 592 HZ2 LYS 125 2HZ LYS 125 -0.749 -0.089 9.166 593 HZ3 LYS 125 3HZ LYS 125 -2.016 -1.149 9.564 594 H ASN 126 H ASN 126 -2.903 -4.933 15.408 595 HA ASN 126 HA ASN 126 -2.485 -7.563 16.575 596 HB2 ASN 126 2HB ASN 126 -5.021 -5.950 16.141 597 HB3 ASN 126 1HB ASN 126 -4.919 -7.429 17.098 598 HD21 ASN 126 1HD2 ASN 126 -5.694 -4.928 18.281 599 HD22 ASN 126 2HD2 ASN 126 -4.479 -4.457 19.368 600 H LEU 127 H LEU 127 -3.031 -9.540 15.690 601 HA LEU 127 HA LEU 127 -3.324 -9.809 12.876 602 HB2 LEU 127 2HB LEU 127 -4.016 -11.744 15.105 603 HB3 LEU 127 1HB LEU 127 -3.974 -12.174 13.398 604 HG LEU 127 HG LEU 127 -1.584 -11.348 13.336 605 HD11 LEU 127 1HD1 LEU 127 -2.214 -10.995 16.249 606 HD12 LEU 127 2HD1 LEU 127 -1.260 -9.970 15.179 607 HD13 LEU 127 3HD1 LEU 127 -0.585 -11.480 15.784 608 HD21 LEU 127 1HD2 LEU 127 -1.349 -13.597 13.441 609 HD22 LEU 127 2HD2 LEU 127 -2.672 -13.751 14.597 610 HD23 LEU 127 3HD2 LEU 127 -1.043 -13.381 15.164 611 H GLU 128 H GLU 128 -5.725 -9.687 15.468 612 HA GLU 128 HA GLU 128 -7.979 -10.438 13.883 613 HB2 GLU 128 2HB GLU 128 -7.808 -8.662 16.334 614 HB3 GLU 128 1HB GLU 128 -9.312 -9.286 15.656 615 HG2 GLU 128 2HG GLU 128 -8.464 -11.602 15.960 616 HG3 GLU 128 1HG GLU 128 -7.005 -10.950 16.706 617 H SER 129 H SER 129 -6.420 -7.292 14.450 618 HA SER 129 HA SER 129 -8.447 -5.713 13.177 619 HB2 SER 129 2HB SER 129 -6.778 -3.958 13.094 620 HB3 SER 129 1HB SER 129 -6.593 -4.816 14.621 621 HG SER 129 HG SER 129 -4.647 -4.389 13.237 622 H VAL 130 H VAL 130 -5.655 -7.483 11.941 623 HA VAL 130 HA VAL 130 -5.781 -6.388 9.278 624 HB VAL 130 HB VAL 130 -4.609 -8.981 10.316 625 HG11 VAL 130 1HG1 VAL 130 -4.538 -9.558 8.126 626 HG12 VAL 130 2HG1 VAL 130 -3.312 -8.299 7.964 627 HG13 VAL 130 3HG1 VAL 130 -5.001 -7.939 7.603 628 HG21 VAL 130 1HG2 VAL 130 -3.783 -6.217 10.386 629 HG22 VAL 130 2HG2 VAL 130 -2.666 -7.137 9.377 630 HG23 VAL 130 3HG2 VAL 130 -2.959 -7.628 11.046 631 H MET 131 H MET 131 -7.216 -9.274 10.796 632 HA MET 131 HA MET 131 -8.231 -10.505 8.472 633 HB2 MET 131 2HB MET 131 -8.383 -11.408 10.833 634 HB3 MET 131 1HB MET 131 -9.730 -10.297 11.096 635 HG2 MET 131 2HG MET 131 -10.697 -11.362 8.910 636 HG3 MET 131 1HG MET 131 -9.575 -12.675 9.261 637 HE1 MET 131 1HE MET 131 -13.444 -11.525 11.300 638 HE2 MET 131 2HE MET 131 -12.991 -11.455 9.598 639 HE3 MET 131 3HE MET 131 -12.263 -10.332 10.743 640 H ASN 132 H ASN 132 -9.622 -7.877 10.422 641 HA ASN 132 HA ASN 132 -12.055 -7.617 8.970 642 HB2 ASN 132 2HB ASN 132 -10.394 -5.566 10.443 643 HB3 ASN 132 1HB ASN 132 -12.015 -5.260 9.834 644 HD21 ASN 132 1HD2 ASN 132 -11.458 -5.141 12.638 645 HD22 ASN 132 2HD2 ASN 132 -12.253 -6.432 13.401 646 H TRP 133 H TRP 133 -8.844 -6.219 8.464 647 HA TRP 133 HA TRP 133 -9.502 -4.475 6.317 648 HB2 TRP 133 2HB TRP 133 -7.330 -4.067 6.861 649 HB3 TRP 133 1HB TRP 133 -7.064 -5.719 7.414 650 HD1 TRP 133 HD TRP 133 -6.262 -7.513 5.638 651 HE1 TRP 133 1HE TRP 133 -5.224 -7.279 3.292 652 HE3 TRP 133 3HE TRP 133 -7.344 -2.618 4.682 653 HZ2 TRP 133 2HZ TRP 133 -4.895 -5.279 1.274 654 HZ3 TRP 133 3HZ TRP 133 -6.663 -1.576 2.544 655 HH2 TRP 133 HH TRP 133 -5.435 -2.898 0.839 656 H GLN 134 H GLN 134 -8.358 -7.851 6.254 657 HA GLN 134 HA GLN 134 -8.606 -8.130 3.395 658 HB2 GLN 134 2HB GLN 134 -7.228 -9.624 4.876 659 HB3 GLN 134 1HB GLN 134 -8.727 -10.306 5.505 660 HG2 GLN 134 2HG GLN 134 -9.230 -10.601 2.886 661 HG3 GLN 134 1HG GLN 134 -7.468 -10.650 2.827 662 HE21 GLN 134 1HE2 GLN 134 -10.123 -12.042 4.841 663 HE22 GLN 134 2HE2 GLN 134 -9.404 -13.573 4.988 664 H GLN 135 H GLN 135 -10.730 -8.904 6.136 665 HA GLN 135 HA GLN 135 -12.796 -10.184 4.664 666 HB2 GLN 135 2HB GLN 135 -12.572 -10.108 7.177 667 HB3 GLN 135 1HB GLN 135 -13.163 -8.447 7.119 668 HG2 GLN 135 2HG GLN 135 -15.228 -9.235 5.993 669 HG3 GLN 135 1HG GLN 135 -14.642 -10.895 6.112 670 HE21 GLN 135 1HE2 GLN 135 -17.018 -10.484 7.389 671 HE22 GLN 135 2HE2 GLN 135 -16.809 -10.390 9.071 672 H TYR 136 H TYR 136 -12.253 -6.747 5.384 673 HA TYR 136 HA TYR 136 -14.728 -5.819 4.275 674 HB2 TYR 136 2HB TYR 136 -13.369 -4.381 5.707 675 HB3 TYR 136 1HB TYR 136 -12.056 -4.408 4.527 676 HD1 TYR 136 1HD TYR 136 -12.413 -3.422 2.246 677 HD2 TYR 136 2HD TYR 136 -15.253 -2.931 5.430 678 HE1 TYR 136 1HE TYR 136 -13.460 -1.541 1.019 679 HE2 TYR 136 2HE TYR 136 -16.301 -1.045 4.204 680 HH TYR 136 HH TYR 136 -15.403 -0.272 0.910 681 H TRP 137 H TRP 137 -11.443 -5.895 2.823 682 HA TRP 137 HA TRP 137 -12.413 -5.058 0.244 683 HB2 TRP 137 2HB TRP 137 -9.831 -6.430 1.035 684 HB3 TRP 137 1HB TRP 137 -10.152 -5.720 -0.545 685 HD1 TRP 137 HD TRP 137 -8.595 -4.877 2.593 686 HE1 TRP 137 1HE TRP 137 -8.413 -2.330 2.931 687 HE3 TRP 137 3HE TRP 137 -11.809 -3.281 -1.027 688 HZ2 TRP 137 2HZ TRP 137 -9.488 0.071 1.809 689 HZ3 TRP 137 3HZ TRP 137 -12.214 -0.861 -1.376 690 HH2 TRP 137 HH TRP 137 -11.058 0.816 0.038 691 H LYS 138 H LYS 138 -11.687 -8.225 1.677 692 HA LYS 138 HA LYS 138 -12.006 -9.768 -0.691 693 HB2 LYS 138 2HB LYS 138 -11.146 -10.651 1.493 694 HB3 LYS 138 1HB LYS 138 -12.790 -10.575 2.126 695 HG2 LYS 138 2HG LYS 138 -13.540 -12.093 0.307 696 HG3 LYS 138 1HG LYS 138 -11.873 -12.210 -0.259 697 HD2 LYS 138 2HD LYS 138 -11.225 -13.070 2.006 698 HD3 LYS 138 1HD LYS 138 -12.934 -13.088 2.443 699 HE2 LYS 138 2HE LYS 138 -12.642 -15.275 1.699 700 HE3 LYS 138 1HE LYS 138 -13.181 -14.482 0.218 701 HZ1 LYS 138 1HZ LYS 138 -10.497 -14.079 0.222 702 HZ2 LYS 138 2HZ LYS 138 -11.316 -15.273 -0.669 703 HZ3 LYS 138 3HZ LYS 138 -10.638 -15.651 0.843 704 H ASP 139 H ASP 139 -14.378 -8.575 1.653 705 HA ASP 139 HA ASP 139 -16.656 -9.915 0.613 706 HB2 ASP 139 2HB ASP 139 -16.555 -8.561 2.750 707 HB3 ASP 139 1HB ASP 139 -16.619 -7.107 1.753 708 H GLU 140 H GLU 140 -15.024 -6.939 -0.387 709 HA GLU 140 HA GLU 140 -16.966 -6.661 -2.617 710 HB2 GLU 140 2HB GLU 140 -14.853 -4.726 -1.631 711 HB3 GLU 140 1HB GLU 140 -16.044 -4.401 -2.892 712 HG2 GLU 140 2HG GLU 140 -16.708 -5.105 -0.016 713 HG3 GLU 140 1HG GLU 140 -16.744 -3.476 -0.693 714 H ILE 141 H ILE 141 -13.515 -5.831 -2.398 715 HA ILE 141 HA ILE 141 -13.169 -7.084 -5.056 716 HB ILE 141 HB ILE 141 -10.836 -5.924 -4.815 717 HG12 ILE 141 2HG1 ILE 141 -12.160 -3.860 -3.201 718 HG13 ILE 141 1HG1 ILE 141 -11.839 -5.335 -2.293 719 HG21 ILE 141 1HG2 ILE 141 -12.215 -5.061 -6.469 720 HG22 ILE 141 2HG2 ILE 141 -12.110 -3.680 -5.377 721 HG23 ILE 141 3HG2 ILE 141 -13.530 -4.727 -5.340 722 HD11 ILE 141 1HD1 ILE 141 -9.820 -3.722 -3.879 723 HD12 ILE 141 2HD1 ILE 141 -9.474 -5.267 -3.102 724 HD13 ILE 141 3HD1 ILE 141 -9.902 -3.866 -2.123 725 H GLY 142 H GLY 142 -10.892 -6.790 -2.322 726 HA2 GLY 142 2HA GLY 142 -10.026 -8.694 -1.076 727 HA3 GLY 142 1HA GLY 142 -10.527 -9.742 -2.406 728 H SER 143 H SER 143 -9.287 -7.188 -3.968 729 HA SER 143 HA SER 143 -6.530 -7.106 -3.664 730 HB2 SER 143 2HB SER 143 -6.022 -8.883 -5.599 731 HB3 SER 143 1HB SER 143 -6.052 -9.352 -3.904 732 HG SER 143 HG SER 143 -8.255 -9.466 -5.697 733 H GLN 144 H GLN 144 -8.035 -5.194 -4.574 734 HA GLN 144 HA GLN 144 -7.530 -5.099 -7.513 735 HB2 GLN 144 2HB GLN 144 -9.986 -5.386 -6.871 736 HB3 GLN 144 1HB GLN 144 -9.887 -3.773 -6.165 737 HG2 GLN 144 2HG GLN 144 -9.056 -2.928 -8.385 738 HG3 GLN 144 1HG GLN 144 -9.389 -4.524 -9.057 739 HE21 GLN 144 1HE2 GLN 144 -10.815 -1.485 -8.235 740 HE22 GLN 144 2HE2 GLN 144 -12.430 -1.917 -8.528 741 HA PRO 145 HA PRO 145 -5.219 -1.730 -5.268 742 HB2 PRO 145 2HB PRO 145 -3.709 -1.968 -7.823 743 HB3 PRO 145 1HB PRO 145 -3.104 -1.861 -6.161 744 HG2 PRO 145 2HG PRO 145 -3.092 -4.157 -7.519 745 HG3 PRO 145 1HG PRO 145 -3.372 -4.100 -5.776 746 HD2 PRO 145 2HD PRO 145 -5.323 -4.597 -7.974 747 HD3 PRO 145 1HD PRO 145 -5.335 -5.189 -6.299 748 H PHE 146 H PHE 146 -5.368 0.507 -5.680 749 HA PHE 146 HA PHE 146 -6.271 1.361 -8.344 750 HB2 PHE 146 2HB PHE 146 -8.025 2.820 -7.308 751 HB3 PHE 146 1HB PHE 146 -8.369 1.098 -7.184 752 HD1 PHE 146 1HD PHE 146 -7.304 -0.015 -4.921 753 HD2 PHE 146 2HD PHE 146 -8.379 4.112 -5.452 754 HE1 PHE 146 1HE PHE 146 -7.521 0.249 -2.468 755 HE2 PHE 146 2HE PHE 146 -8.604 4.367 -2.999 756 HZ PHE 146 HZ PHE 146 -8.169 2.438 -1.506 757 H THR 147 H THR 147 -5.858 3.607 -8.765 758 HA THR 147 HA THR 147 -3.901 4.807 -6.854 759 HB THR 147 HB THR 147 -2.792 5.807 -8.775 760 HG1 THR 147 1HG THR 147 -4.913 5.743 -9.979 761 HG21 THR 147 1HG2 THR 147 -2.494 3.415 -10.051 762 HG22 THR 147 2HG2 THR 147 -3.162 2.899 -8.503 763 HG23 THR 147 3HG2 THR 147 -1.678 3.849 -8.551 764 H CYS 148 H CYS 148 -3.914 7.123 -6.759 765 HA CYS 148 HA CYS 148 -6.346 8.426 -7.816 766 HB2 CYS 148 2HB CYS 148 -5.649 9.189 -5.047 767 HB3 CYS 148 1HB CYS 148 -7.227 8.871 -5.759 768 H TYR 149 H TYR 149 -6.135 10.788 -7.843 769 HA TYR 149 HA TYR 149 -3.460 11.898 -7.259 770 HB2 TYR 149 2HB TYR 149 -4.602 11.751 -10.058 771 HB3 TYR 149 1HB TYR 149 -3.364 12.910 -9.599 772 HD1 TYR 149 1HD TYR 149 -1.113 12.207 -9.044 773 HD2 TYR 149 2HD TYR 149 -4.121 9.342 -10.128 774 HE1 TYR 149 1HE TYR 149 0.644 10.481 -9.350 775 HE2 TYR 149 2HE TYR 149 -2.367 7.615 -10.437 776 HH TYR 149 HH TYR 149 0.675 8.153 -10.916 777 H PHE 150 H PHE 150 -3.627 14.083 -6.742 778 HA PHE 150 HA PHE 150 -6.119 15.460 -7.527 779 HB2 PHE 150 2HB PHE 150 -7.017 15.583 -5.448 780 HB3 PHE 150 1HB PHE 150 -5.911 14.279 -5.035 781 HD1 PHE 150 1HD PHE 150 -3.819 14.716 -3.858 782 HD2 PHE 150 2HD PHE 150 -6.536 17.885 -4.847 783 HE1 PHE 150 1HE PHE 150 -2.632 16.215 -2.292 784 HE2 PHE 150 2HE PHE 150 -5.365 19.399 -3.275 785 HZ PHE 150 HZ PHE 150 -3.399 18.563 -1.993 786 H ASN 151 H ASN 151 -5.939 17.754 -7.512 787 HA ASN 151 HA ASN 151 -3.303 18.859 -6.722 788 HB2 ASN 151 2HB ASN 151 -2.995 19.926 -8.914 789 HB3 ASN 151 1HB ASN 151 -3.058 18.171 -9.076 790 HD21 ASN 151 1HD2 ASN 151 -3.669 19.597 -11.364 791 HD22 ASN 151 2HD2 ASN 151 -5.337 19.556 -11.670 792 H GLN 152 H GLN 152 -3.616 20.731 -5.667 793 HA GLN 152 HA GLN 152 -6.229 22.089 -5.848 794 HB2 GLN 152 2HB GLN 152 -5.498 23.316 -3.898 795 HB3 GLN 152 1HB GLN 152 -5.104 21.622 -3.638 796 HG2 GLN 152 2HG GLN 152 -2.792 22.127 -4.549 797 HG3 GLN 152 1HG GLN 152 -3.225 23.836 -4.483 798 HE21 GLN 152 1HE2 GLN 152 -1.946 24.532 -2.713 799 HE22 GLN 152 2HE2 GLN 152 -2.066 23.877 -1.151 800 H HIS 153 H HIS 153 -3.215 22.262 -7.350 801 HA HIS 153 HA HIS 153 -2.589 24.971 -7.526 802 HB2 HIS 153 2HB HIS 153 -1.234 24.375 -9.259 803 HB3 HIS 153 1HB HIS 153 -1.687 22.738 -8.786 804 HD1 HIS 153 1HD HIS 153 -2.563 25.434 -11.293 805 HD2 HIS 153 2HD HIS 153 -3.292 21.380 -10.640 806 HE1 HIS 153 1HE HIS 153 -3.686 24.562 -13.390 807 HE2 HIS 153 2HE HIS 153 -4.142 22.096 -13.001 808 H GLN 154 H GLN 154 -5.305 23.276 -8.982 809 HA GLN 154 HA GLN 154 -6.052 25.393 -10.803 810 HB2 GLN 154 2HB GLN 154 -7.646 23.164 -9.500 811 HB3 GLN 154 1HB GLN 154 -8.307 24.253 -10.714 812 HG2 GLN 154 2HG GLN 154 -5.822 22.589 -11.170 813 HG3 GLN 154 1HG GLN 154 -7.441 22.055 -11.627 814 HE21 GLN 154 1HE2 GLN 154 -5.104 22.775 -13.408 815 HE22 GLN 154 2HE2 GLN 154 -5.689 23.997 -14.431 816 H ARG 155 H ARG 155 -7.733 24.339 -7.842 817 HA ARG 155 HA ARG 155 -7.650 26.938 -6.626 818 HB2 ARG 155 2HB ARG 155 -9.686 26.614 -8.590 819 HB3 ARG 155 1HB ARG 155 -10.472 26.614 -7.008 820 HG2 ARG 155 2HG ARG 155 -8.447 28.683 -7.902 821 HG3 ARG 155 1HG ARG 155 -10.195 28.909 -7.979 822 HD2 ARG 155 2HD ARG 155 -10.345 29.316 -5.759 823 HD3 ARG 155 1HD ARG 155 -9.286 27.963 -5.359 824 HE ARG 155 HE ARG 155 -7.883 30.277 -6.480 825 HH11 ARG 155 1HH1 ARG 155 -6.452 31.299 -5.058 826 HH12 ARG 155 2HH1 ARG 155 -6.525 30.935 -3.366 827 HH21 ARG 155 1HH2 ARG 155 -9.133 28.673 -3.695 828 HH22 ARG 155 2HH2 ARG 155 -8.044 29.449 -2.595 829 HA PRO 156 HA PRO 156 -10.010 23.919 -3.899 830 HB2 PRO 156 2HB PRO 156 -11.648 22.062 -4.899 831 HB3 PRO 156 1HB PRO 156 -12.059 23.783 -5.023 832 HG2 PRO 156 2HG PRO 156 -11.151 21.918 -7.118 833 HG3 PRO 156 1HG PRO 156 -12.115 23.395 -7.260 834 HD2 PRO 156 2HD PRO 156 -9.254 23.084 -7.661 835 HD3 PRO 156 1HD PRO 156 -10.245 24.537 -7.882 836 H ASP 157 H ASP 157 -10.417 21.063 -5.741 837 HA ASP 157 HA ASP 157 -7.768 19.949 -5.401 838 HB2 ASP 157 2HB ASP 157 -8.404 18.292 -3.648 839 HB3 ASP 157 1HB ASP 157 -8.442 19.949 -3.046 840 H ASP 158 H ASP 158 -8.474 19.546 -7.699 841 HA ASP 158 HA ASP 158 -10.683 17.854 -8.360 842 HB2 ASP 158 2HB ASP 158 -9.246 19.135 -10.011 843 HB3 ASP 158 1HB ASP 158 -7.996 17.913 -9.773 844 H VAL 159 H VAL 159 -10.725 15.490 -8.604 845 HA VAL 159 HA VAL 159 -8.399 14.112 -7.317 846 HB VAL 159 HB VAL 159 -9.934 12.702 -6.048 847 HG11 VAL 159 1HG1 VAL 159 -10.700 15.616 -5.714 848 HG12 VAL 159 2HG1 VAL 159 -9.184 14.926 -5.134 849 HG13 VAL 159 3HG1 VAL 159 -10.721 14.365 -4.472 850 HG21 VAL 159 1HG2 VAL 159 -12.396 14.019 -6.232 851 HG22 VAL 159 2HG2 VAL 159 -12.010 12.433 -6.900 852 HG23 VAL 159 3HG2 VAL 159 -11.852 13.874 -7.903 853 H LEU 160 H LEU 160 -7.973 12.017 -8.012 854 HA LEU 160 HA LEU 160 -9.533 11.047 -10.377 855 HB2 LEU 160 2HB LEU 160 -6.568 10.724 -9.829 856 HB3 LEU 160 1HB LEU 160 -7.416 10.075 -11.224 857 HG LEU 160 HG LEU 160 -7.031 13.004 -10.526 858 HD11 LEU 160 1HD1 LEU 160 -6.293 12.236 -13.195 859 HD12 LEU 160 2HD1 LEU 160 -5.513 11.143 -12.053 860 HD13 LEU 160 3HD1 LEU 160 -5.264 12.884 -11.916 861 HD21 LEU 160 1HD2 LEU 160 -9.168 13.022 -11.474 862 HD22 LEU 160 2HD2 LEU 160 -8.843 11.612 -12.480 863 HD23 LEU 160 3HD2 LEU 160 -8.153 13.178 -12.907 864 H LEU 161 H LEU 161 -9.864 8.744 -10.452 865 HA LEU 161 HA LEU 161 -8.924 7.214 -8.080 866 HB2 LEU 161 2HB LEU 161 -11.224 8.155 -7.634 867 HB3 LEU 161 1HB LEU 161 -11.811 7.183 -8.984 868 HG LEU 161 HG LEU 161 -10.468 5.273 -7.647 869 HD11 LEU 161 1HD1 LEU 161 -9.760 6.808 -5.856 870 HD12 LEU 161 2HD1 LEU 161 -10.847 5.572 -5.222 871 HD13 LEU 161 3HD1 LEU 161 -11.445 7.204 -5.521 872 HD21 LEU 161 1HD2 LEU 161 -12.653 4.651 -6.646 873 HD22 LEU 161 2HD2 LEU 161 -12.825 5.176 -8.322 874 HD23 LEU 161 3HD2 LEU 161 -13.262 6.266 -7.006 875 H HIS 162 H HIS 162 -7.637 6.572 -10.224 876 HA HIS 162 HA HIS 162 -9.023 4.820 -12.080 877 HB2 HIS 162 2HB HIS 162 -6.071 5.136 -11.443 878 HB3 HIS 162 1HB HIS 162 -6.706 4.162 -12.770 879 HD1 HIS 162 1HD HIS 162 -4.922 6.543 -13.465 880 HD2 HIS 162 2HD HIS 162 -9.071 6.834 -13.158 881 HE1 HIS 162 1HE HIS 162 -5.602 8.575 -14.820 882 HE2 HIS 162 2HE HIS 162 -8.126 8.760 -14.639 883 H ARG 163 H ARG 163 -8.923 2.495 -12.121 884 HA ARG 163 HA ARG 163 -8.246 1.271 -9.471 885 HB2 ARG 163 2HB ARG 163 -10.378 0.484 -11.475 886 HB3 ARG 163 1HB ARG 163 -10.003 -0.412 -10.003 887 HG2 ARG 163 2HG ARG 163 -10.503 1.636 -8.670 888 HG3 ARG 163 1HG ARG 163 -10.979 2.455 -10.159 889 HD2 ARG 163 2HD ARG 163 -12.661 0.613 -10.535 890 HD3 ARG 163 1HD ARG 163 -12.273 0.010 -8.924 891 HE ARG 163 HE ARG 163 -12.890 2.654 -8.462 892 HH11 ARG 163 1HH1 ARG 163 -14.988 3.390 -8.060 893 HH12 ARG 163 2HH1 ARG 163 -16.339 2.489 -8.663 894 HH21 ARG 163 1HH2 ARG 163 -14.381 0.038 -10.142 895 HH22 ARG 163 2HH2 ARG 163 -15.995 0.591 -9.841 896 H THR 164 H THR 164 -7.451 -0.958 -9.543 897 HA THR 164 HA THR 164 -5.908 -1.496 -12.040 898 HB THR 164 HB THR 164 -5.498 -2.756 -9.319 899 HG1 THR 164 1HG THR 164 -4.965 -0.260 -10.193 900 HG21 THR 164 1HG2 THR 164 -3.793 -3.868 -10.289 901 HG22 THR 164 2HG2 THR 164 -3.225 -2.420 -11.122 902 HG23 THR 164 3HG2 THR 164 -4.509 -3.399 -11.831 903 H HIS 165 H HIS 165 -6.162 -3.453 -13.117 904 HA HIS 165 HA HIS 165 -8.294 -5.269 -12.054 905 HB2 HIS 165 2HB HIS 165 -8.949 -4.035 -14.116 906 HB3 HIS 165 1HB HIS 165 -7.561 -4.736 -14.949 907 HD1 HIS 165 1HD HIS 165 -10.544 -6.015 -12.922 908 HD2 HIS 165 2HD HIS 165 -8.212 -7.104 -16.205 909 HE1 HIS 165 1HE HIS 165 -11.541 -8.161 -13.832 910 HE2 HIS 165 2HE HIS 165 -10.130 -8.831 -15.830 911 H ASP 166 H ASP 166 -7.713 -7.385 -11.791 912 HA ASP 166 HA ASP 166 -5.037 -8.247 -11.835 913 HB2 ASP 166 2HB ASP 166 -6.931 -9.434 -10.697 914 HB3 ASP 166 1HB ASP 166 -7.469 -10.004 -12.278 Start of MODEL 14 1 H1 GLN 45 1HT GLN 45 10.932 20.913 -4.623 2 H2 GLN 45 2HT GLN 45 9.390 21.615 -4.744 3 H3 GLN 45 3HT GLN 45 10.046 20.767 -6.062 4 HA GLN 45 HA GLN 45 10.089 19.003 -3.929 5 HB2 GLN 45 2HB GLN 45 7.395 20.361 -4.259 6 HB3 GLN 45 1HB GLN 45 7.750 18.979 -3.222 7 HG2 GLN 45 2HG GLN 45 8.961 21.747 -2.953 8 HG3 GLN 45 1HG GLN 45 7.719 21.058 -1.906 9 HE21 GLN 45 1HE2 GLN 45 10.860 21.744 -1.717 10 HE22 GLN 45 2HE2 GLN 45 11.443 20.410 -0.844 11 H ASP 46 H ASP 46 7.179 18.271 -4.841 12 HA ASP 46 HA ASP 46 8.075 16.730 -7.173 13 HB2 ASP 46 2HB ASP 46 5.887 15.637 -7.018 14 HB3 ASP 46 1HB ASP 46 6.636 15.702 -5.423 15 H LEU 47 H LEU 47 5.657 16.624 -8.636 16 HA LEU 47 HA LEU 47 5.936 18.954 -10.300 17 HB2 LEU 47 2HB LEU 47 3.622 16.992 -10.211 18 HB3 LEU 47 1HB LEU 47 4.068 18.037 -11.561 19 HG LEU 47 HG LEU 47 5.764 15.803 -10.407 20 HD11 LEU 47 1HD1 LEU 47 4.174 14.711 -11.709 21 HD12 LEU 47 2HD1 LEU 47 5.414 15.058 -12.915 22 HD13 LEU 47 3HD1 LEU 47 3.981 16.081 -12.805 23 HD21 LEU 47 1HD2 LEU 47 6.271 17.984 -12.401 24 HD22 LEU 47 2HD2 LEU 47 7.014 16.407 -12.667 25 HD23 LEU 47 3HD2 LEU 47 7.357 17.306 -11.188 26 H GLN 48 H GLN 48 4.262 20.607 -10.674 27 HA GLN 48 HA GLN 48 3.386 21.922 -8.375 28 HB2 GLN 48 2HB GLN 48 3.392 22.921 -10.656 29 HB3 GLN 48 1HB GLN 48 1.972 21.952 -11.057 30 HG2 GLN 48 2HG GLN 48 1.249 24.180 -10.379 31 HG3 GLN 48 1HG GLN 48 0.759 23.014 -9.148 32 HE21 GLN 48 1HE2 GLN 48 1.513 23.362 -7.037 33 HE22 GLN 48 2HE2 GLN 48 2.681 24.521 -6.616 34 H ALA 49 H ALA 49 1.588 19.543 -10.318 35 HA ALA 49 HA ALA 49 -0.791 19.686 -8.672 36 HB1 ALA 49 1HB ALA 49 -0.971 18.807 -10.927 37 HB2 ALA 49 2HB ALA 49 -1.357 17.505 -9.802 38 HB3 ALA 49 3HB ALA 49 0.225 17.558 -10.579 39 H THR 50 H THR 50 -1.415 18.213 -6.974 40 HA THR 50 HA THR 50 0.912 16.989 -5.630 41 HB THR 50 HB THR 50 -1.943 17.166 -4.643 42 HG1 THR 50 1HG THR 50 -1.222 19.228 -4.843 43 HG21 THR 50 1HG2 THR 50 -0.881 15.542 -3.349 44 HG22 THR 50 2HG2 THR 50 -0.568 17.014 -2.424 45 HG23 THR 50 3HG2 THR 50 0.688 16.340 -3.461 46 H GLU 51 H GLU 51 0.984 14.782 -5.094 47 HA GLU 51 HA GLU 51 -0.872 13.077 -6.686 48 HB2 GLU 51 2HB GLU 51 1.997 12.532 -5.909 49 HB3 GLU 51 1HB GLU 51 0.984 11.513 -6.933 50 HG2 GLU 51 2HG GLU 51 0.753 13.425 -8.531 51 HG3 GLU 51 1HG GLU 51 1.877 14.347 -7.535 52 H ALA 52 H ALA 52 -1.817 11.327 -5.669 53 HA ALA 52 HA ALA 52 -0.885 10.541 -2.979 54 HB1 ALA 52 1HB ALA 52 -2.454 12.107 -2.200 55 HB2 ALA 52 2HB ALA 52 -3.435 10.644 -2.312 56 HB3 ALA 52 3HB ALA 52 -3.522 11.862 -3.583 57 H ASN 53 H ASN 53 -0.618 8.371 -3.447 58 HA ASN 53 HA ASN 53 -2.693 7.098 -5.136 59 HB2 ASN 53 2HB ASN 53 0.106 6.228 -4.439 60 HB3 ASN 53 1HB ASN 53 -1.030 5.223 -5.337 61 HD21 ASN 53 1HD2 ASN 53 -2.278 7.446 -6.818 62 HD22 ASN 53 2HD2 ASN 53 -1.125 8.003 -7.930 63 H CYS 54 H CYS 54 -3.953 5.434 -4.423 64 HA CYS 54 HA CYS 54 -3.518 4.495 -1.619 65 HB2 CYS 54 2HB CYS 54 -6.145 4.468 -1.645 66 HB3 CYS 54 1HB CYS 54 -5.313 5.988 -1.335 67 H THR 55 H THR 55 -2.806 2.386 -2.242 68 HA THR 55 HA THR 55 -4.832 0.887 -3.830 69 HB THR 55 HB THR 55 -3.363 0.530 -5.481 70 HG1 THR 55 1HG THR 55 -1.734 -0.862 -5.088 71 HG21 THR 55 1HG2 THR 55 -2.402 2.747 -4.723 72 HG22 THR 55 2HG2 THR 55 -1.259 1.698 -5.553 73 HG23 THR 55 3HG2 THR 55 -1.212 1.834 -3.798 74 H VAL 56 H VAL 56 -5.189 -1.232 -3.350 75 HA VAL 56 HA VAL 56 -4.070 -2.167 -0.773 76 HB VAL 56 HB VAL 56 -5.807 -4.058 -1.231 77 HG11 VAL 56 1HG1 VAL 56 -6.605 -2.854 0.506 78 HG12 VAL 56 2HG1 VAL 56 -7.638 -2.074 -0.693 79 HG13 VAL 56 3HG1 VAL 56 -6.115 -1.323 -0.217 80 HG21 VAL 56 1HG2 VAL 56 -7.651 -3.423 -2.671 81 HG22 VAL 56 2HG2 VAL 56 -6.161 -3.369 -3.611 82 HG23 VAL 56 3HG2 VAL 56 -6.892 -1.875 -3.028 83 H LEU 57 H LEU 57 -2.223 -3.269 -1.036 84 HA LEU 57 HA LEU 57 -1.133 -4.224 -3.398 85 HB2 LEU 57 2HB LEU 57 -0.103 -4.147 -1.042 86 HB3 LEU 57 1HB LEU 57 -0.830 -5.733 -0.814 87 HG LEU 57 HG LEU 57 0.326 -6.497 -2.912 88 HD11 LEU 57 1HD1 LEU 57 2.442 -4.694 -3.075 89 HD12 LEU 57 2HD1 LEU 57 1.024 -3.658 -2.937 90 HD13 LEU 57 3HD1 LEU 57 1.124 -4.846 -4.234 91 HD21 LEU 57 1HD2 LEU 57 1.618 -5.711 -0.365 92 HD22 LEU 57 2HD2 LEU 57 2.723 -6.077 -1.690 93 HD23 LEU 57 3HD2 LEU 57 1.557 -7.286 -1.155 94 H SER 58 H SER 58 -0.980 -6.389 -4.303 95 HA SER 58 HA SER 58 -3.544 -7.850 -4.065 96 HB2 SER 58 2HB SER 58 -2.942 -8.899 -6.156 97 HB3 SER 58 1HB SER 58 -2.601 -7.180 -6.323 98 HG SER 58 HG SER 58 -0.645 -7.788 -6.762 99 H VAL 59 H VAL 59 -3.413 -10.261 -3.845 100 HA VAL 59 HA VAL 59 -1.138 -10.961 -2.068 101 HB VAL 59 HB VAL 59 -3.627 -12.607 -2.571 102 HG11 VAL 59 1HG1 VAL 59 -1.337 -13.241 -1.250 103 HG12 VAL 59 2HG1 VAL 59 -2.918 -13.886 -0.815 104 HG13 VAL 59 3HG1 VAL 59 -2.260 -12.503 0.058 105 HG21 VAL 59 1HG2 VAL 59 -4.188 -10.250 -1.838 106 HG22 VAL 59 2HG2 VAL 59 -3.230 -10.535 -0.386 107 HG23 VAL 59 3HG2 VAL 59 -4.677 -11.494 -0.689 108 H GLN 60 H GLN 60 0.507 -12.109 -2.928 109 HA GLN 60 HA GLN 60 -0.080 -14.135 -5.011 110 HB2 GLN 60 2HB GLN 60 2.027 -11.969 -5.274 111 HB3 GLN 60 1HB GLN 60 1.833 -13.335 -6.375 112 HG2 GLN 60 2HG GLN 60 -0.456 -12.589 -6.908 113 HG3 GLN 60 1HG GLN 60 -0.267 -11.223 -5.808 114 HE21 GLN 60 1HE2 GLN 60 -0.816 -10.442 -8.340 115 HE22 GLN 60 2HE2 GLN 60 0.574 -9.893 -9.149 116 H GLN 61 H GLN 61 1.642 -15.748 -5.189 117 HA GLN 61 HA GLN 61 2.997 -16.153 -2.607 118 HB2 GLN 61 2HB GLN 61 3.028 -17.898 -5.081 119 HB3 GLN 61 1HB GLN 61 3.513 -18.375 -3.457 120 HG2 GLN 61 2HG GLN 61 0.731 -17.564 -4.345 121 HG3 GLN 61 1HG GLN 61 1.257 -19.186 -3.890 122 HE21 GLN 61 1HE2 GLN 61 -0.285 -16.474 -2.676 123 HE22 GLN 61 2HE2 GLN 61 0.016 -16.716 -1.027 124 H ILE 62 H ILE 62 4.499 -14.299 -2.912 125 HA ILE 62 HA ILE 62 6.574 -13.385 -3.529 126 HB ILE 62 HB ILE 62 7.209 -16.332 -3.888 127 HG12 ILE 62 2HG1 ILE 62 7.585 -14.534 -1.473 128 HG13 ILE 62 1HG1 ILE 62 6.247 -15.668 -1.658 129 HG21 ILE 62 1HG2 ILE 62 9.531 -15.410 -3.174 130 HG22 ILE 62 2HG2 ILE 62 8.896 -13.841 -3.666 131 HG23 ILE 62 3HG2 ILE 62 9.018 -15.152 -4.840 132 HD11 ILE 62 1HD1 ILE 62 8.763 -16.244 -0.585 133 HD12 ILE 62 2HD1 ILE 62 8.804 -16.945 -2.202 134 HD13 ILE 62 3HD1 ILE 62 7.540 -17.418 -1.069 135 H GLY 63 H GLY 63 8.267 -13.374 -5.380 136 HA2 GLY 63 2HA GLY 63 8.783 -13.715 -7.711 137 HA3 GLY 63 1HA GLY 63 7.143 -14.317 -7.958 138 H GLU 64 H GLU 64 6.962 -11.603 -6.043 139 HA GLU 64 HA GLU 64 6.651 -9.801 -8.403 140 HB2 GLU 64 2HB GLU 64 4.450 -10.612 -7.495 141 HB3 GLU 64 1HB GLU 64 4.857 -9.835 -5.963 142 HG2 GLU 64 2HG GLU 64 5.089 -7.662 -7.153 143 HG3 GLU 64 1HG GLU 64 4.598 -8.454 -8.650 144 H VAL 65 H VAL 65 7.359 -7.676 -8.091 145 HA VAL 65 HA VAL 65 8.646 -7.111 -5.452 146 HB VAL 65 HB VAL 65 10.293 -5.765 -6.662 147 HG11 VAL 65 1HG1 VAL 65 9.936 -8.601 -6.959 148 HG12 VAL 65 2HG1 VAL 65 11.443 -7.688 -6.867 149 HG13 VAL 65 3HG1 VAL 65 10.672 -7.960 -8.429 150 HG21 VAL 65 1HG2 VAL 65 9.945 -6.421 -9.345 151 HG22 VAL 65 2HG2 VAL 65 9.583 -4.858 -8.611 152 HG23 VAL 65 3HG2 VAL 65 8.309 -6.063 -8.793 153 H PHE 66 H PHE 66 8.426 -4.936 -4.661 154 HA PHE 66 HA PHE 66 6.351 -3.319 -6.078 155 HB2 PHE 66 2HB PHE 66 6.651 -3.704 -3.092 156 HB3 PHE 66 1HB PHE 66 5.439 -2.699 -3.887 157 HD1 PHE 66 1HD PHE 66 6.275 -5.997 -2.755 158 HD2 PHE 66 2HD PHE 66 3.863 -3.837 -5.577 159 HE1 PHE 66 1HE PHE 66 4.823 -7.984 -3.033 160 HE2 PHE 66 2HE PHE 66 2.409 -5.826 -5.855 161 HZ PHE 66 HZ PHE 66 2.888 -7.902 -4.584 162 H GLU 67 H GLU 67 6.424 -1.005 -5.572 163 HA GLU 67 HA GLU 67 9.205 -0.104 -4.953 164 HB2 GLU 67 2HB GLU 67 8.388 0.400 -7.251 165 HB3 GLU 67 1HB GLU 67 7.052 1.315 -6.549 166 HG2 GLU 67 2HG GLU 67 8.701 2.787 -5.405 167 HG3 GLU 67 1HG GLU 67 10.005 1.912 -6.207 168 H CYS 68 H CYS 68 9.499 1.483 -3.397 169 HA CYS 68 HA CYS 68 7.063 2.258 -1.845 170 HB2 CYS 68 2HB CYS 68 9.713 1.321 -1.069 171 HB3 CYS 68 1HB CYS 68 9.325 2.863 -0.307 172 H THR 69 H THR 69 7.058 4.502 -1.014 173 HA THR 69 HA THR 69 8.740 6.328 -2.679 174 HB THR 69 HB THR 69 6.906 7.528 -3.325 175 HG1 THR 69 1HG THR 69 5.992 6.914 -0.733 176 HG21 THR 69 1HG2 THR 69 6.441 5.060 -3.781 177 HG22 THR 69 2HG2 THR 69 5.031 6.118 -3.778 178 HG23 THR 69 3HG2 THR 69 5.372 5.099 -2.379 179 H PHE 70 H PHE 70 9.453 8.232 -1.663 180 HA PHE 70 HA PHE 70 8.638 8.777 1.109 181 HB2 PHE 70 2HB PHE 70 10.908 8.701 2.009 182 HB3 PHE 70 1HB PHE 70 10.468 7.117 1.369 183 HD1 PHE 70 1HD PHE 70 12.598 10.068 0.953 184 HD2 PHE 70 2HD PHE 70 11.416 6.314 -0.768 185 HE1 PHE 70 1HE PHE 70 14.570 10.135 -0.550 186 HE2 PHE 70 2HE PHE 70 13.389 6.383 -2.270 187 HZ PHE 70 HZ PHE 70 14.966 8.292 -2.161 188 H THR 71 H THR 71 9.607 10.849 1.864 189 HA THR 71 HA THR 71 10.524 12.568 -0.388 190 HB THR 71 HB THR 71 8.512 13.398 1.718 191 HG1 THR 71 1HG THR 71 8.234 12.017 -0.587 192 HG21 THR 71 1HG2 THR 71 10.191 14.902 0.093 193 HG22 THR 71 2HG2 THR 71 8.725 15.479 0.883 194 HG23 THR 71 3HG2 THR 71 8.659 14.894 -0.780 195 H CYS 72 H CYS 72 12.003 14.190 0.215 196 HA CYS 72 HA CYS 72 12.841 14.179 3.083 197 HB2 CYS 72 2HB CYS 72 14.710 13.131 2.302 198 HB3 CYS 72 1HB CYS 72 14.428 13.644 0.642 199 H GLY 73 H GLY 73 14.070 16.221 3.633 200 HA2 GLY 73 2HA GLY 73 12.604 18.505 2.521 201 HA3 GLY 73 1HA GLY 73 13.704 18.553 3.899 202 H ALA 74 H ALA 74 13.397 20.027 1.188 203 HA ALA 74 HA ALA 74 15.120 21.435 0.244 204 HB1 ALA 74 1HB ALA 74 16.859 20.239 1.711 205 HB2 ALA 74 2HB ALA 74 17.392 20.811 0.134 206 HB3 ALA 74 3HB ALA 74 17.028 19.104 0.367 207 H ASP 75 H ASP 75 13.108 19.857 -0.942 208 HA ASP 75 HA ASP 75 12.474 19.006 -3.020 209 HB2 ASP 75 2HB ASP 75 15.060 20.373 -3.827 210 HB3 ASP 75 1HB ASP 75 13.861 19.751 -4.959 211 H CYS 76 H CYS 76 13.872 17.234 -1.278 212 HA CYS 76 HA CYS 76 15.439 15.592 -3.237 213 HB2 CYS 76 2HB CYS 76 15.950 14.413 -0.860 214 HB3 CYS 76 1HB CYS 76 16.917 15.758 -1.469 215 H ARG 77 H ARG 77 13.999 14.167 -4.124 216 HA ARG 77 HA ARG 77 12.239 12.663 -2.241 217 HB2 ARG 77 2HB ARG 77 11.435 13.817 -4.937 218 HB3 ARG 77 1HB ARG 77 10.413 12.805 -3.911 219 HG2 ARG 77 2HG ARG 77 10.454 14.458 -2.134 220 HG3 ARG 77 1HG ARG 77 11.623 15.436 -3.014 221 HD2 ARG 77 2HD ARG 77 9.498 16.463 -3.350 222 HD3 ARG 77 1HD ARG 77 9.904 15.644 -4.861 223 HE ARG 77 HE ARG 77 7.768 14.856 -2.986 224 HH11 ARG 77 1HH1 ARG 77 6.390 13.251 -3.778 225 HH12 ARG 77 2HH1 ARG 77 6.824 12.384 -5.213 226 HH21 ARG 77 1HH2 ARG 77 9.806 14.094 -5.665 227 HH22 ARG 77 2HH2 ARG 77 8.756 12.862 -6.282 228 H GLY 78 H GLY 78 11.954 10.442 -2.832 229 HA2 GLY 78 2HA GLY 78 12.927 9.479 -5.410 230 HA3 GLY 78 1HA GLY 78 14.019 9.088 -4.082 231 H THR 79 H THR 79 13.142 6.914 -5.200 232 HA THR 79 HA THR 79 10.923 5.940 -3.458 233 HB THR 79 HB THR 79 10.103 4.569 -5.259 234 HG1 THR 79 1HG THR 79 12.539 5.316 -6.407 235 HG21 THR 79 1HG2 THR 79 10.519 6.889 -6.972 236 HG22 THR 79 2HG2 THR 79 10.090 7.353 -5.326 237 HG23 THR 79 3HG2 THR 79 9.028 6.287 -6.246 238 H SER 80 H SER 80 11.072 3.590 -2.997 239 HA SER 80 HA SER 80 13.888 2.583 -3.169 240 HB2 SER 80 2HB SER 80 11.914 2.180 -0.906 241 HB3 SER 80 1HB SER 80 13.550 1.531 -0.973 242 HG SER 80 HG SER 80 13.836 4.053 -1.453 243 H GLN 81 H GLN 81 14.117 0.318 -3.508 244 HA GLN 81 HA GLN 81 11.621 -1.050 -4.414 245 HB2 GLN 81 2HB GLN 81 14.480 -1.307 -5.377 246 HB3 GLN 81 1HB GLN 81 13.193 -2.414 -5.852 247 HG2 GLN 81 2HG GLN 81 12.694 0.518 -6.147 248 HG3 GLN 81 1HG GLN 81 13.765 -0.261 -7.312 249 HE21 GLN 81 1HE2 GLN 81 10.542 -0.837 -5.780 250 HE22 GLN 81 2HE2 GLN 81 9.830 -1.478 -7.181 251 H TYR 82 H TYR 82 11.184 -3.078 -3.575 252 HA TYR 82 HA TYR 82 13.274 -4.447 -1.995 253 HB2 TYR 82 2HB TYR 82 11.521 -4.776 -0.140 254 HB3 TYR 82 1HB TYR 82 12.250 -3.174 -0.260 255 HD1 TYR 82 1HD TYR 82 11.028 -1.448 -1.768 256 HD2 TYR 82 2HD TYR 82 9.188 -5.006 -0.226 257 HE1 TYR 82 1HE TYR 82 8.790 -0.458 -2.140 258 HE2 TYR 82 2HE TYR 82 6.948 -4.006 -0.601 259 HH TYR 82 HH TYR 82 6.434 -1.321 -2.518 260 HA PRO 83 HA PRO 83 11.543 -8.162 -3.728 261 HB2 PRO 83 2HB PRO 83 11.278 -9.287 -0.985 262 HB3 PRO 83 1HB PRO 83 12.127 -9.943 -2.397 263 HG2 PRO 83 2HG PRO 83 13.422 -8.848 -0.325 264 HG3 PRO 83 1HG PRO 83 14.018 -8.742 -1.989 265 HD2 PRO 83 2HD PRO 83 12.789 -6.631 -0.299 266 HD3 PRO 83 1HD PRO 83 13.947 -6.486 -1.638 267 H CYS 84 H CYS 84 9.732 -9.932 -2.228 268 HA CYS 84 HA CYS 84 7.238 -8.504 -2.769 269 HB2 CYS 84 2HB CYS 84 6.494 -10.602 -3.098 270 HB3 CYS 84 1HB CYS 84 8.071 -11.222 -2.607 271 H VAL 85 H VAL 85 5.630 -8.014 -1.216 272 HA VAL 85 HA VAL 85 6.494 -8.137 1.642 273 HB VAL 85 HB VAL 85 6.762 -5.834 0.720 274 HG11 VAL 85 1HG1 VAL 85 4.884 -6.073 -0.944 275 HG12 VAL 85 2HG1 VAL 85 4.818 -4.584 -0.003 276 HG13 VAL 85 3HG1 VAL 85 3.751 -5.928 0.399 277 HG21 VAL 85 1HG2 VAL 85 4.399 -5.901 2.600 278 HG22 VAL 85 2HG2 VAL 85 5.737 -4.753 2.567 279 HG23 VAL 85 3HG2 VAL 85 6.007 -6.405 3.124 280 H GLN 86 H GLN 86 4.675 -8.230 3.162 281 HA GLN 86 HA GLN 86 2.628 -10.007 2.411 282 HB2 GLN 86 2HB GLN 86 2.722 -7.987 4.664 283 HB3 GLN 86 1HB GLN 86 1.455 -9.203 4.493 284 HG2 GLN 86 2HG GLN 86 3.042 -10.212 5.937 285 HG3 GLN 86 1HG GLN 86 3.360 -10.928 4.359 286 HE21 GLN 86 1HE2 GLN 86 5.612 -11.185 4.304 287 HE22 GLN 86 2HE2 GLN 86 6.727 -9.949 4.639 288 H VAL 87 H VAL 87 0.162 -8.898 3.208 289 HA VAL 87 HA VAL 87 -0.290 -6.910 1.016 290 HB VAL 87 HB VAL 87 -2.059 -9.173 1.950 291 HG11 VAL 87 1HG1 VAL 87 -3.359 -8.264 -0.175 292 HG12 VAL 87 2HG1 VAL 87 -2.569 -6.748 0.260 293 HG13 VAL 87 3HG1 VAL 87 -3.636 -7.548 1.414 294 HG21 VAL 87 1HG2 VAL 87 -0.008 -8.935 -0.026 295 HG22 VAL 87 2HG2 VAL 87 -1.552 -9.065 -0.868 296 HG23 VAL 87 3HG2 VAL 87 -1.064 -10.314 0.280 297 H TYR 88 H TYR 88 -1.678 -5.206 1.360 298 HA TYR 88 HA TYR 88 -3.513 -4.943 3.505 299 HB2 TYR 88 2HB TYR 88 -1.346 -4.894 4.796 300 HB3 TYR 88 1HB TYR 88 -0.985 -3.381 3.993 301 HD1 TYR 88 1HD TYR 88 -3.979 -4.946 5.674 302 HD2 TYR 88 2HD TYR 88 -1.442 -1.507 5.253 303 HE1 TYR 88 1HE TYR 88 -5.343 -3.736 7.340 304 HE2 TYR 88 2HE TYR 88 -2.803 -0.298 6.928 305 HH TYR 88 HH TYR 88 -5.714 -0.939 7.738 306 H VAL 89 H VAL 89 -2.298 -1.966 3.681 307 HA VAL 89 HA VAL 89 -3.425 -1.134 1.048 308 HB VAL 89 HB VAL 89 -5.051 -0.809 2.951 309 HG11 VAL 89 1HG1 VAL 89 -4.532 0.478 4.765 310 HG12 VAL 89 2HG1 VAL 89 -3.536 1.586 3.820 311 HG13 VAL 89 3HG1 VAL 89 -2.877 0.040 4.350 312 HG21 VAL 89 1HG2 VAL 89 -5.676 0.603 1.266 313 HG22 VAL 89 2HG2 VAL 89 -4.041 1.233 1.056 314 HG23 VAL 89 3HG2 VAL 89 -5.065 1.851 2.352 315 H ASN 90 H ASN 90 -2.303 0.401 -0.020 316 HA ASN 90 HA ASN 90 0.189 1.339 1.235 317 HB2 ASN 90 2HB ASN 90 -0.864 1.518 -1.592 318 HB3 ASN 90 1HB ASN 90 0.694 2.152 -1.078 319 HD21 ASN 90 1HD2 ASN 90 0.107 -0.568 0.784 320 HD22 ASN 90 2HD2 ASN 90 0.925 -1.719 -0.158 321 H ASN 91 H ASN 91 -0.092 3.183 2.446 322 HA ASN 91 HA ASN 91 -2.076 5.175 1.511 323 HB2 ASN 91 2HB ASN 91 -0.451 5.083 4.072 324 HB3 ASN 91 1HB ASN 91 -1.728 6.241 3.707 325 HD21 ASN 91 1HD2 ASN 91 -3.665 4.549 2.532 326 HD22 ASN 91 2HD2 ASN 91 -4.197 3.425 3.686 327 H SER 92 H SER 92 -0.861 5.916 -0.291 328 HA SER 92 HA SER 92 1.694 7.294 0.324 329 HB2 SER 92 2HB SER 92 0.429 6.279 -2.207 330 HB3 SER 92 1HB SER 92 1.705 7.491 -2.273 331 HG SER 92 HG SER 92 2.123 5.293 -0.621 332 H GLU 93 H GLU 93 -1.115 8.240 0.946 333 HA GLU 93 HA GLU 93 -1.685 10.426 -0.857 334 HB2 GLU 93 2HB GLU 93 -3.323 11.107 0.758 335 HB3 GLU 93 1HB GLU 93 -3.323 9.344 0.774 336 HG2 GLU 93 2HG GLU 93 -1.720 9.434 2.716 337 HG3 GLU 93 1HG GLU 93 -1.954 11.183 2.758 338 H SER 94 H SER 94 0.685 9.865 1.439 339 HA SER 94 HA SER 94 2.282 12.041 1.133 340 HB2 SER 94 2HB SER 94 0.851 13.773 1.675 341 HB3 SER 94 1HB SER 94 -0.122 12.770 2.748 342 HG SER 94 HG SER 94 1.183 13.221 4.356 343 H ASN 95 H ASN 95 0.900 9.661 3.162 344 HA ASN 95 HA ASN 95 2.959 9.929 5.250 345 HB2 ASN 95 2HB ASN 95 0.724 7.914 4.902 346 HB3 ASN 95 1HB ASN 95 1.770 8.042 6.315 347 HD21 ASN 95 1HD2 ASN 95 1.900 10.853 6.622 348 HD22 ASN 95 2HD2 ASN 95 0.351 11.446 6.981 349 H SER 96 H SER 96 2.030 6.716 4.567 350 HA SER 96 HA SER 96 4.310 6.122 2.810 351 HB2 SER 96 2HB SER 96 4.970 6.273 5.413 352 HB3 SER 96 1HB SER 96 4.357 4.620 5.382 353 HG SER 96 HG SER 96 5.841 4.921 3.234 354 H ARG 97 H ARG 97 4.486 3.566 2.701 355 HA ARG 97 HA ARG 97 1.754 2.617 2.198 356 HB2 ARG 97 2HB ARG 97 3.178 1.948 0.467 357 HB3 ARG 97 1HB ARG 97 4.510 1.599 1.570 358 HG2 ARG 97 2HG ARG 97 3.499 -0.415 2.328 359 HG3 ARG 97 1HG ARG 97 1.940 0.007 1.625 360 HD2 ARG 97 2HD ARG 97 2.928 -1.612 0.164 361 HD3 ARG 97 1HD ARG 97 3.082 -0.050 -0.644 362 HE ARG 97 HE ARG 97 5.419 -0.289 -0.469 363 HH11 ARG 97 1HH1 ARG 97 7.314 -1.220 0.348 364 HH12 ARG 97 2HH1 ARG 97 7.207 -2.390 1.620 365 HH21 ARG 97 1HH2 ARG 97 3.751 -2.245 1.829 366 HH22 ARG 97 2HH2 ARG 97 5.191 -2.970 2.458 367 H ALA 98 H ALA 98 0.642 1.324 3.581 368 HA ALA 98 HA ALA 98 2.046 0.328 5.993 369 HB1 ALA 98 1HB ALA 98 -0.872 0.699 5.295 370 HB2 ALA 98 2HB ALA 98 0.061 1.534 6.537 371 HB3 ALA 98 3HB ALA 98 -0.352 -0.168 6.742 372 H LEU 99 H LEU 99 2.409 -1.815 6.322 373 HA LEU 99 HA LEU 99 1.235 -3.740 4.351 374 HB2 LEU 99 2HB LEU 99 3.297 -5.105 4.743 375 HB3 LEU 99 1HB LEU 99 3.633 -3.535 4.025 376 HG LEU 99 HG LEU 99 3.903 -2.744 6.516 377 HD11 LEU 99 1HD1 LEU 99 3.849 -4.327 8.107 378 HD12 LEU 99 2HD1 LEU 99 5.151 -5.193 7.297 379 HD13 LEU 99 3HD1 LEU 99 3.476 -5.550 6.894 380 HD21 LEU 99 1HD2 LEU 99 6.336 -3.682 6.390 381 HD22 LEU 99 2HD2 LEU 99 5.781 -2.574 5.133 382 HD23 LEU 99 3HD2 LEU 99 5.827 -4.310 4.822 383 H LEU 100 H LEU 100 0.172 -5.486 5.170 384 HA LEU 100 HA LEU 100 0.320 -5.959 8.119 385 HB2 LEU 100 2HB LEU 100 -1.800 -4.778 7.341 386 HB3 LEU 100 1HB LEU 100 -2.181 -6.241 6.437 387 HG LEU 100 HG LEU 100 -2.004 -7.549 8.558 388 HD11 LEU 100 1HD1 LEU 100 -0.727 -6.416 10.102 389 HD12 LEU 100 2HD1 LEU 100 -2.310 -5.825 10.603 390 HD13 LEU 100 3HD1 LEU 100 -1.288 -4.834 9.561 391 HD21 LEU 100 1HD2 LEU 100 -3.965 -5.252 8.370 392 HD22 LEU 100 2HD2 LEU 100 -4.107 -6.517 9.590 393 HD23 LEU 100 3HD2 LEU 100 -4.208 -6.926 7.876 394 H HIS 101 H HIS 101 0.290 -8.159 8.723 395 HA HIS 101 HA HIS 101 0.834 -10.044 6.512 396 HB2 HIS 101 2HB HIS 101 0.822 -10.720 9.452 397 HB3 HIS 101 1HB HIS 101 1.740 -11.485 8.155 398 HD1 HIS 101 1HD HIS 101 2.721 -8.744 6.863 399 HD2 HIS 101 2HD HIS 101 3.095 -9.807 10.879 400 HE1 HIS 101 1HE HIS 101 4.626 -7.360 7.795 401 HE2 HIS 101 2HE HIS 101 4.864 -7.998 10.240 402 H SER 102 H SER 102 -0.820 -11.201 5.664 403 HA SER 102 HA SER 102 -3.467 -11.216 6.708 404 HB2 SER 102 2HB SER 102 -2.174 -13.265 4.883 405 HB3 SER 102 1HB SER 102 -3.903 -13.003 5.084 406 HG SER 102 HG SER 102 -2.920 -10.657 4.564 407 H ASP 103 H ASP 103 -0.795 -13.521 7.066 408 HA ASP 103 HA ASP 103 -1.755 -14.434 9.616 409 HB2 ASP 103 2HB ASP 103 -3.370 -15.552 7.960 410 HB3 ASP 103 1HB ASP 103 -1.984 -16.504 7.428 411 H GLU 104 H GLU 104 -0.299 -16.088 10.512 412 HA GLU 104 HA GLU 104 2.426 -15.682 9.743 413 HB2 GLU 104 2HB GLU 104 1.674 -16.389 12.027 414 HB3 GLU 104 1HB GLU 104 1.291 -17.981 11.368 415 HG2 GLU 104 2HG GLU 104 3.660 -18.204 10.620 416 HG3 GLU 104 1HG GLU 104 4.021 -16.661 11.397 417 H HIS 105 H HIS 105 0.031 -18.081 8.804 418 HA HIS 105 HA HIS 105 1.722 -20.069 7.735 419 HB2 HIS 105 2HB HIS 105 -0.699 -20.371 7.897 420 HB3 HIS 105 1HB HIS 105 -0.960 -19.081 6.723 421 HD1 HIS 105 1HD HIS 105 0.675 -22.517 6.951 422 HD2 HIS 105 2HD HIS 105 -0.864 -19.905 4.092 423 HE1 HIS 105 1HE HIS 105 0.708 -23.770 4.746 424 HE2 HIS 105 2HE HIS 105 -0.229 -22.189 2.997 425 H GLN 106 H GLN 106 0.599 -17.016 6.312 426 HA GLN 106 HA GLN 106 1.691 -17.416 3.707 427 HB2 GLN 106 2HB GLN 106 0.129 -15.548 4.382 428 HB3 GLN 106 1HB GLN 106 1.494 -14.778 5.191 429 HG2 GLN 106 2HG GLN 106 2.730 -14.699 3.066 430 HG3 GLN 106 1HG GLN 106 1.387 -15.501 2.248 431 HE21 GLN 106 1HE2 GLN 106 2.037 -13.037 1.227 432 HE22 GLN 106 2HE2 GLN 106 0.903 -11.865 1.694 433 H LEU 107 H LEU 107 3.085 -16.118 6.690 434 HA LEU 107 HA LEU 107 5.612 -15.340 5.614 435 HB2 LEU 107 2HB LEU 107 4.837 -14.686 7.874 436 HB3 LEU 107 1HB LEU 107 4.961 -16.366 8.395 437 HG LEU 107 HG LEU 107 7.390 -16.327 7.833 438 HD11 LEU 107 1HD1 LEU 107 7.811 -14.698 6.261 439 HD12 LEU 107 2HD1 LEU 107 8.184 -13.767 7.712 440 HD13 LEU 107 3HD1 LEU 107 6.612 -13.591 6.932 441 HD21 LEU 107 1HD2 LEU 107 7.421 -14.056 9.599 442 HD22 LEU 107 2HD2 LEU 107 7.671 -15.757 9.994 443 HD23 LEU 107 3HD2 LEU 107 6.043 -15.080 10.000 444 H LEU 108 H LEU 108 4.486 -18.416 7.027 445 HA LEU 108 HA LEU 108 6.970 -19.811 6.786 446 HB2 LEU 108 2HB LEU 108 4.933 -20.614 8.059 447 HB3 LEU 108 1HB LEU 108 4.186 -20.984 6.506 448 HG LEU 108 HG LEU 108 6.184 -22.431 5.977 449 HD11 LEU 108 1HD1 LEU 108 7.038 -21.289 8.521 450 HD12 LEU 108 2HD1 LEU 108 7.982 -22.162 7.314 451 HD13 LEU 108 3HD1 LEU 108 7.088 -23.053 8.546 452 HD21 LEU 108 1HD2 LEU 108 5.356 -23.854 8.297 453 HD22 LEU 108 2HD2 LEU 108 4.761 -24.042 6.647 454 HD23 LEU 108 3HD2 LEU 108 3.972 -22.910 7.746 455 H THR 109 H THR 109 4.344 -19.134 4.567 456 HA THR 109 HA THR 109 5.267 -20.841 2.432 457 HB THR 109 HB THR 109 3.448 -18.415 2.409 458 HG1 THR 109 1HG THR 109 2.836 -21.179 2.446 459 HG21 THR 109 1HG2 THR 109 3.395 -18.656 0.192 460 HG22 THR 109 2HG2 THR 109 2.837 -20.317 0.393 461 HG23 THR 109 3HG2 THR 109 4.563 -19.972 0.296 462 H ASN 110 H ASN 110 5.868 -17.515 3.423 463 HA ASN 110 HA ASN 110 7.908 -17.314 1.251 464 HB2 ASN 110 2HB ASN 110 6.351 -14.924 2.224 465 HB3 ASN 110 1HB ASN 110 7.279 -15.101 0.734 466 HD21 ASN 110 1HD2 ASN 110 6.202 -17.745 0.033 467 HD22 ASN 110 2HD2 ASN 110 4.584 -17.510 -0.425 468 HA PRO 111 HA PRO 111 9.599 -16.743 5.644 469 HB2 PRO 111 2HB PRO 111 11.881 -17.989 4.191 470 HB3 PRO 111 1HB PRO 111 11.264 -18.329 5.817 471 HG2 PRO 111 2HG PRO 111 10.815 -19.976 3.767 472 HG3 PRO 111 1HG PRO 111 9.616 -19.719 5.045 473 HD2 PRO 111 2HD PRO 111 9.603 -18.734 2.233 474 HD3 PRO 111 1HD PRO 111 8.243 -19.102 3.311 475 H LYS 112 H LYS 112 10.388 -15.745 2.451 476 HA LYS 112 HA LYS 112 12.074 -13.550 3.553 477 HB2 LYS 112 2HB LYS 112 13.468 -15.238 2.333 478 HB3 LYS 112 1HB LYS 112 12.500 -14.938 0.890 479 HG2 LYS 112 2HG LYS 112 13.141 -12.540 0.981 480 HG3 LYS 112 1HG LYS 112 14.160 -12.884 2.381 481 HD2 LYS 112 2HD LYS 112 15.421 -14.543 0.987 482 HD3 LYS 112 1HD LYS 112 14.476 -14.024 -0.411 483 HE2 LYS 112 2HE LYS 112 15.278 -11.617 0.342 484 HE3 LYS 112 1HE LYS 112 16.574 -12.528 1.119 485 HZ1 LYS 112 1HZ LYS 112 16.886 -13.658 -1.083 486 HZ2 LYS 112 2HZ LYS 112 17.313 -12.014 -1.042 487 HZ3 LYS 112 3HZ LYS 112 15.848 -12.496 -1.754 488 H CYS 113 H CYS 113 11.202 -11.597 3.058 489 HA CYS 113 HA CYS 113 10.128 -10.870 0.528 490 HB2 CYS 113 2HB CYS 113 8.261 -12.175 2.419 491 HB3 CYS 113 1HB CYS 113 7.679 -10.662 1.728 492 H SER 114 H SER 114 8.704 -10.188 3.721 493 HA SER 114 HA SER 114 9.267 -7.327 3.338 494 HB2 SER 114 2HB SER 114 7.901 -6.977 5.274 495 HB3 SER 114 1HB SER 114 7.121 -8.257 4.347 496 HG SER 114 HG SER 114 8.162 -9.761 5.730 497 H TYR 115 H TYR 115 11.046 -9.904 4.456 498 HA TYR 115 HA TYR 115 12.214 -8.922 6.856 499 HB2 TYR 115 2HB TYR 115 13.303 -10.710 4.673 500 HB3 TYR 115 1HB TYR 115 14.204 -10.352 6.149 501 HD1 TYR 115 1HD TYR 115 11.109 -11.893 4.805 502 HD2 TYR 115 2HD TYR 115 13.583 -11.302 8.265 503 HE1 TYR 115 1HE TYR 115 9.812 -13.619 6.026 504 HE2 TYR 115 2HE TYR 115 12.287 -13.028 9.486 505 HH TYR 115 HH TYR 115 9.749 -13.956 9.210 506 H ILE 116 H ILE 116 13.003 -8.270 3.455 507 HA ILE 116 HA ILE 116 15.370 -6.737 4.044 508 HB ILE 116 HB ILE 116 13.732 -7.347 1.696 509 HG12 ILE 116 2HG1 ILE 116 15.957 -7.155 0.597 510 HG13 ILE 116 1HG1 ILE 116 16.623 -6.526 2.104 511 HG21 ILE 116 1HG2 ILE 116 14.476 -5.297 0.426 512 HG22 ILE 116 2HG2 ILE 116 14.899 -4.559 1.964 513 HG23 ILE 116 3HG2 ILE 116 13.221 -4.984 1.622 514 HD11 ILE 116 1HD1 ILE 116 15.113 -9.097 2.238 515 HD12 ILE 116 2HD1 ILE 116 16.515 -8.569 3.168 516 HD13 ILE 116 3HD1 ILE 116 16.718 -9.134 1.510 517 HA PRO 117 HA PRO 117 13.998 -3.027 6.038 518 HB2 PRO 117 2HB PRO 117 14.966 -1.753 3.494 519 HB3 PRO 117 1HB PRO 117 15.205 -1.225 5.172 520 HG2 PRO 117 2HG PRO 117 17.066 -2.615 3.768 521 HG3 PRO 117 1HG PRO 117 16.912 -2.684 5.530 522 HD2 PRO 117 2HD PRO 117 16.428 -4.802 3.608 523 HD3 PRO 117 1HD PRO 117 16.373 -4.895 5.381 524 HA PRO 118 HA PRO 118 10.172 -2.858 3.476 525 HB2 PRO 118 2HB PRO 118 8.416 -3.494 5.420 526 HB3 PRO 118 1HB PRO 118 9.389 -4.731 4.601 527 HG2 PRO 118 2HG PRO 118 9.717 -3.549 7.300 528 HG3 PRO 118 1HG PRO 118 10.050 -5.194 6.735 529 HD2 PRO 118 2HD PRO 118 11.963 -3.161 7.096 530 HD3 PRO 118 1HD PRO 118 12.210 -4.677 6.209 531 H CYS 119 H CYS 119 8.613 -1.167 3.368 532 HA CYS 119 HA CYS 119 9.041 1.028 5.329 533 HB2 CYS 119 2HB CYS 119 7.315 1.768 3.148 534 HB3 CYS 119 1HB CYS 119 8.920 2.387 3.534 535 H LYS 120 H LYS 120 7.597 0.901 6.995 536 HA LYS 120 HA LYS 120 4.728 0.475 6.297 537 HB2 LYS 120 2HB LYS 120 4.425 -0.993 8.196 538 HB3 LYS 120 1HB LYS 120 5.758 -1.623 7.229 539 HG2 LYS 120 2HG LYS 120 7.356 -0.428 8.745 540 HG3 LYS 120 1HG LYS 120 5.987 0.025 9.764 541 HD2 LYS 120 2HD LYS 120 5.432 -2.460 9.903 542 HD3 LYS 120 1HD LYS 120 7.010 -2.759 9.175 543 HE2 LYS 120 2HE LYS 120 8.131 -1.629 11.010 544 HE3 LYS 120 1HE LYS 120 6.583 -1.140 11.703 545 HZ1 LYS 120 1HZ LYS 120 7.666 -3.165 12.704 546 HZ2 LYS 120 2HZ LYS 120 7.299 -3.979 11.258 547 HZ3 LYS 120 3HZ LYS 120 6.051 -3.351 12.222 548 H ARG 121 H ARG 121 3.280 1.701 7.533 549 HA ARG 121 HA ARG 121 4.260 4.102 8.732 550 HB2 ARG 121 2HB ARG 121 1.557 2.746 8.956 551 HB3 ARG 121 1HB ARG 121 1.902 4.386 9.499 552 HG2 ARG 121 2HG ARG 121 2.635 4.950 7.171 553 HG3 ARG 121 1HG ARG 121 2.109 3.344 6.663 554 HD2 ARG 121 2HD ARG 121 0.364 5.496 7.894 555 HD3 ARG 121 1HD ARG 121 0.328 4.955 6.216 556 HE ARG 121 HE ARG 121 -0.099 2.684 7.867 557 HH11 ARG 121 1HH1 ARG 121 -2.210 1.937 8.176 558 HH12 ARG 121 2HH1 ARG 121 -3.544 3.006 7.898 559 HH21 ARG 121 1HH2 ARG 121 -1.544 5.692 6.996 560 HH22 ARG 121 2HH2 ARG 121 -3.166 5.132 7.230 561 H GLU 122 H GLU 122 3.442 0.949 10.016 562 HA GLU 122 HA GLU 122 4.236 0.016 12.061 563 HB2 GLU 122 2HB GLU 122 5.786 2.111 12.197 564 HB3 GLU 122 1HB GLU 122 4.530 2.770 13.249 565 HG2 GLU 122 2HG GLU 122 4.683 0.773 14.689 566 HG3 GLU 122 1HG GLU 122 5.974 0.145 13.666 567 H ASN 123 H ASN 123 1.563 0.669 11.239 568 HA ASN 123 HA ASN 123 -0.006 1.924 13.244 569 HB2 ASN 123 2HB ASN 123 -0.838 -0.471 11.586 570 HB3 ASN 123 1HB ASN 123 -1.888 0.770 12.271 571 HD21 ASN 123 1HD2 ASN 123 0.520 0.141 9.744 572 HD22 ASN 123 2HD2 ASN 123 0.182 1.532 8.830 573 H GLN 124 H GLN 124 1.222 -1.380 12.987 574 HA GLN 124 HA GLN 124 1.273 -3.126 14.552 575 HB2 GLN 124 2HB GLN 124 0.974 -0.812 16.496 576 HB3 GLN 124 1HB GLN 124 1.446 -2.454 16.931 577 HG2 GLN 124 2HG GLN 124 3.430 -2.292 15.506 578 HG3 GLN 124 1HG GLN 124 2.950 -0.675 14.993 579 HE21 GLN 124 1HE2 GLN 124 5.448 -1.087 16.305 580 HE22 GLN 124 2HE2 GLN 124 5.383 -0.361 17.837 581 H LYS 125 H LYS 125 -1.149 -2.941 13.359 582 HA LYS 125 HA LYS 125 -3.320 -2.618 15.268 583 HB2 LYS 125 2HB LYS 125 -3.245 -3.906 12.522 584 HB3 LYS 125 1HB LYS 125 -4.714 -3.589 13.445 585 HG2 LYS 125 2HG LYS 125 -4.108 -1.165 13.496 586 HG3 LYS 125 1HG LYS 125 -2.726 -1.522 12.460 587 HD2 LYS 125 2HD LYS 125 -4.299 -2.471 10.763 588 HD3 LYS 125 1HD LYS 125 -5.648 -1.963 11.780 589 HE2 LYS 125 2HE LYS 125 -5.494 -0.107 10.414 590 HE3 LYS 125 1HE LYS 125 -4.364 0.374 11.680 591 HZ1 LYS 125 1HZ LYS 125 -3.612 -1.016 9.165 592 HZ2 LYS 125 2HZ LYS 125 -2.545 -0.459 10.364 593 HZ3 LYS 125 3HZ LYS 125 -3.443 0.649 9.441 594 H ASN 126 H ASN 126 -4.669 -4.359 16.069 595 HA ASN 126 HA ASN 126 -3.161 -6.651 16.971 596 HB2 ASN 126 2HB ASN 126 -6.168 -6.300 17.024 597 HB3 ASN 126 1HB ASN 126 -5.197 -7.336 18.069 598 HD21 ASN 126 1HD2 ASN 126 -3.079 -5.568 18.727 599 HD22 ASN 126 2HD2 ASN 126 -3.702 -4.266 19.619 600 H LEU 127 H LEU 127 -4.060 -8.930 16.631 601 HA LEU 127 HA LEU 127 -3.929 -9.626 13.873 602 HB2 LEU 127 2HB LEU 127 -5.174 -11.263 16.099 603 HB3 LEU 127 1HB LEU 127 -4.494 -11.873 14.590 604 HG LEU 127 HG LEU 127 -2.996 -10.516 16.844 605 HD11 LEU 127 1HD1 LEU 127 -3.697 -13.178 16.422 606 HD12 LEU 127 2HD1 LEU 127 -2.418 -12.599 17.488 607 HD13 LEU 127 3HD1 LEU 127 -2.037 -13.079 15.834 608 HD21 LEU 127 1HD2 LEU 127 -1.902 -9.703 14.936 609 HD22 LEU 127 2HD2 LEU 127 -2.237 -11.164 14.005 610 HD23 LEU 127 3HD2 LEU 127 -1.012 -11.189 15.274 611 H GLU 128 H GLU 128 -6.694 -9.086 16.016 612 HA GLU 128 HA GLU 128 -8.734 -10.103 14.353 613 HB2 GLU 128 2HB GLU 128 -9.063 -9.262 16.691 614 HB3 GLU 128 1HB GLU 128 -8.908 -7.615 16.079 615 HG2 GLU 128 2HG GLU 128 -10.824 -8.042 14.540 616 HG3 GLU 128 1HG GLU 128 -11.012 -9.640 15.265 617 H SER 129 H SER 129 -6.988 -7.046 14.223 618 HA SER 129 HA SER 129 -8.638 -5.687 12.348 619 HB2 SER 129 2HB SER 129 -6.700 -4.303 11.895 620 HB3 SER 129 1HB SER 129 -6.717 -4.677 13.617 621 HG SER 129 HG SER 129 -4.974 -5.474 11.620 622 H VAL 130 H VAL 130 -6.186 -8.184 11.928 623 HA VAL 130 HA VAL 130 -5.821 -7.942 9.121 624 HB VAL 130 HB VAL 130 -5.715 -10.379 10.911 625 HG11 VAL 130 1HG1 VAL 130 -5.224 -9.996 7.978 626 HG12 VAL 130 2HG1 VAL 130 -5.949 -11.367 8.819 627 HG13 VAL 130 3HG1 VAL 130 -4.203 -11.124 8.871 628 HG21 VAL 130 1HG2 VAL 130 -3.360 -9.036 9.634 629 HG22 VAL 130 2HG2 VAL 130 -3.451 -9.917 11.158 630 HG23 VAL 130 3HG2 VAL 130 -4.096 -8.280 11.048 631 H MET 131 H MET 131 -8.242 -9.802 10.974 632 HA MET 131 HA MET 131 -9.468 -11.061 8.740 633 HB2 MET 131 2HB MET 131 -9.996 -11.520 11.174 634 HB3 MET 131 1HB MET 131 -10.917 -10.014 11.190 635 HG2 MET 131 2HG MET 131 -12.197 -10.946 9.178 636 HG3 MET 131 1HG MET 131 -11.449 -12.498 9.552 637 HE1 MET 131 1HE MET 131 -14.677 -10.210 11.794 638 HE2 MET 131 2HE MET 131 -14.138 -10.047 10.124 639 HE3 MET 131 3HE MET 131 -13.118 -9.458 11.435 640 H ASN 132 H ASN 132 -9.900 -7.861 10.174 641 HA ASN 132 HA ASN 132 -12.114 -7.025 8.581 642 HB2 ASN 132 2HB ASN 132 -11.221 -5.820 10.605 643 HB3 ASN 132 1HB ASN 132 -9.862 -5.276 9.619 644 HD21 ASN 132 1HD2 ASN 132 -13.465 -5.214 9.684 645 HD22 ASN 132 2HD2 ASN 132 -13.602 -3.729 8.873 646 H TRP 133 H TRP 133 -8.607 -6.945 7.976 647 HA TRP 133 HA TRP 133 -8.700 -5.379 5.597 648 HB2 TRP 133 2HB TRP 133 -6.522 -5.666 6.296 649 HB3 TRP 133 1HB TRP 133 -6.792 -7.334 6.794 650 HD1 TRP 133 HD TRP 133 -6.229 -5.224 3.623 651 HE1 TRP 133 1HE TRP 133 -5.298 -6.763 1.782 652 HE3 TRP 133 3HE TRP 133 -6.561 -9.727 5.996 653 HZ2 TRP 133 2HZ TRP 133 -4.758 -9.542 1.369 654 HZ3 TRP 133 3HZ TRP 133 -5.830 -11.804 4.859 655 HH2 TRP 133 HH TRP 133 -4.930 -11.719 2.551 656 H GLN 134 H GLN 134 -8.745 -8.934 5.993 657 HA GLN 134 HA GLN 134 -9.234 -9.406 3.171 658 HB2 GLN 134 2HB GLN 134 -8.247 -11.105 4.739 659 HB3 GLN 134 1HB GLN 134 -9.823 -11.240 5.511 660 HG2 GLN 134 2HG GLN 134 -10.504 -11.553 2.884 661 HG3 GLN 134 1HG GLN 134 -8.904 -12.293 2.909 662 HE21 GLN 134 1HE2 GLN 134 -11.838 -12.262 5.024 663 HE22 GLN 134 2HE2 GLN 134 -11.797 -13.928 5.347 664 H GLN 135 H GLN 135 -11.275 -9.446 6.085 665 HA GLN 135 HA GLN 135 -13.721 -10.068 4.762 666 HB2 GLN 135 2HB GLN 135 -13.309 -10.163 7.245 667 HB3 GLN 135 1HB GLN 135 -13.386 -8.401 7.269 668 HG2 GLN 135 2HG GLN 135 -15.671 -8.553 6.231 669 HG3 GLN 135 1HG GLN 135 -15.587 -10.305 6.427 670 HE21 GLN 135 1HE2 GLN 135 -16.707 -10.939 8.268 671 HE22 GLN 135 2HE2 GLN 135 -16.752 -10.078 9.730 672 H TYR 136 H TYR 136 -12.161 -6.964 5.472 673 HA TYR 136 HA TYR 136 -14.368 -5.357 4.583 674 HB2 TYR 136 2HB TYR 136 -12.582 -4.432 5.996 675 HB3 TYR 136 1HB TYR 136 -11.421 -4.672 4.686 676 HD1 TYR 136 1HD TYR 136 -11.758 -3.482 2.496 677 HD2 TYR 136 2HD TYR 136 -14.041 -2.545 6.009 678 HE1 TYR 136 1HE TYR 136 -12.443 -1.334 1.475 679 HE2 TYR 136 2HE TYR 136 -14.722 -0.386 4.991 680 HH TYR 136 HH TYR 136 -14.954 0.575 2.711 681 H TRP 137 H TRP 137 -11.284 -6.164 2.920 682 HA TRP 137 HA TRP 137 -12.204 -4.978 0.455 683 HB2 TRP 137 2HB TRP 137 -9.887 -6.839 1.027 684 HB3 TRP 137 1HB TRP 137 -10.168 -6.049 -0.519 685 HD1 TRP 137 HD TRP 137 -8.213 -5.595 2.450 686 HE1 TRP 137 1HE TRP 137 -7.536 -3.142 2.825 687 HE3 TRP 137 3HE TRP 137 -11.404 -3.297 -0.794 688 HZ2 TRP 137 2HZ TRP 137 -8.247 -0.546 1.871 689 HZ3 TRP 137 3HZ TRP 137 -11.382 -0.832 -1.049 690 HH2 TRP 137 HH TRP 137 -9.808 0.546 0.280 691 H LYS 138 H LYS 138 -12.053 -8.311 1.674 692 HA LYS 138 HA LYS 138 -12.788 -9.597 -0.754 693 HB2 LYS 138 2HB LYS 138 -12.003 -10.803 1.284 694 HB3 LYS 138 1HB LYS 138 -13.546 -10.437 2.060 695 HG2 LYS 138 2HG LYS 138 -14.726 -11.630 0.226 696 HG3 LYS 138 1HG LYS 138 -13.164 -12.046 -0.481 697 HD2 LYS 138 2HD LYS 138 -12.555 -13.184 1.668 698 HD3 LYS 138 1HD LYS 138 -14.195 -12.880 2.244 699 HE2 LYS 138 2HE LYS 138 -13.759 -14.257 -0.395 700 HE3 LYS 138 1HE LYS 138 -13.662 -15.175 1.107 701 HZ1 LYS 138 1HZ LYS 138 -15.923 -14.902 -0.108 702 HZ2 LYS 138 2HZ LYS 138 -15.950 -13.388 0.659 703 HZ3 LYS 138 3HZ LYS 138 -15.859 -14.809 1.583 704 H ASP 139 H ASP 139 -14.782 -8.141 1.795 705 HA ASP 139 HA ASP 139 -17.316 -8.980 0.828 706 HB2 ASP 139 2HB ASP 139 -16.498 -6.425 2.242 707 HB3 ASP 139 1HB ASP 139 -18.174 -6.887 1.947 708 H GLU 140 H GLU 140 -15.232 -6.278 -0.126 709 HA GLU 140 HA GLU 140 -17.182 -5.579 -2.258 710 HB2 GLU 140 2HB GLU 140 -14.737 -4.069 -1.294 711 HB3 GLU 140 1HB GLU 140 -15.905 -3.493 -2.484 712 HG2 GLU 140 2HG GLU 140 -17.698 -3.660 -0.767 713 HG3 GLU 140 1HG GLU 140 -16.484 -4.142 0.421 714 H ILE 141 H ILE 141 -13.637 -5.344 -2.147 715 HA ILE 141 HA ILE 141 -13.586 -6.567 -4.843 716 HB ILE 141 HB ILE 141 -11.132 -5.738 -4.760 717 HG12 ILE 141 2HG1 ILE 141 -11.872 -3.543 -3.013 718 HG13 ILE 141 1HG1 ILE 141 -11.918 -5.068 -2.134 719 HG21 ILE 141 1HG2 ILE 141 -12.240 -3.263 -4.970 720 HG22 ILE 141 2HG2 ILE 141 -13.674 -4.276 -5.130 721 HG23 ILE 141 3HG2 ILE 141 -12.321 -4.484 -6.241 722 HD11 ILE 141 1HD1 ILE 141 -9.671 -4.188 -1.983 723 HD12 ILE 141 2HD1 ILE 141 -9.597 -3.961 -3.729 724 HD13 ILE 141 3HD1 ILE 141 -9.635 -5.589 -3.051 725 H GLY 142 H GLY 142 -11.231 -6.648 -2.149 726 HA2 GLY 142 2HA GLY 142 -10.679 -8.720 -0.964 727 HA3 GLY 142 1HA GLY 142 -11.209 -9.618 -2.387 728 H SER 143 H SER 143 -9.658 -7.185 -3.788 729 HA SER 143 HA SER 143 -6.930 -7.312 -3.340 730 HB2 SER 143 2HB SER 143 -6.595 -9.587 -3.554 731 HB3 SER 143 1HB SER 143 -7.971 -9.792 -4.637 732 HG SER 143 HG SER 143 -5.403 -9.519 -5.251 733 H GLN 144 H GLN 144 -7.894 -5.228 -4.306 734 HA GLN 144 HA GLN 144 -7.328 -5.243 -7.218 735 HB2 GLN 144 2HB GLN 144 -9.832 -5.402 -6.755 736 HB3 GLN 144 1HB GLN 144 -9.710 -3.778 -6.077 737 HG2 GLN 144 2HG GLN 144 -8.489 -3.231 -8.341 738 HG3 GLN 144 1HG GLN 144 -9.324 -4.677 -8.916 739 HE21 GLN 144 1HE2 GLN 144 -10.898 -3.608 -10.239 740 HE22 GLN 144 2HE2 GLN 144 -12.084 -2.572 -9.602 741 HA PRO 145 HA PRO 145 -5.012 -1.904 -4.945 742 HB2 PRO 145 2HB PRO 145 -3.462 -2.100 -7.473 743 HB3 PRO 145 1HB PRO 145 -2.888 -2.066 -5.798 744 HG2 PRO 145 2HG PRO 145 -2.917 -4.305 -7.283 745 HG3 PRO 145 1HG PRO 145 -3.127 -4.312 -5.530 746 HD2 PRO 145 2HD PRO 145 -5.141 -4.786 -7.656 747 HD3 PRO 145 1HD PRO 145 -5.130 -5.340 -5.971 748 H PHE 146 H PHE 146 -5.195 0.327 -5.326 749 HA PHE 146 HA PHE 146 -6.106 1.210 -7.998 750 HB2 PHE 146 2HB PHE 146 -7.816 2.684 -6.918 751 HB3 PHE 146 1HB PHE 146 -8.169 0.967 -6.759 752 HD1 PHE 146 1HD PHE 146 -8.048 4.013 -5.068 753 HD2 PHE 146 2HD PHE 146 -7.080 -0.140 -4.523 754 HE1 PHE 146 1HE PHE 146 -8.179 4.304 -2.612 755 HE2 PHE 146 2HE PHE 146 -7.193 0.160 -2.060 756 HZ PHE 146 HZ PHE 146 -7.749 2.380 -1.109 757 H THR 147 H THR 147 -5.797 3.520 -8.367 758 HA THR 147 HA THR 147 -3.733 4.698 -6.549 759 HB THR 147 HB THR 147 -2.755 5.766 -8.552 760 HG1 THR 147 1HG THR 147 -4.070 5.873 -10.172 761 HG21 THR 147 1HG2 THR 147 -2.910 2.855 -8.120 762 HG22 THR 147 2HG2 THR 147 -1.496 3.897 -8.295 763 HG23 THR 147 3HG2 THR 147 -2.353 3.326 -9.727 764 H CYS 148 H CYS 148 -3.757 7.024 -6.436 765 HA CYS 148 HA CYS 148 -6.227 8.308 -7.423 766 HB2 CYS 148 2HB CYS 148 -5.993 9.490 -4.981 767 HB3 CYS 148 1HB CYS 148 -7.049 8.115 -5.297 768 H TYR 149 H TYR 149 -6.049 10.659 -7.485 769 HA TYR 149 HA TYR 149 -3.374 11.823 -7.020 770 HB2 TYR 149 2HB TYR 149 -4.605 11.570 -9.773 771 HB3 TYR 149 1HB TYR 149 -3.404 12.799 -9.391 772 HD1 TYR 149 1HD TYR 149 -4.004 9.220 -9.921 773 HD2 TYR 149 2HD TYR 149 -1.121 12.176 -8.744 774 HE1 TYR 149 1HE TYR 149 -2.184 7.561 -10.223 775 HE2 TYR 149 2HE TYR 149 0.702 10.519 -9.043 776 HH TYR 149 HH TYR 149 0.400 7.745 -10.742 777 H PHE 150 H PHE 150 -3.590 13.987 -6.471 778 HA PHE 150 HA PHE 150 -6.115 15.327 -7.222 779 HB2 PHE 150 2HB PHE 150 -7.004 15.362 -5.137 780 HB3 PHE 150 1HB PHE 150 -5.841 14.099 -4.751 781 HD1 PHE 150 1HD PHE 150 -6.621 17.667 -4.504 782 HD2 PHE 150 2HD PHE 150 -3.756 14.611 -3.586 783 HE1 PHE 150 1HE PHE 150 -5.506 19.207 -2.920 784 HE2 PHE 150 2HE PHE 150 -2.619 16.142 -2.008 785 HZ PHE 150 HZ PHE 150 -3.493 18.447 -1.668 786 H ASN 151 H ASN 151 -6.016 17.638 -7.074 787 HA ASN 151 HA ASN 151 -3.430 18.818 -6.267 788 HB2 ASN 151 2HB ASN 151 -3.049 19.913 -8.385 789 HB3 ASN 151 1HB ASN 151 -3.236 18.185 -8.688 790 HD21 ASN 151 1HD2 ASN 151 -3.763 20.254 -10.681 791 HD22 ASN 151 2HD2 ASN 151 -5.416 20.178 -11.060 792 H GLN 152 H GLN 152 -3.998 20.465 -4.950 793 HA GLN 152 HA GLN 152 -6.591 21.846 -5.329 794 HB2 GLN 152 2HB GLN 152 -6.145 21.338 -3.043 795 HB3 GLN 152 1HB GLN 152 -4.485 21.917 -3.155 796 HG2 GLN 152 2HG GLN 152 -5.218 24.201 -3.343 797 HG3 GLN 152 1HG GLN 152 -6.899 23.707 -3.541 798 HE21 GLN 152 1HE2 GLN 152 -6.413 25.469 -1.472 799 HE22 GLN 152 2HE2 GLN 152 -6.485 24.672 0.027 800 H HIS 153 H HIS 153 -3.371 22.188 -6.288 801 HA HIS 153 HA HIS 153 -2.788 24.897 -6.126 802 HB2 HIS 153 2HB HIS 153 -2.333 23.086 -8.513 803 HB3 HIS 153 1HB HIS 153 -1.454 24.574 -8.157 804 HD1 HIS 153 1HD HIS 153 0.190 24.548 -6.129 805 HD2 HIS 153 2HD HIS 153 -1.629 20.870 -6.874 806 HE1 HIS 153 1HE HIS 153 1.434 22.837 -4.732 807 HE2 HIS 153 2HE HIS 153 0.334 20.595 -5.177 808 H GLN 154 H GLN 154 -5.148 23.322 -8.228 809 HA GLN 154 HA GLN 154 -5.577 25.612 -9.934 810 HB2 GLN 154 2HB GLN 154 -6.350 23.275 -10.462 811 HB3 GLN 154 1HB GLN 154 -7.568 23.444 -9.197 812 HG2 GLN 154 2HG GLN 154 -8.533 25.383 -10.362 813 HG3 GLN 154 1HG GLN 154 -7.305 25.246 -11.622 814 HE21 GLN 154 1HE2 GLN 154 -9.892 25.046 -12.522 815 HE22 GLN 154 2HE2 GLN 154 -10.286 23.436 -12.891 816 H ARG 155 H ARG 155 -7.591 24.309 -7.281 817 HA ARG 155 HA ARG 155 -7.844 26.867 -6.017 818 HB2 ARG 155 2HB ARG 155 -9.606 26.474 -8.212 819 HB3 ARG 155 1HB ARG 155 -10.575 26.356 -6.742 820 HG2 ARG 155 2HG ARG 155 -8.614 28.603 -7.283 821 HG3 ARG 155 1HG ARG 155 -10.338 28.704 -7.637 822 HD2 ARG 155 2HD ARG 155 -10.622 27.961 -5.134 823 HD3 ARG 155 1HD ARG 155 -8.967 28.544 -4.967 824 HE ARG 155 HE ARG 155 -10.742 30.453 -6.286 825 HH11 ARG 155 1HH1 ARG 155 -11.138 32.351 -5.126 826 HH12 ARG 155 2HH1 ARG 155 -10.726 32.426 -3.445 827 HH21 ARG 155 1HH2 ARG 155 -9.502 29.183 -3.330 828 HH22 ARG 155 2HH2 ARG 155 -9.799 30.633 -2.428 829 HA PRO 156 HA PRO 156 -10.279 23.645 -3.620 830 HB2 PRO 156 2HB PRO 156 -11.762 21.786 -4.834 831 HB3 PRO 156 1HB PRO 156 -12.200 23.500 -4.948 832 HG2 PRO 156 2HG PRO 156 -11.066 21.721 -7.001 833 HG3 PRO 156 1HG PRO 156 -12.010 23.207 -7.190 834 HD2 PRO 156 2HD PRO 156 -9.108 22.890 -7.259 835 HD3 PRO 156 1HD PRO 156 -10.072 24.335 -7.613 836 H ASP 157 H ASP 157 -10.427 20.851 -5.585 837 HA ASP 157 HA ASP 157 -7.818 19.756 -5.093 838 HB2 ASP 157 2HB ASP 157 -8.480 18.128 -3.323 839 HB3 ASP 157 1HB ASP 157 -8.563 19.794 -2.755 840 H ASP 158 H ASP 158 -8.539 19.359 -7.420 841 HA ASP 158 HA ASP 158 -10.694 17.595 -8.061 842 HB2 ASP 158 2HB ASP 158 -8.002 17.935 -9.431 843 HB3 ASP 158 1HB ASP 158 -9.371 17.066 -10.123 844 H VAL 159 H VAL 159 -10.618 15.215 -8.365 845 HA VAL 159 HA VAL 159 -8.280 13.935 -7.002 846 HB VAL 159 HB VAL 159 -9.798 12.468 -5.762 847 HG11 VAL 159 1HG1 VAL 159 -11.037 15.059 -5.108 848 HG12 VAL 159 2HG1 VAL 159 -9.278 15.116 -5.230 849 HG13 VAL 159 3HG1 VAL 159 -10.049 13.999 -4.103 850 HG21 VAL 159 1HG2 VAL 159 -11.913 14.068 -7.223 851 HG22 VAL 159 2HG2 VAL 159 -12.267 13.116 -5.780 852 HG23 VAL 159 3HG2 VAL 159 -11.682 12.321 -7.241 853 H LEU 160 H LEU 160 -7.810 11.808 -7.640 854 HA LEU 160 HA LEU 160 -9.246 10.848 -10.088 855 HB2 LEU 160 2HB LEU 160 -6.797 11.615 -10.366 856 HB3 LEU 160 1HB LEU 160 -6.373 10.214 -9.386 857 HG LEU 160 HG LEU 160 -7.632 8.766 -11.000 858 HD11 LEU 160 1HD1 LEU 160 -8.277 11.412 -12.084 859 HD12 LEU 160 2HD1 LEU 160 -9.079 9.863 -12.349 860 HD13 LEU 160 3HD1 LEU 160 -7.666 10.301 -13.310 861 HD21 LEU 160 1HD2 LEU 160 -5.435 8.552 -11.576 862 HD22 LEU 160 2HD2 LEU 160 -5.165 10.296 -11.574 863 HD23 LEU 160 3HD2 LEU 160 -5.898 9.518 -12.977 864 H LEU 161 H LEU 161 -9.652 8.549 -10.145 865 HA LEU 161 HA LEU 161 -8.838 7.004 -7.746 866 HB2 LEU 161 2HB LEU 161 -11.089 8.070 -7.309 867 HB3 LEU 161 1HB LEU 161 -11.723 7.107 -8.645 868 HG LEU 161 HG LEU 161 -10.453 5.160 -7.280 869 HD11 LEU 161 1HD1 LEU 161 -9.886 7.028 -5.551 870 HD12 LEU 161 2HD1 LEU 161 -10.470 5.475 -4.954 871 HD13 LEU 161 3HD1 LEU 161 -11.567 6.852 -5.052 872 HD21 LEU 161 1HD2 LEU 161 -13.219 6.273 -6.716 873 HD22 LEU 161 2HD2 LEU 161 -12.679 4.658 -6.259 874 HD23 LEU 161 3HD2 LEU 161 -12.795 5.100 -7.963 875 H HIS 162 H HIS 162 -7.588 6.280 -9.881 876 HA HIS 162 HA HIS 162 -9.114 4.532 -11.656 877 HB2 HIS 162 2HB HIS 162 -6.136 4.932 -11.252 878 HB3 HIS 162 1HB HIS 162 -6.822 3.855 -12.467 879 HD1 HIS 162 1HD HIS 162 -5.207 6.118 -13.575 880 HD2 HIS 162 2HD HIS 162 -9.269 6.542 -12.719 881 HE1 HIS 162 1HE HIS 162 -6.039 8.063 -14.973 882 HE2 HIS 162 2HE HIS 162 -8.507 8.328 -14.460 883 H ARG 163 H ARG 163 -9.077 2.232 -11.631 884 HA ARG 163 HA ARG 163 -8.122 1.041 -9.053 885 HB2 ARG 163 2HB ARG 163 -10.486 0.271 -10.784 886 HB3 ARG 163 1HB ARG 163 -9.952 -0.626 -9.362 887 HG2 ARG 163 2HG ARG 163 -10.250 1.445 -7.995 888 HG3 ARG 163 1HG ARG 163 -10.909 2.251 -9.421 889 HD2 ARG 163 2HD ARG 163 -12.045 -0.221 -8.080 890 HD3 ARG 163 1HD ARG 163 -12.740 1.399 -8.041 891 HE ARG 163 HE ARG 163 -12.998 -0.493 -10.216 892 HH11 ARG 163 1HH1 ARG 163 -14.068 0.242 -12.065 893 HH12 ARG 163 2HH1 ARG 163 -14.285 1.942 -12.306 894 HH21 ARG 163 1HH2 ARG 163 -12.681 2.832 -9.365 895 HH22 ARG 163 2HH2 ARG 163 -13.499 3.410 -10.778 896 H THR 164 H THR 164 -7.197 -1.071 -9.156 897 HA THR 164 HA THR 164 -5.841 -1.645 -11.700 898 HB THR 164 HB THR 164 -5.698 -3.060 -9.028 899 HG1 THR 164 1HG THR 164 -3.539 -1.895 -9.257 900 HG21 THR 164 1HG2 THR 164 -4.795 -4.646 -10.421 901 HG22 THR 164 2HG2 THR 164 -3.371 -3.621 -10.248 902 HG23 THR 164 3HG2 THR 164 -4.400 -3.470 -11.674 903 H HIS 165 H HIS 165 -6.262 -3.416 -13.013 904 HA HIS 165 HA HIS 165 -8.646 -5.062 -12.260 905 HB2 HIS 165 2HB HIS 165 -7.574 -4.310 -14.996 906 HB3 HIS 165 1HB HIS 165 -8.943 -5.385 -14.714 907 HD1 HIS 165 1HD HIS 165 -7.924 -1.782 -14.578 908 HD2 HIS 165 2HD HIS 165 -11.313 -4.080 -13.772 909 HE1 HIS 165 1HE HIS 165 -9.845 -0.154 -14.289 910 HE2 HIS 165 2HE HIS 165 -11.911 -1.541 -13.799 911 H ASP 166 H ASP 166 -8.403 -7.274 -12.231 912 HA ASP 166 HA ASP 166 -7.171 -9.277 -12.037 913 HB2 ASP 166 2HB ASP 166 -6.363 -8.269 -14.781 914 HB3 ASP 166 1HB ASP 166 -6.048 -9.903 -14.198 Start of MODEL 15 1 H1 GLN 45 1HT GLN 45 3.002 17.555 -6.818 2 H2 GLN 45 2HT GLN 45 2.096 17.157 -5.436 3 H3 GLN 45 3HT GLN 45 2.249 16.040 -6.707 4 HA GLN 45 HA GLN 45 3.886 15.150 -5.499 5 HB2 GLN 45 2HB GLN 45 5.220 17.714 -6.427 6 HB3 GLN 45 1HB GLN 45 6.081 16.293 -5.834 7 HG2 GLN 45 2HG GLN 45 5.123 14.934 -7.640 8 HG3 GLN 45 1HG GLN 45 4.212 16.327 -8.223 9 HE21 GLN 45 1HE2 GLN 45 6.109 15.030 -9.915 10 HE22 GLN 45 2HE2 GLN 45 7.416 16.081 -10.171 11 H ASP 46 H ASP 46 5.809 15.846 -3.814 12 HA ASP 46 HA ASP 46 4.470 16.596 -1.419 13 HB2 ASP 46 2HB ASP 46 7.417 16.593 -2.125 14 HB3 ASP 46 1HB ASP 46 6.802 16.857 -0.494 15 H LEU 47 H LEU 47 6.511 18.474 -3.635 16 HA LEU 47 HA LEU 47 6.510 20.889 -2.099 17 HB2 LEU 47 2HB LEU 47 6.717 20.559 -5.106 18 HB3 LEU 47 1HB LEU 47 7.214 21.977 -4.182 19 HG LEU 47 HG LEU 47 8.367 19.185 -3.897 20 HD11 LEU 47 1HD1 LEU 47 10.457 20.503 -4.675 21 HD12 LEU 47 2HD1 LEU 47 9.308 21.719 -5.234 22 HD13 LEU 47 3HD1 LEU 47 9.251 20.084 -5.892 23 HD21 LEU 47 1HD2 LEU 47 8.649 21.729 -2.346 24 HD22 LEU 47 2HD2 LEU 47 10.089 20.736 -2.575 25 HD23 LEU 47 3HD2 LEU 47 8.670 20.061 -1.775 26 H GLN 48 H GLN 48 4.293 19.645 -4.575 27 HA GLN 48 HA GLN 48 2.280 21.601 -3.632 28 HB2 GLN 48 2HB GLN 48 1.733 22.223 -5.998 29 HB3 GLN 48 1HB GLN 48 3.323 22.783 -5.478 30 HG2 GLN 48 2HG GLN 48 4.415 21.423 -6.935 31 HG3 GLN 48 1HG GLN 48 3.309 20.077 -6.654 32 HE21 GLN 48 1HE2 GLN 48 1.210 20.130 -7.832 33 HE22 GLN 48 2HE2 GLN 48 1.081 21.003 -9.283 34 H ALA 49 H ALA 49 0.096 21.003 -4.272 35 HA ALA 49 HA ALA 49 -0.334 18.147 -4.277 36 HB1 ALA 49 1HB ALA 49 -2.750 18.845 -4.622 37 HB2 ALA 49 2HB ALA 49 -2.173 20.514 -4.625 38 HB3 ALA 49 3HB ALA 49 -1.962 19.510 -3.191 39 H THR 50 H THR 50 -1.091 16.821 -5.948 40 HA THR 50 HA THR 50 -1.864 17.715 -8.545 41 HB THR 50 HB THR 50 0.962 16.627 -8.396 42 HG1 THR 50 1HG THR 50 -0.045 19.229 -8.847 43 HG21 THR 50 1HG2 THR 50 -0.508 16.085 -10.419 44 HG22 THR 50 2HG2 THR 50 1.012 16.909 -10.766 45 HG23 THR 50 3HG2 THR 50 -0.499 17.816 -10.760 46 H GLU 51 H GLU 51 0.243 15.102 -7.351 47 HA GLU 51 HA GLU 51 -1.784 13.154 -8.350 48 HB2 GLU 51 2HB GLU 51 1.187 12.758 -7.960 49 HB3 GLU 51 1HB GLU 51 0.064 11.611 -8.691 50 HG2 GLU 51 2HG GLU 51 -0.444 13.318 -10.456 51 HG3 GLU 51 1HG GLU 51 0.808 14.346 -9.762 52 H ALA 52 H ALA 52 -2.493 11.569 -7.001 53 HA ALA 52 HA ALA 52 -1.110 10.997 -4.466 54 HB1 ALA 52 1HB ALA 52 -2.496 12.572 -3.456 55 HB2 ALA 52 2HB ALA 52 -3.565 11.169 -3.425 56 HB3 ALA 52 3HB ALA 52 -3.752 12.392 -4.681 57 H ASN 53 H ASN 53 -0.961 8.759 -4.812 58 HA ASN 53 HA ASN 53 -3.355 7.495 -6.024 59 HB2 ASN 53 2HB ASN 53 -0.525 6.491 -5.816 60 HB3 ASN 53 1HB ASN 53 -1.862 5.527 -6.432 61 HD21 ASN 53 1HD2 ASN 53 -3.245 7.776 -7.764 62 HD22 ASN 53 2HD2 ASN 53 -2.294 8.208 -9.100 63 H CYS 54 H CYS 54 -4.498 5.886 -5.089 64 HA CYS 54 HA CYS 54 -3.698 5.094 -2.322 65 HB2 CYS 54 2HB CYS 54 -6.576 5.250 -2.741 66 HB3 CYS 54 1HB CYS 54 -5.605 5.994 -1.477 67 H THR 55 H THR 55 -3.136 2.946 -2.842 68 HA THR 55 HA THR 55 -5.273 1.428 -4.270 69 HB THR 55 HB THR 55 -3.809 0.843 -5.865 70 HG1 THR 55 1HG THR 55 -1.761 -0.129 -5.124 71 HG21 THR 55 1HG2 THR 55 -1.719 2.044 -6.056 72 HG22 THR 55 2HG2 THR 55 -1.704 2.386 -4.328 73 HG23 THR 55 3HG2 THR 55 -2.904 3.148 -5.365 74 H VAL 56 H VAL 56 -5.605 -0.698 -3.740 75 HA VAL 56 HA VAL 56 -4.633 -1.503 -1.056 76 HB VAL 56 HB VAL 56 -6.900 -2.405 -2.840 77 HG11 VAL 56 1HG1 VAL 56 -5.577 -3.840 -0.548 78 HG12 VAL 56 2HG1 VAL 56 -6.103 -4.488 -2.102 79 HG13 VAL 56 3HG1 VAL 56 -7.295 -4.065 -0.874 80 HG21 VAL 56 1HG2 VAL 56 -8.190 -1.280 -1.369 81 HG22 VAL 56 2HG2 VAL 56 -6.698 -0.581 -0.738 82 HG23 VAL 56 3HG2 VAL 56 -7.381 -2.025 0.010 83 H LEU 57 H LEU 57 -2.726 -2.610 -1.218 84 HA LEU 57 HA LEU 57 -1.533 -3.669 -3.458 85 HB2 LEU 57 2HB LEU 57 -0.531 -3.614 -1.160 86 HB3 LEU 57 1HB LEU 57 -1.488 -5.041 -0.761 87 HG LEU 57 HG LEU 57 -0.437 -6.230 -2.694 88 HD11 LEU 57 1HD1 LEU 57 0.716 -3.536 -3.058 89 HD12 LEU 57 2HD1 LEU 57 0.450 -4.817 -4.238 90 HD13 LEU 57 3HD1 LEU 57 1.877 -4.855 -3.204 91 HD21 LEU 57 1HD2 LEU 57 2.032 -5.795 -1.484 92 HD22 LEU 57 2HD2 LEU 57 0.819 -6.963 -0.961 93 HD23 LEU 57 3HD2 LEU 57 0.873 -5.359 -0.229 94 H SER 58 H SER 58 -1.515 -5.717 -4.492 95 HA SER 58 HA SER 58 -4.085 -7.165 -4.256 96 HB2 SER 58 2HB SER 58 -3.527 -8.134 -6.408 97 HB3 SER 58 1HB SER 58 -3.212 -6.405 -6.507 98 HG SER 58 HG SER 58 -1.438 -8.566 -6.392 99 H VAL 59 H VAL 59 -4.070 -9.478 -3.895 100 HA VAL 59 HA VAL 59 -1.631 -10.339 -2.432 101 HB VAL 59 HB VAL 59 -4.324 -11.718 -2.532 102 HG11 VAL 59 1HG1 VAL 59 -3.564 -12.897 -0.621 103 HG12 VAL 59 2HG1 VAL 59 -2.244 -11.761 -0.342 104 HG13 VAL 59 3HG1 VAL 59 -2.169 -12.882 -1.703 105 HG21 VAL 59 1HG2 VAL 59 -4.467 -10.525 -0.190 106 HG22 VAL 59 2HG2 VAL 59 -4.905 -9.627 -1.645 107 HG23 VAL 59 3HG2 VAL 59 -3.321 -9.391 -0.905 108 H GLN 60 H GLN 60 -0.216 -11.509 -3.594 109 HA GLN 60 HA GLN 60 -1.234 -13.651 -5.362 110 HB2 GLN 60 2HB GLN 60 0.755 -11.532 -6.235 111 HB3 GLN 60 1HB GLN 60 0.343 -12.975 -7.163 112 HG2 GLN 60 2HG GLN 60 -2.016 -12.250 -7.249 113 HG3 GLN 60 1HG GLN 60 -1.605 -10.806 -6.324 114 HE21 GLN 60 1HE2 GLN 60 -2.718 -10.423 -8.848 115 HE22 GLN 60 2HE2 GLN 60 -1.533 -9.862 -9.927 116 H GLN 61 H GLN 61 0.415 -15.295 -5.775 117 HA GLN 61 HA GLN 61 2.030 -15.891 -3.506 118 HB2 GLN 61 2HB GLN 61 2.403 -16.911 -6.330 119 HB3 GLN 61 1HB GLN 61 2.956 -17.694 -4.853 120 HG2 GLN 61 2HG GLN 61 0.081 -17.191 -5.667 121 HG3 GLN 61 1HG GLN 61 0.894 -18.756 -5.597 122 HE21 GLN 61 1HE2 GLN 61 -1.145 -16.772 -3.845 123 HE22 GLN 61 2HE2 GLN 61 -0.819 -17.360 -2.291 124 H ILE 62 H ILE 62 4.375 -15.930 -3.356 125 HA ILE 62 HA ILE 62 5.669 -13.521 -3.918 126 HB ILE 62 HB ILE 62 6.495 -15.315 -2.372 127 HG12 ILE 62 2HG1 ILE 62 8.758 -14.795 -4.247 128 HG13 ILE 62 1HG1 ILE 62 7.913 -13.390 -3.596 129 HG21 ILE 62 1HG2 ILE 62 7.615 -17.231 -3.205 130 HG22 ILE 62 2HG2 ILE 62 7.702 -16.571 -4.838 131 HG23 ILE 62 3HG2 ILE 62 6.155 -17.112 -4.187 132 HD11 ILE 62 1HD1 ILE 62 9.806 -14.035 -2.154 133 HD12 ILE 62 2HD1 ILE 62 9.106 -15.642 -1.956 134 HD13 ILE 62 3HD1 ILE 62 8.270 -14.230 -1.310 135 H GLY 63 H GLY 63 7.924 -13.721 -5.322 136 HA2 GLY 63 2HA GLY 63 8.875 -14.267 -7.477 137 HA3 GLY 63 1HA GLY 63 7.290 -14.847 -7.996 138 H GLU 64 H GLU 64 6.730 -12.060 -6.355 139 HA GLU 64 HA GLU 64 6.957 -10.379 -8.810 140 HB2 GLU 64 2HB GLU 64 4.745 -10.412 -6.739 141 HB3 GLU 64 1HB GLU 64 4.865 -9.253 -8.065 142 HG2 GLU 64 2HG GLU 64 4.808 -11.129 -9.684 143 HG3 GLU 64 1HG GLU 64 4.625 -12.262 -8.344 144 H VAL 65 H VAL 65 7.675 -8.258 -8.484 145 HA VAL 65 HA VAL 65 8.691 -7.687 -5.740 146 HB VAL 65 HB VAL 65 9.588 -6.481 -8.369 147 HG11 VAL 65 1HG1 VAL 65 11.402 -6.537 -6.058 148 HG12 VAL 65 2HG1 VAL 65 9.954 -5.567 -5.790 149 HG13 VAL 65 3HG1 VAL 65 11.015 -5.208 -7.151 150 HG21 VAL 65 1HG2 VAL 65 10.078 -9.077 -7.247 151 HG22 VAL 65 2HG2 VAL 65 11.570 -8.140 -7.171 152 HG23 VAL 65 3HG2 VAL 65 10.754 -8.376 -8.717 153 H PHE 66 H PHE 66 8.023 -5.858 -4.696 154 HA PHE 66 HA PHE 66 6.223 -4.001 -6.190 155 HB2 PHE 66 2HB PHE 66 6.120 -4.870 -3.288 156 HB3 PHE 66 1HB PHE 66 5.105 -3.607 -3.986 157 HD1 PHE 66 1HD PHE 66 3.173 -4.141 -5.266 158 HD2 PHE 66 2HD PHE 66 5.982 -7.214 -4.222 159 HE1 PHE 66 1HE PHE 66 1.593 -5.863 -6.091 160 HE2 PHE 66 2HE PHE 66 4.403 -8.938 -5.042 161 HZ PHE 66 HZ PHE 66 2.207 -8.264 -5.979 162 H GLU 67 H GLU 67 6.292 -1.744 -5.411 163 HA GLU 67 HA GLU 67 9.014 -1.068 -4.397 164 HB2 GLU 67 2HB GLU 67 8.776 1.050 -5.514 165 HB3 GLU 67 1HB GLU 67 8.282 -0.199 -6.656 166 HG2 GLU 67 2HG GLU 67 5.898 0.192 -5.951 167 HG3 GLU 67 1HG GLU 67 6.461 1.559 -4.986 168 H CYS 68 H CYS 68 9.246 0.438 -2.712 169 HA CYS 68 HA CYS 68 6.777 0.879 -1.083 170 HB2 CYS 68 2HB CYS 68 8.897 -0.412 -0.207 171 HB3 CYS 68 1HB CYS 68 9.580 1.203 -0.035 172 H THR 69 H THR 69 6.627 3.036 -0.028 173 HA THR 69 HA THR 69 8.052 5.124 -1.625 174 HB THR 69 HB THR 69 6.113 6.505 -1.467 175 HG1 THR 69 1HG THR 69 4.654 4.674 0.019 176 HG21 THR 69 1HG2 THR 69 4.983 3.723 -1.811 177 HG22 THR 69 2HG2 THR 69 6.026 4.472 -3.020 178 HG23 THR 69 3HG2 THR 69 4.475 5.209 -2.613 179 H PHE 70 H PHE 70 8.856 6.933 -0.517 180 HA PHE 70 HA PHE 70 8.477 7.179 2.381 181 HB2 PHE 70 2HB PHE 70 10.763 6.858 3.014 182 HB3 PHE 70 1HB PHE 70 10.333 5.455 2.036 183 HD1 PHE 70 1HD PHE 70 11.111 5.266 -0.310 184 HD2 PHE 70 2HD PHE 70 12.335 8.510 2.225 185 HE1 PHE 70 1HE PHE 70 12.943 5.813 -1.892 186 HE2 PHE 70 2HE PHE 70 14.166 9.056 0.644 187 HZ PHE 70 HZ PHE 70 14.470 7.707 -1.414 188 H THR 71 H THR 71 9.528 9.202 3.172 189 HA THR 71 HA THR 71 10.230 11.076 0.966 190 HB THR 71 HB THR 71 8.932 12.595 2.950 191 HG1 THR 71 1HG THR 71 8.079 10.143 3.086 192 HG21 THR 71 1HG2 THR 71 8.138 11.631 0.195 193 HG22 THR 71 2HG2 THR 71 8.843 13.186 0.635 194 HG23 THR 71 3HG2 THR 71 7.186 12.806 1.103 195 H CYS 72 H CYS 72 11.713 12.709 1.551 196 HA CYS 72 HA CYS 72 12.899 12.463 4.279 197 HB2 CYS 72 2HB CYS 72 15.022 13.215 2.670 198 HB3 CYS 72 1HB CYS 72 14.726 11.586 3.265 199 H GLY 73 H GLY 73 14.261 14.506 4.763 200 HA2 GLY 73 2HA GLY 73 12.585 16.820 4.100 201 HA3 GLY 73 1HA GLY 73 13.928 16.810 5.243 202 H ALA 74 H ALA 74 13.953 18.967 3.723 203 HA ALA 74 HA ALA 74 15.386 20.176 2.301 204 HB1 ALA 74 1HB ALA 74 17.001 18.257 3.209 205 HB2 ALA 74 2HB ALA 74 17.494 19.323 1.894 206 HB3 ALA 74 3HB ALA 74 16.883 17.708 1.539 207 H ASP 75 H ASP 75 12.946 18.957 1.372 208 HA ASP 75 HA ASP 75 11.818 18.482 -0.631 209 HB2 ASP 75 2HB ASP 75 14.296 19.827 -1.760 210 HB3 ASP 75 1HB ASP 75 12.838 19.470 -2.686 211 H CYS 76 H CYS 76 13.221 16.352 0.461 212 HA CYS 76 HA CYS 76 14.438 15.015 -1.919 213 HB2 CYS 76 2HB CYS 76 16.056 15.042 -0.198 214 HB3 CYS 76 1HB CYS 76 14.858 14.711 1.043 215 H ARG 77 H ARG 77 13.065 13.602 -2.865 216 HA ARG 77 HA ARG 77 11.299 11.958 -1.112 217 HB2 ARG 77 2HB ARG 77 9.676 12.154 -3.203 218 HB3 ARG 77 1HB ARG 77 9.667 13.390 -1.945 219 HG2 ARG 77 2HG ARG 77 11.630 13.754 -4.152 220 HG3 ARG 77 1HG ARG 77 9.931 13.992 -4.559 221 HD2 ARG 77 2HD ARG 77 9.727 15.567 -2.632 222 HD3 ARG 77 1HD ARG 77 11.457 15.389 -2.339 223 HE ARG 77 HE ARG 77 11.865 16.787 -4.202 224 HH11 ARG 77 1HH1 ARG 77 11.180 18.108 -5.903 225 HH12 ARG 77 2HH1 ARG 77 9.533 18.027 -6.434 226 HH21 ARG 77 1HH2 ARG 77 8.628 15.602 -4.127 227 HH22 ARG 77 2HH2 ARG 77 8.087 16.608 -5.429 228 H GLY 78 H GLY 78 10.974 9.795 -1.925 229 HA2 GLY 78 2HA GLY 78 11.821 8.998 -4.559 230 HA3 GLY 78 1HA GLY 78 13.101 8.658 -3.394 231 H THR 79 H THR 79 12.152 6.490 -4.589 232 HA THR 79 HA THR 79 10.397 5.224 -2.538 233 HB THR 79 HB THR 79 9.368 3.869 -4.305 234 HG1 THR 79 1HG THR 79 9.894 4.760 -6.516 235 HG21 THR 79 1HG2 THR 79 8.377 5.875 -5.662 236 HG22 THR 79 2HG2 THR 79 9.322 6.862 -4.547 237 HG23 THR 79 3HG2 THR 79 8.078 5.776 -3.928 238 H SER 80 H SER 80 10.754 2.857 -2.362 239 HA SER 80 HA SER 80 13.521 2.076 -3.202 240 HB2 SER 80 2HB SER 80 13.754 0.859 -1.117 241 HB3 SER 80 1HB SER 80 13.271 2.509 -0.736 242 HG SER 80 HG SER 80 11.436 1.786 0.002 243 H GLN 81 H GLN 81 13.778 -0.330 -3.404 244 HA GLN 81 HA GLN 81 11.241 -1.560 -4.390 245 HB2 GLN 81 2HB GLN 81 13.047 -1.120 -6.094 246 HB3 GLN 81 1HB GLN 81 14.070 -2.249 -5.210 247 HG2 GLN 81 2HG GLN 81 13.062 -3.536 -6.938 248 HG3 GLN 81 1HG GLN 81 12.178 -3.948 -5.466 249 HE21 GLN 81 1HE2 GLN 81 9.947 -3.572 -5.467 250 HE22 GLN 81 2HE2 GLN 81 9.126 -2.712 -6.674 251 H TYR 82 H TYR 82 10.550 -3.341 -3.296 252 HA TYR 82 HA TYR 82 12.559 -4.991 -1.853 253 HB2 TYR 82 2HB TYR 82 10.110 -3.665 -0.678 254 HB3 TYR 82 1HB TYR 82 10.823 -5.094 0.066 255 HD1 TYR 82 1HD TYR 82 13.553 -4.921 0.198 256 HD2 TYR 82 2HD TYR 82 10.801 -1.621 0.168 257 HE1 TYR 82 1HE TYR 82 15.256 -3.491 1.289 258 HE2 TYR 82 2HE TYR 82 12.507 -0.191 1.261 259 HH TYR 82 HH TYR 82 15.625 -0.761 1.307 260 HA PRO 83 HA PRO 83 10.436 -8.477 -3.538 261 HB2 PRO 83 2HB PRO 83 10.161 -10.008 -1.169 262 HB3 PRO 83 1HB PRO 83 11.490 -10.084 -2.336 263 HG2 PRO 83 2HG PRO 83 11.338 -8.707 0.268 264 HG3 PRO 83 1HG PRO 83 12.737 -9.383 -0.582 265 HD2 PRO 83 2HD PRO 83 12.302 -6.714 -0.422 266 HD3 PRO 83 1HD PRO 83 13.083 -7.458 -1.832 267 H CYS 84 H CYS 84 8.592 -10.177 -2.137 268 HA CYS 84 HA CYS 84 6.167 -8.650 -2.477 269 HB2 CYS 84 2HB CYS 84 5.439 -10.755 -2.788 270 HB3 CYS 84 1HB CYS 84 6.914 -11.414 -2.080 271 H VAL 85 H VAL 85 4.687 -7.952 -0.909 272 HA VAL 85 HA VAL 85 5.625 -8.030 1.928 273 HB VAL 85 HB VAL 85 4.719 -5.724 2.188 274 HG11 VAL 85 1HG1 VAL 85 6.764 -5.915 -0.039 275 HG12 VAL 85 2HG1 VAL 85 7.133 -6.203 1.662 276 HG13 VAL 85 3HG1 VAL 85 6.588 -4.610 1.135 277 HG21 VAL 85 1HG2 VAL 85 4.503 -4.520 -0.139 278 HG22 VAL 85 2HG2 VAL 85 3.132 -5.432 0.491 279 HG23 VAL 85 3HG2 VAL 85 4.174 -6.144 -0.742 280 H GLN 86 H GLN 86 3.767 -7.612 3.473 281 HA GLN 86 HA GLN 86 1.629 -9.401 2.992 282 HB2 GLN 86 2HB GLN 86 1.609 -7.025 4.872 283 HB3 GLN 86 1HB GLN 86 0.585 -8.457 4.971 284 HG2 GLN 86 2HG GLN 86 3.606 -8.423 5.209 285 HG3 GLN 86 1HG GLN 86 2.468 -8.659 6.536 286 HE21 GLN 86 1HE2 GLN 86 4.531 -10.452 4.819 287 HE22 GLN 86 2HE2 GLN 86 3.657 -11.899 4.658 288 H VAL 87 H VAL 87 -0.702 -7.873 3.720 289 HA VAL 87 HA VAL 87 -1.094 -6.296 1.200 290 HB VAL 87 HB VAL 87 -2.270 -8.487 1.182 291 HG11 VAL 87 1HG1 VAL 87 -3.801 -9.106 2.822 292 HG12 VAL 87 2HG1 VAL 87 -4.101 -7.439 3.314 293 HG13 VAL 87 3HG1 VAL 87 -2.608 -8.246 3.796 294 HG21 VAL 87 1HG2 VAL 87 -3.185 -6.428 0.045 295 HG22 VAL 87 2HG2 VAL 87 -4.177 -6.143 1.474 296 HG23 VAL 87 3HG2 VAL 87 -4.424 -7.597 0.505 297 H TYR 88 H TYR 88 -2.272 -4.413 1.322 298 HA TYR 88 HA TYR 88 -3.910 -3.613 3.486 299 HB2 TYR 88 2HB TYR 88 -1.688 -3.541 4.663 300 HB3 TYR 88 1HB TYR 88 -1.203 -2.292 3.541 301 HD1 TYR 88 1HD TYR 88 -0.939 -1.443 6.141 302 HD2 TYR 88 2HD TYR 88 -4.651 -1.657 3.968 303 HE1 TYR 88 1HE TYR 88 -1.928 0.249 7.638 304 HE2 TYR 88 2HE TYR 88 -5.616 0.029 5.465 305 HH TYR 88 HH TYR 88 -5.051 1.681 6.991 306 H VAL 89 H VAL 89 -2.394 -0.819 3.102 307 HA VAL 89 HA VAL 89 -3.437 -0.274 0.369 308 HB VAL 89 HB VAL 89 -5.161 0.368 2.053 309 HG11 VAL 89 1HG1 VAL 89 -3.569 2.673 2.982 310 HG12 VAL 89 2HG1 VAL 89 -3.008 1.112 3.582 311 HG13 VAL 89 3HG1 VAL 89 -4.667 1.627 3.883 312 HG21 VAL 89 1HG2 VAL 89 -4.668 1.637 -0.144 313 HG22 VAL 89 2HG2 VAL 89 -3.904 2.854 0.879 314 HG23 VAL 89 3HG2 VAL 89 -5.617 2.485 1.078 315 H ASN 90 H ASN 90 -2.147 1.083 -0.804 316 HA ASN 90 HA ASN 90 0.332 2.028 0.494 317 HB2 ASN 90 2HB ASN 90 -0.474 2.268 -2.414 318 HB3 ASN 90 1HB ASN 90 1.148 2.358 -1.739 319 HD21 ASN 90 1HD2 ASN 90 0.584 0.070 0.143 320 HD22 ASN 90 2HD2 ASN 90 0.630 -1.322 -0.826 321 H ASN 91 H ASN 91 0.305 4.074 1.332 322 HA ASN 91 HA ASN 91 -1.751 5.969 0.384 323 HB2 ASN 91 2HB ASN 91 0.281 6.147 2.629 324 HB3 ASN 91 1HB ASN 91 -0.922 7.387 2.268 325 HD21 ASN 91 1HD2 ASN 91 -0.918 6.014 4.786 326 HD22 ASN 91 2HD2 ASN 91 -2.313 5.051 4.871 327 H SER 92 H SER 92 -0.845 6.384 -1.714 328 HA SER 92 HA SER 92 1.837 7.594 -1.830 329 HB2 SER 92 2HB SER 92 0.428 7.836 -4.301 330 HB3 SER 92 1HB SER 92 1.804 6.806 -3.927 331 HG SER 92 HG SER 92 0.366 5.243 -3.165 332 H GLU 93 H GLU 93 -0.789 8.775 -0.609 333 HA GLU 93 HA GLU 93 -1.160 11.204 -2.200 334 HB2 GLU 93 2HB GLU 93 -2.767 11.840 -0.534 335 HB3 GLU 93 1HB GLU 93 -2.966 10.104 -0.774 336 HG2 GLU 93 2HG GLU 93 -1.438 9.729 1.193 337 HG3 GLU 93 1HG GLU 93 -1.469 11.469 1.481 338 H SER 94 H SER 94 1.065 10.076 0.076 339 HA SER 94 HA SER 94 2.330 12.721 0.247 340 HB2 SER 94 2HB SER 94 2.356 12.847 2.653 341 HB3 SER 94 1HB SER 94 0.680 12.610 2.168 342 HG SER 94 HG SER 94 0.729 10.607 2.927 343 H ASN 95 H ASN 95 2.957 10.082 -0.882 344 HA ASN 95 HA ASN 95 4.786 8.629 -1.035 345 HB2 ASN 95 2HB ASN 95 6.149 10.642 0.776 346 HB3 ASN 95 1HB ASN 95 6.933 9.476 -0.289 347 HD21 ASN 95 1HD2 ASN 95 5.299 9.775 -2.611 348 HD22 ASN 95 2HD2 ASN 95 5.519 11.342 -3.227 349 H SER 96 H SER 96 2.874 7.927 0.881 350 HA SER 96 HA SER 96 4.598 6.749 3.029 351 HB2 SER 96 2HB SER 96 1.769 7.807 3.211 352 HB3 SER 96 1HB SER 96 2.484 6.768 4.439 353 HG SER 96 HG SER 96 3.642 8.385 5.111 354 H ARG 97 H ARG 97 4.168 4.565 3.543 355 HA ARG 97 HA ARG 97 2.112 3.213 1.861 356 HB2 ARG 97 2HB ARG 97 4.418 2.889 0.917 357 HB3 ARG 97 1HB ARG 97 4.879 2.117 2.434 358 HG2 ARG 97 2HG ARG 97 2.397 1.040 1.283 359 HG3 ARG 97 1HG ARG 97 3.812 0.802 0.258 360 HD2 ARG 97 2HD ARG 97 3.877 0.165 3.206 361 HD3 ARG 97 1HD ARG 97 3.319 -1.015 2.019 362 HE ARG 97 HE ARG 97 6.090 -0.100 2.371 363 HH11 ARG 97 1HH1 ARG 97 7.604 -1.217 1.115 364 HH12 ARG 97 2HH1 ARG 97 7.058 -2.244 -0.168 365 HH21 ARG 97 1HH2 ARG 97 3.698 -1.601 0.394 366 HH22 ARG 97 2HH2 ARG 97 4.847 -2.461 -0.576 367 H ALA 98 H ALA 98 0.698 2.228 3.199 368 HA ALA 98 HA ALA 98 1.600 1.463 5.923 369 HB1 ALA 98 1HB ALA 98 -0.570 1.774 6.620 370 HB2 ALA 98 2HB ALA 98 -1.250 1.192 5.101 371 HB3 ALA 98 3HB ALA 98 -0.605 2.828 5.208 372 H LEU 99 H LEU 99 1.901 -0.668 6.417 373 HA LEU 99 HA LEU 99 0.817 -2.711 4.512 374 HB2 LEU 99 2HB LEU 99 3.271 -2.489 4.362 375 HB3 LEU 99 1HB LEU 99 3.403 -2.798 6.093 376 HG LEU 99 HG LEU 99 2.317 -5.013 5.748 377 HD11 LEU 99 1HD1 LEU 99 2.536 -5.649 3.141 378 HD12 LEU 99 2HD1 LEU 99 2.164 -3.934 2.974 379 HD13 LEU 99 3HD1 LEU 99 1.047 -4.999 3.829 380 HD21 LEU 99 1HD2 LEU 99 4.811 -4.387 4.147 381 HD22 LEU 99 2HD2 LEU 99 4.260 -6.030 4.475 382 HD23 LEU 99 3HD2 LEU 99 4.724 -4.974 5.808 383 H LEU 100 H LEU 100 -0.431 -4.304 5.425 384 HA LEU 100 HA LEU 100 -0.361 -4.590 8.398 385 HB2 LEU 100 2HB LEU 100 -2.673 -4.456 6.483 386 HB3 LEU 100 1HB LEU 100 -2.823 -5.400 7.956 387 HG LEU 100 HG LEU 100 -1.803 -2.570 8.046 388 HD11 LEU 100 1HD1 LEU 100 -4.704 -3.391 8.338 389 HD12 LEU 100 2HD1 LEU 100 -4.044 -2.674 6.869 390 HD13 LEU 100 3HD1 LEU 100 -4.049 -1.755 8.373 391 HD21 LEU 100 1HD2 LEU 100 -2.045 -4.575 9.939 392 HD22 LEU 100 2HD2 LEU 100 -3.508 -3.623 10.189 393 HD23 LEU 100 3HD2 LEU 100 -1.926 -2.852 10.292 394 H HIS 101 H HIS 101 -0.506 -6.744 9.178 395 HA HIS 101 HA HIS 101 0.271 -8.771 7.172 396 HB2 HIS 101 2HB HIS 101 -0.014 -9.193 10.148 397 HB3 HIS 101 1HB HIS 101 0.982 -10.102 9.012 398 HD1 HIS 101 1HD HIS 101 1.982 -7.342 7.585 399 HD2 HIS 101 2HD HIS 101 2.317 -8.363 11.615 400 HE1 HIS 101 1HE HIS 101 3.890 -5.960 8.519 401 HE2 HIS 101 2HE HIS 101 4.101 -6.573 10.971 402 H SER 102 H SER 102 -1.305 -9.964 6.230 403 HA SER 102 HA SER 102 -3.997 -10.059 7.343 404 HB2 SER 102 2HB SER 102 -4.551 -11.365 5.384 405 HB3 SER 102 1HB SER 102 -3.473 -10.071 4.873 406 HG SER 102 HG SER 102 -1.773 -11.538 4.891 407 H ASP 103 H ASP 103 -1.169 -12.127 7.311 408 HA ASP 103 HA ASP 103 -2.187 -13.727 9.494 409 HB2 ASP 103 2HB ASP 103 -2.338 -14.806 6.691 410 HB3 ASP 103 1HB ASP 103 -1.986 -15.901 8.026 411 H GLU 104 H GLU 104 -0.384 -14.304 10.607 412 HA GLU 104 HA GLU 104 2.250 -13.825 9.653 413 HB2 GLU 104 2HB GLU 104 1.605 -14.062 12.068 414 HB3 GLU 104 1HB GLU 104 1.432 -15.798 11.809 415 HG2 GLU 104 2HG GLU 104 3.806 -15.887 11.049 416 HG3 GLU 104 1HG GLU 104 3.963 -14.171 11.433 417 H HIS 105 H HIS 105 0.189 -16.680 9.475 418 HA HIS 105 HA HIS 105 2.095 -18.639 8.799 419 HB2 HIS 105 2HB HIS 105 -0.699 -18.277 7.672 420 HB3 HIS 105 1HB HIS 105 0.255 -19.756 7.561 421 HD1 HIS 105 1HD HIS 105 1.121 -20.642 10.066 422 HD2 HIS 105 2HD HIS 105 -2.280 -18.228 9.936 423 HE1 HIS 105 1HE HIS 105 -0.094 -20.997 12.260 424 HE2 HIS 105 2HE HIS 105 -2.166 -19.533 12.192 425 H GLN 106 H GLN 106 0.570 -16.169 6.751 426 HA GLN 106 HA GLN 106 1.651 -17.052 4.265 427 HB2 GLN 106 2HB GLN 106 0.973 -14.254 5.225 428 HB3 GLN 106 1HB GLN 106 1.311 -14.683 3.551 429 HG2 GLN 106 2HG GLN 106 -0.583 -16.249 3.548 430 HG3 GLN 106 1HG GLN 106 -0.915 -15.862 5.237 431 HE21 GLN 106 1HE2 GLN 106 -2.924 -15.383 3.312 432 HE22 GLN 106 2HE2 GLN 106 -3.115 -13.709 3.105 433 H LEU 107 H LEU 107 2.924 -14.936 6.795 434 HA LEU 107 HA LEU 107 5.307 -14.125 5.446 435 HB2 LEU 107 2HB LEU 107 4.470 -13.097 7.560 436 HB3 LEU 107 1HB LEU 107 4.889 -14.579 8.418 437 HG LEU 107 HG LEU 107 7.258 -14.288 7.644 438 HD11 LEU 107 1HD1 LEU 107 5.978 -12.074 6.203 439 HD12 LEU 107 2HD1 LEU 107 7.528 -12.858 5.907 440 HD13 LEU 107 3HD1 LEU 107 7.405 -11.574 7.109 441 HD21 LEU 107 1HD2 LEU 107 5.801 -12.857 9.649 442 HD22 LEU 107 2HD2 LEU 107 7.051 -11.787 9.011 443 HD23 LEU 107 3HD2 LEU 107 7.493 -13.358 9.680 444 H LEU 108 H LEU 108 4.577 -16.907 7.533 445 HA LEU 108 HA LEU 108 7.230 -18.026 7.456 446 HB2 LEU 108 2HB LEU 108 4.574 -19.448 7.838 447 HB3 LEU 108 1HB LEU 108 6.162 -20.079 8.273 448 HG LEU 108 HG LEU 108 4.825 -17.624 9.450 449 HD11 LEU 108 1HD1 LEU 108 3.856 -19.619 10.373 450 HD12 LEU 108 2HD1 LEU 108 5.025 -19.035 11.557 451 HD13 LEU 108 3HD1 LEU 108 5.435 -20.394 10.511 452 HD21 LEU 108 1HD2 LEU 108 7.089 -17.070 9.538 453 HD22 LEU 108 2HD2 LEU 108 7.602 -18.753 9.634 454 HD23 LEU 108 3HD2 LEU 108 6.903 -17.961 11.047 455 H THR 109 H THR 109 4.457 -18.113 5.338 456 HA THR 109 HA THR 109 5.312 -20.333 3.716 457 HB THR 109 HB THR 109 3.489 -18.012 3.014 458 HG1 THR 109 1HG THR 109 3.211 -20.236 4.619 459 HG21 THR 109 1HG2 THR 109 2.483 -19.845 1.543 460 HG22 THR 109 2HG2 THR 109 3.971 -20.741 1.841 461 HG23 THR 109 3HG2 THR 109 4.031 -19.176 1.033 462 H ASN 110 H ASN 110 5.678 -16.808 3.496 463 HA ASN 110 HA ASN 110 7.821 -17.257 1.468 464 HB2 ASN 110 2HB ASN 110 5.569 -15.241 1.391 465 HB3 ASN 110 1HB ASN 110 7.039 -15.053 0.435 466 HD21 ASN 110 1HD2 ASN 110 4.314 -15.539 -0.628 467 HD22 ASN 110 2HD2 ASN 110 4.389 -17.005 -1.480 468 HA PRO 111 HA PRO 111 9.136 -14.777 5.289 469 HB2 PRO 111 2HB PRO 111 11.609 -16.296 4.608 470 HB3 PRO 111 1HB PRO 111 10.875 -15.994 6.194 471 HG2 PRO 111 2HG PRO 111 10.722 -18.375 4.992 472 HG3 PRO 111 1HG PRO 111 9.409 -17.739 5.996 473 HD2 PRO 111 2HD PRO 111 9.552 -17.995 3.030 474 HD3 PRO 111 1HD PRO 111 8.138 -18.029 4.102 475 H LYS 112 H LYS 112 10.495 -15.409 2.116 476 HA LYS 112 HA LYS 112 12.465 -13.348 2.051 477 HB2 LYS 112 2HB LYS 112 10.801 -14.553 -0.176 478 HB3 LYS 112 1HB LYS 112 12.194 -13.503 -0.434 479 HG2 LYS 112 2HG LYS 112 13.595 -15.115 0.863 480 HG3 LYS 112 1HG LYS 112 12.198 -16.186 0.978 481 HD2 LYS 112 2HD LYS 112 12.083 -16.234 -1.517 482 HD3 LYS 112 1HD LYS 112 13.561 -15.272 -1.571 483 HE2 LYS 112 2HE LYS 112 14.681 -17.071 -0.200 484 HE3 LYS 112 1HE LYS 112 13.230 -18.051 -0.412 485 HZ1 LYS 112 1HZ LYS 112 13.521 -17.964 -2.783 486 HZ2 LYS 112 2HZ LYS 112 14.952 -18.537 -2.067 487 HZ3 LYS 112 3HZ LYS 112 14.860 -16.936 -2.629 488 H CYS 113 H CYS 113 9.015 -13.254 1.926 489 HA CYS 113 HA CYS 113 8.578 -10.854 0.491 490 HB2 CYS 113 2HB CYS 113 7.093 -12.182 2.755 491 HB3 CYS 113 1HB CYS 113 6.519 -10.681 2.029 492 H SER 114 H SER 114 9.560 -11.321 3.886 493 HA SER 114 HA SER 114 10.064 -8.382 3.987 494 HB2 SER 114 2HB SER 114 8.918 -8.074 5.992 495 HB3 SER 114 1HB SER 114 7.869 -9.211 5.149 496 HG SER 114 HG SER 114 9.795 -10.540 6.456 497 H TYR 115 H TYR 115 11.757 -10.994 3.863 498 HA TYR 115 HA TYR 115 13.101 -11.162 6.405 499 HB2 TYR 115 2HB TYR 115 14.566 -12.646 5.383 500 HB3 TYR 115 1HB TYR 115 13.177 -12.770 4.306 501 HD1 TYR 115 1HD TYR 115 16.666 -12.014 4.541 502 HD2 TYR 115 2HD TYR 115 13.131 -11.186 2.260 503 HE1 TYR 115 1HE TYR 115 18.070 -11.273 2.635 504 HE2 TYR 115 2HE TYR 115 14.527 -10.448 0.352 505 HH TYR 115 HH TYR 115 18.018 -10.847 0.372 506 H ILE 116 H ILE 116 13.242 -8.910 3.799 507 HA ILE 116 HA ILE 116 15.809 -7.766 4.777 508 HB ILE 116 HB ILE 116 15.166 -6.136 2.750 509 HG12 ILE 116 2HG1 ILE 116 13.977 -7.375 0.989 510 HG13 ILE 116 1HG1 ILE 116 13.741 -8.732 2.087 511 HG21 ILE 116 1HG2 ILE 116 17.151 -7.216 2.379 512 HG22 ILE 116 2HG2 ILE 116 16.162 -8.164 1.270 513 HG23 ILE 116 3HG2 ILE 116 16.514 -8.781 2.882 514 HD11 ILE 116 1HD1 ILE 116 12.806 -6.005 2.917 515 HD12 ILE 116 2HD1 ILE 116 12.183 -7.586 3.387 516 HD13 ILE 116 3HD1 ILE 116 11.831 -6.942 1.788 517 HA PRO 117 HA PRO 117 14.252 -4.436 7.208 518 HB2 PRO 117 2HB PRO 117 15.254 -2.633 5.035 519 HB3 PRO 117 1HB PRO 117 15.483 -2.514 6.790 520 HG2 PRO 117 2HG PRO 117 17.390 -3.453 5.143 521 HG3 PRO 117 1HG PRO 117 17.193 -4.020 6.808 522 HD2 PRO 117 2HD PRO 117 16.679 -5.461 4.297 523 HD3 PRO 117 1HD PRO 117 16.847 -6.103 5.944 524 HA PRO 118 HA PRO 118 10.533 -3.871 4.561 525 HB2 PRO 118 2HB PRO 118 8.681 -4.264 6.506 526 HB3 PRO 118 1HB PRO 118 9.506 -5.604 5.687 527 HG2 PRO 118 2HG PRO 118 9.945 -4.485 8.391 528 HG3 PRO 118 1HG PRO 118 10.118 -6.147 7.809 529 HD2 PRO 118 2HD PRO 118 12.222 -4.336 8.224 530 HD3 PRO 118 1HD PRO 118 12.320 -5.840 7.287 531 H CYS 119 H CYS 119 9.129 -2.068 4.334 532 HA CYS 119 HA CYS 119 9.684 0.168 6.211 533 HB2 CYS 119 2HB CYS 119 8.382 1.415 4.271 534 HB3 CYS 119 1HB CYS 119 10.079 0.988 4.063 535 H LYS 120 H LYS 120 8.183 0.238 7.829 536 HA LYS 120 HA LYS 120 5.327 -0.298 7.096 537 HB2 LYS 120 2HB LYS 120 6.762 -0.690 9.739 538 HB3 LYS 120 1HB LYS 120 5.037 -0.948 9.481 539 HG2 LYS 120 2HG LYS 120 5.582 -2.642 7.739 540 HG3 LYS 120 1HG LYS 120 7.294 -2.425 8.098 541 HD2 LYS 120 2HD LYS 120 6.829 -3.066 10.471 542 HD3 LYS 120 1HD LYS 120 5.161 -3.411 10.013 543 HE2 LYS 120 2HE LYS 120 5.886 -5.501 9.541 544 HE3 LYS 120 1HE LYS 120 6.625 -4.789 8.107 545 HZ1 LYS 120 1HZ LYS 120 7.856 -5.542 10.658 546 HZ2 LYS 120 2HZ LYS 120 8.508 -4.222 9.809 547 HZ3 LYS 120 3HZ LYS 120 8.433 -5.752 9.076 548 H ARG 121 H ARG 121 3.848 1.283 7.597 549 HA ARG 121 HA ARG 121 4.759 3.938 8.233 550 HB2 ARG 121 2HB ARG 121 2.640 3.303 6.973 551 HB3 ARG 121 1HB ARG 121 1.939 2.876 8.530 552 HG2 ARG 121 2HG ARG 121 2.311 5.153 9.358 553 HG3 ARG 121 1HG ARG 121 3.075 5.600 7.830 554 HD2 ARG 121 2HD ARG 121 0.782 6.357 7.747 555 HD3 ARG 121 1HD ARG 121 0.925 4.971 6.667 556 HE ARG 121 HE ARG 121 0.126 3.781 8.989 557 HH11 ARG 121 1HH1 ARG 121 -2.023 3.586 9.665 558 HH12 ARG 121 2HH1 ARG 121 -3.194 4.742 9.129 559 HH21 ARG 121 1HH2 ARG 121 -0.921 6.569 7.251 560 HH22 ARG 121 2HH2 ARG 121 -2.571 6.431 7.761 561 H GLU 122 H GLU 122 3.152 1.399 10.077 562 HA GLU 122 HA GLU 122 3.906 2.824 12.592 563 HB2 GLU 122 2HB GLU 122 1.414 1.147 12.200 564 HB3 GLU 122 1HB GLU 122 1.822 2.138 13.600 565 HG2 GLU 122 2HG GLU 122 1.784 4.155 12.119 566 HG3 GLU 122 1HG GLU 122 1.227 3.126 10.798 567 H ASN 123 H ASN 123 3.586 1.039 14.488 568 HA ASN 123 HA ASN 123 5.580 -0.945 14.096 569 HB2 ASN 123 2HB ASN 123 3.262 -1.005 16.061 570 HB3 ASN 123 1HB ASN 123 4.748 -1.946 16.187 571 HD21 ASN 123 1HD2 ASN 123 4.128 1.520 15.406 572 HD22 ASN 123 2HD2 ASN 123 5.185 2.128 16.587 573 H GLN 124 H GLN 124 2.079 -1.014 13.724 574 HA GLN 124 HA GLN 124 0.664 -2.587 12.713 575 HB2 GLN 124 2HB GLN 124 3.239 -3.185 11.231 576 HB3 GLN 124 1HB GLN 124 1.634 -3.722 10.729 577 HG2 GLN 124 2HG GLN 124 0.878 -1.444 10.459 578 HG3 GLN 124 1HG GLN 124 2.359 -0.815 11.176 579 HE21 GLN 124 1HE2 GLN 124 1.653 0.043 8.592 580 HE22 GLN 124 2HE2 GLN 124 2.720 -0.635 7.459 581 H LYS 125 H LYS 125 1.475 -3.472 15.172 582 HA LYS 125 HA LYS 125 2.834 -5.965 15.260 583 HB2 LYS 125 2HB LYS 125 1.787 -6.286 17.419 584 HB3 LYS 125 1HB LYS 125 2.164 -4.571 17.251 585 HG2 LYS 125 2HG LYS 125 -0.187 -4.188 16.464 586 HG3 LYS 125 1HG LYS 125 -0.538 -5.879 16.821 587 HD2 LYS 125 2HD LYS 125 0.301 -5.420 19.185 588 HD3 LYS 125 1HD LYS 125 0.262 -3.707 18.766 589 HE2 LYS 125 2HE LYS 125 -2.198 -4.432 17.915 590 HE3 LYS 125 1HE LYS 125 -1.985 -5.594 19.225 591 HZ1 LYS 125 1HZ LYS 125 -1.090 -3.048 20.047 592 HZ2 LYS 125 2HZ LYS 125 -2.338 -4.001 20.700 593 HZ3 LYS 125 3HZ LYS 125 -2.667 -2.913 19.436 594 H ASN 126 H ASN 126 1.176 -7.895 16.271 595 HA ASN 126 HA ASN 126 -0.457 -8.583 13.884 596 HB2 ASN 126 2HB ASN 126 0.571 -10.236 16.202 597 HB3 ASN 126 1HB ASN 126 -0.484 -10.871 14.941 598 HD21 ASN 126 1HD2 ASN 126 0.583 -9.653 12.643 599 HD22 ASN 126 2HD2 ASN 126 2.185 -10.168 12.415 600 H LEU 127 H LEU 127 -2.667 -8.586 13.998 601 HA LEU 127 HA LEU 127 -3.974 -8.946 16.609 602 HB2 LEU 127 2HB LEU 127 -3.467 -6.432 16.165 603 HB3 LEU 127 1HB LEU 127 -4.754 -6.546 14.966 604 HG LEU 127 HG LEU 127 -6.258 -7.469 16.750 605 HD11 LEU 127 1HD1 LEU 127 -3.728 -7.357 18.222 606 HD12 LEU 127 2HD1 LEU 127 -5.205 -8.246 18.598 607 HD13 LEU 127 3HD1 LEU 127 -5.045 -6.557 19.082 608 HD21 LEU 127 1HD2 LEU 127 -6.732 -5.324 17.734 609 HD22 LEU 127 2HD2 LEU 127 -6.120 -5.015 16.109 610 HD23 LEU 127 3HD2 LEU 127 -5.067 -4.788 17.504 611 H GLU 128 H GLU 128 -6.024 -9.841 16.403 612 HA GLU 128 HA GLU 128 -6.706 -11.153 13.968 613 HB2 GLU 128 2HB GLU 128 -8.450 -10.452 16.350 614 HB3 GLU 128 1HB GLU 128 -8.904 -11.578 15.070 615 HG2 GLU 128 2HG GLU 128 -6.905 -12.955 15.601 616 HG3 GLU 128 1HG GLU 128 -6.520 -11.854 16.924 617 H SER 129 H SER 129 -7.488 -7.968 15.194 618 HA SER 129 HA SER 129 -9.745 -7.367 13.591 619 HB2 SER 129 2HB SER 129 -7.501 -5.472 14.343 620 HB3 SER 129 1HB SER 129 -9.145 -5.022 13.896 621 HG SER 129 HG SER 129 -9.447 -5.169 15.982 622 H VAL 130 H VAL 130 -6.299 -7.399 12.820 623 HA VAL 130 HA VAL 130 -6.468 -6.086 10.290 624 HB VAL 130 HB VAL 130 -4.567 -8.254 11.235 625 HG11 VAL 130 1HG1 VAL 130 -4.392 -8.261 8.876 626 HG12 VAL 130 2HG1 VAL 130 -3.121 -7.151 9.390 627 HG13 VAL 130 3HG1 VAL 130 -4.645 -6.519 8.765 628 HG21 VAL 130 1HG2 VAL 130 -3.073 -6.098 11.300 629 HG22 VAL 130 2HG2 VAL 130 -4.198 -6.401 12.624 630 HG23 VAL 130 3HG2 VAL 130 -4.616 -5.246 11.358 631 H MET 131 H MET 131 -6.975 -9.474 11.243 632 HA MET 131 HA MET 131 -7.150 -10.597 8.644 633 HB2 MET 131 2HB MET 131 -7.185 -11.954 10.724 634 HB3 MET 131 1HB MET 131 -8.793 -11.328 11.089 635 HG2 MET 131 2HG MET 131 -8.775 -12.306 8.389 636 HG3 MET 131 1HG MET 131 -8.129 -13.556 9.452 637 HE1 MET 131 1HE MET 131 -10.900 -13.003 7.645 638 HE2 MET 131 2HE MET 131 -11.158 -11.424 8.378 639 HE3 MET 131 3HE MET 131 -12.345 -12.702 8.618 640 H ASN 132 H ASN 132 -9.566 -8.906 10.611 641 HA ASN 132 HA ASN 132 -11.810 -9.301 8.923 642 HB2 ASN 132 2HB ASN 132 -11.062 -6.975 10.697 643 HB3 ASN 132 1HB ASN 132 -12.635 -7.160 9.940 644 HD21 ASN 132 1HD2 ASN 132 -12.373 -7.150 12.789 645 HD22 ASN 132 2HD2 ASN 132 -12.747 -8.701 13.370 646 H TRP 133 H TRP 133 -9.216 -6.895 8.813 647 HA TRP 133 HA TRP 133 -10.289 -5.228 6.788 648 HB2 TRP 133 2HB TRP 133 -8.387 -4.242 7.578 649 HB3 TRP 133 1HB TRP 133 -7.587 -5.784 7.866 650 HD1 TRP 133 HD TRP 133 -6.459 -7.004 5.735 651 HE1 TRP 133 1HE TRP 133 -5.527 -6.025 3.541 652 HE3 TRP 133 3HE TRP 133 -8.632 -2.385 5.835 653 HZ2 TRP 133 2HZ TRP 133 -5.684 -3.605 2.028 654 HZ3 TRP 133 3HZ TRP 133 -8.219 -0.768 4.006 655 HH2 TRP 133 HH TRP 133 -6.750 -1.370 2.108 656 H GLN 134 H GLN 134 -8.375 -8.220 6.511 657 HA GLN 134 HA GLN 134 -8.075 -8.134 3.686 658 HB2 GLN 134 2HB GLN 134 -7.118 -10.194 3.909 659 HB3 GLN 134 1HB GLN 134 -7.166 -9.797 5.623 660 HG2 GLN 134 2HG GLN 134 -8.098 -11.967 5.482 661 HG3 GLN 134 1HG GLN 134 -9.493 -10.907 5.634 662 HE21 GLN 134 1HE2 GLN 134 -11.095 -11.752 4.289 663 HE22 GLN 134 2HE2 GLN 134 -10.847 -12.264 2.693 664 H GLN 135 H GLN 135 -10.684 -9.279 5.742 665 HA GLN 135 HA GLN 135 -12.269 -10.421 3.615 666 HB2 GLN 135 2HB GLN 135 -12.492 -10.927 6.085 667 HB3 GLN 135 1HB GLN 135 -13.246 -9.344 6.270 668 HG2 GLN 135 2HG GLN 135 -15.019 -10.947 6.011 669 HG3 GLN 135 1HG GLN 135 -14.917 -10.037 4.502 670 HE21 GLN 135 1HE2 GLN 135 -15.568 -11.667 3.014 671 HE22 GLN 135 2HE2 GLN 135 -14.737 -13.133 2.811 672 H TYR 136 H TYR 136 -12.021 -7.209 5.061 673 HA TYR 136 HA TYR 136 -14.404 -6.074 4.047 674 HB2 TYR 136 2HB TYR 136 -13.012 -4.917 5.680 675 HB3 TYR 136 1HB TYR 136 -11.722 -4.745 4.489 676 HD1 TYR 136 1HD TYR 136 -14.886 -3.425 5.695 677 HD2 TYR 136 2HD TYR 136 -12.130 -3.402 2.398 678 HE1 TYR 136 1HE TYR 136 -15.960 -1.371 4.810 679 HE2 TYR 136 2HE TYR 136 -13.201 -1.350 1.513 680 HH TYR 136 HH TYR 136 -15.935 0.179 3.228 681 H TRP 137 H TRP 137 -11.133 -5.910 2.498 682 HA TRP 137 HA TRP 137 -12.425 -4.759 0.133 683 HB2 TRP 137 2HB TRP 137 -10.122 -4.769 -0.849 684 HB3 TRP 137 1HB TRP 137 -10.244 -3.891 0.670 685 HD1 TRP 137 HD TRP 137 -8.702 -4.620 2.573 686 HE1 TRP 137 1HE TRP 137 -7.017 -6.539 2.914 687 HE3 TRP 137 3HE TRP 137 -9.710 -7.403 -1.557 688 HZ2 TRP 137 2HZ TRP 137 -6.208 -8.952 1.600 689 HZ3 TRP 137 3HZ TRP 137 -8.479 -9.510 -2.004 690 HH2 TRP 137 HH TRP 137 -6.727 -10.285 -0.429 691 H LYS 138 H LYS 138 -11.259 -7.926 1.119 692 HA LYS 138 HA LYS 138 -11.156 -9.120 -1.471 693 HB2 LYS 138 2HB LYS 138 -10.374 -10.223 0.638 694 HB3 LYS 138 1HB LYS 138 -12.061 -10.433 1.107 695 HG2 LYS 138 2HG LYS 138 -12.458 -11.728 -0.977 696 HG3 LYS 138 1HG LYS 138 -10.748 -11.570 -1.378 697 HD2 LYS 138 2HD LYS 138 -10.186 -12.693 0.789 698 HD3 LYS 138 1HD LYS 138 -11.911 -12.958 1.053 699 HE2 LYS 138 2HE LYS 138 -11.363 -14.958 0.027 700 HE3 LYS 138 1HE LYS 138 -11.770 -13.994 -1.393 701 HZ1 LYS 138 1HZ LYS 138 -9.729 -14.833 -1.965 702 HZ2 LYS 138 2HZ LYS 138 -9.127 -14.782 -0.377 703 HZ3 LYS 138 3HZ LYS 138 -9.276 -13.350 -1.278 704 H ASP 139 H ASP 139 -13.865 -8.751 0.805 705 HA ASP 139 HA ASP 139 -15.780 -10.051 -0.920 706 HB2 ASP 139 2HB ASP 139 -16.146 -8.108 1.374 707 HB3 ASP 139 1HB ASP 139 -17.465 -8.970 0.584 708 H GLU 140 H GLU 140 -14.950 -6.626 -0.341 709 HA GLU 140 HA GLU 140 -16.937 -5.676 -2.239 710 HB2 GLU 140 2HB GLU 140 -14.561 -4.291 -0.962 711 HB3 GLU 140 1HB GLU 140 -15.791 -3.480 -1.935 712 HG2 GLU 140 2HG GLU 140 -17.534 -4.265 -0.346 713 HG3 GLU 140 1HG GLU 140 -16.273 -4.996 0.648 714 H ILE 141 H ILE 141 -13.374 -5.857 -2.276 715 HA ILE 141 HA ILE 141 -13.543 -6.109 -5.224 716 HB ILE 141 HB ILE 141 -11.439 -4.643 -5.310 717 HG12 ILE 141 2HG1 ILE 141 -12.371 -3.264 -2.870 718 HG13 ILE 141 1HG1 ILE 141 -11.595 -4.818 -2.579 719 HG21 ILE 141 1HG2 ILE 141 -14.254 -3.812 -4.807 720 HG22 ILE 141 2HG2 ILE 141 -13.243 -3.552 -6.228 721 HG23 ILE 141 3HG2 ILE 141 -13.031 -2.542 -4.796 722 HD11 ILE 141 1HD1 ILE 141 -10.335 -2.811 -4.434 723 HD12 ILE 141 2HD1 ILE 141 -9.570 -4.137 -3.558 724 HD13 ILE 141 3HD1 ILE 141 -10.095 -2.694 -2.691 725 H GLY 142 H GLY 142 -12.626 -8.038 -5.694 726 HA2 GLY 142 2HA GLY 142 -10.882 -9.443 -3.895 727 HA3 GLY 142 1HA GLY 142 -11.169 -9.879 -5.580 728 H SER 143 H SER 143 -9.022 -8.292 -3.387 729 HA SER 143 HA SER 143 -7.019 -7.077 -3.759 730 HB2 SER 143 2HB SER 143 -5.558 -8.465 -5.423 731 HB3 SER 143 1HB SER 143 -6.067 -9.209 -3.911 732 HG SER 143 HG SER 143 -7.837 -10.111 -5.085 733 H GLN 144 H GLN 144 -8.426 -5.341 -4.882 734 HA GLN 144 HA GLN 144 -7.528 -5.079 -7.717 735 HB2 GLN 144 2HB GLN 144 -10.099 -5.434 -7.090 736 HB3 GLN 144 1HB GLN 144 -10.013 -3.695 -6.817 737 HG2 GLN 144 2HG GLN 144 -9.075 -3.388 -9.086 738 HG3 GLN 144 1HG GLN 144 -9.193 -5.127 -9.361 739 HE21 GLN 144 1HE2 GLN 144 -10.841 -2.251 -9.888 740 HE22 GLN 144 2HE2 GLN 144 -12.411 -2.873 -10.062 741 HA PRO 145 HA PRO 145 -5.637 -1.655 -5.191 742 HB2 PRO 145 2HB PRO 145 -3.875 -1.670 -7.583 743 HB3 PRO 145 1HB PRO 145 -3.443 -1.673 -5.866 744 HG2 PRO 145 2HG PRO 145 -3.198 -3.844 -7.424 745 HG3 PRO 145 1HG PRO 145 -3.571 -3.940 -5.698 746 HD2 PRO 145 2HD PRO 145 -5.359 -4.397 -8.032 747 HD3 PRO 145 1HD PRO 145 -5.442 -5.081 -6.395 748 H PHE 146 H PHE 146 -5.658 0.666 -5.695 749 HA PHE 146 HA PHE 146 -6.653 1.379 -8.381 750 HB2 PHE 146 2HB PHE 146 -8.375 2.873 -7.373 751 HB3 PHE 146 1HB PHE 146 -8.688 1.163 -7.098 752 HD1 PHE 146 1HD PHE 146 -7.522 0.230 -4.815 753 HD2 PHE 146 2HD PHE 146 -8.626 4.311 -5.605 754 HE1 PHE 146 1HE PHE 146 -7.632 0.679 -2.383 755 HE2 PHE 146 2HE PHE 146 -8.736 4.751 -3.171 756 HZ PHE 146 HZ PHE 146 -8.236 2.936 -1.559 757 H THR 147 H THR 147 -6.337 3.612 -8.927 758 HA THR 147 HA THR 147 -4.297 4.952 -7.209 759 HB THR 147 HB THR 147 -3.279 5.832 -9.213 760 HG1 THR 147 1HG THR 147 -4.666 4.427 -11.045 761 HG21 THR 147 1HG2 THR 147 -3.275 3.322 -10.442 762 HG22 THR 147 2HG2 THR 147 -3.596 2.989 -8.740 763 HG23 THR 147 3HG2 THR 147 -2.154 3.891 -9.204 764 H CYS 148 H CYS 148 -4.380 7.273 -7.263 765 HA CYS 148 HA CYS 148 -6.932 8.422 -8.205 766 HB2 CYS 148 2HB CYS 148 -6.007 9.381 -5.561 767 HB3 CYS 148 1HB CYS 148 -7.635 8.995 -6.102 768 H TYR 149 H TYR 149 -6.804 10.765 -8.444 769 HA TYR 149 HA TYR 149 -4.032 11.890 -8.344 770 HB2 TYR 149 2HB TYR 149 -5.926 12.006 -10.713 771 HB3 TYR 149 1HB TYR 149 -4.496 13.015 -10.550 772 HD1 TYR 149 1HD TYR 149 -5.658 9.479 -10.769 773 HD2 TYR 149 2HD TYR 149 -2.324 12.172 -11.004 774 HE1 TYR 149 1HE TYR 149 -4.246 7.651 -11.664 775 HE2 TYR 149 2HE TYR 149 -0.908 10.342 -11.896 776 HH TYR 149 HH TYR 149 -2.145 7.028 -12.161 777 H PHE 150 H PHE 150 -4.058 13.949 -7.459 778 HA PHE 150 HA PHE 150 -6.613 15.423 -7.529 779 HB2 PHE 150 2HB PHE 150 -7.155 14.982 -5.391 780 HB3 PHE 150 1HB PHE 150 -5.773 13.894 -5.293 781 HD1 PHE 150 1HD PHE 150 -7.161 17.031 -4.251 782 HD2 PHE 150 2HD PHE 150 -3.487 14.879 -4.752 783 HE1 PHE 150 1HE PHE 150 -6.043 18.615 -2.710 784 HE2 PHE 150 2HE PHE 150 -2.346 16.449 -3.222 785 HZ PHE 150 HZ PHE 150 -3.624 18.324 -2.188 786 H ASN 151 H ASN 151 -6.397 17.673 -7.217 787 HA ASN 151 HA ASN 151 -3.640 18.691 -6.782 788 HB2 ASN 151 2HB ASN 151 -3.825 20.138 -8.772 789 HB3 ASN 151 1HB ASN 151 -3.888 18.434 -9.204 790 HD21 ASN 151 1HD2 ASN 151 -5.778 17.668 -10.247 791 HD22 ASN 151 2HD2 ASN 151 -7.141 18.633 -10.546 792 H GLN 152 H GLN 152 -3.824 20.141 -5.195 793 HA GLN 152 HA GLN 152 -6.306 21.690 -4.791 794 HB2 GLN 152 2HB GLN 152 -5.240 20.708 -2.808 795 HB3 GLN 152 1HB GLN 152 -3.734 21.540 -3.183 796 HG2 GLN 152 2HG GLN 152 -4.825 23.711 -2.884 797 HG3 GLN 152 1HG GLN 152 -6.371 22.917 -2.594 798 HE21 GLN 152 1HE2 GLN 152 -5.515 24.535 -0.548 799 HE22 GLN 152 2HE2 GLN 152 -4.926 23.615 0.751 800 H HIS 153 H HIS 153 -3.122 22.028 -6.123 801 HA HIS 153 HA HIS 153 -2.612 24.759 -5.774 802 HB2 HIS 153 2HB HIS 153 -1.133 24.610 -7.624 803 HB3 HIS 153 1HB HIS 153 -1.133 23.007 -6.897 804 HD1 HIS 153 1HD HIS 153 -3.035 24.846 -9.658 805 HD2 HIS 153 2HD HIS 153 -1.636 21.024 -8.737 806 HE1 HIS 153 1HE HIS 153 -3.546 23.391 -11.670 807 HE2 HIS 153 2HE HIS 153 -2.695 21.065 -11.122 808 H GLN 154 H GLN 154 -5.060 23.255 -7.769 809 HA GLN 154 HA GLN 154 -5.494 25.526 -9.499 810 HB2 GLN 154 2HB GLN 154 -7.361 23.303 -8.618 811 HB3 GLN 154 1HB GLN 154 -7.730 24.471 -9.883 812 HG2 GLN 154 2HG GLN 154 -5.752 23.723 -11.157 813 HG3 GLN 154 1HG GLN 154 -5.391 22.545 -9.893 814 HE21 GLN 154 1HE2 GLN 154 -5.909 21.656 -12.541 815 HE22 GLN 154 2HE2 GLN 154 -7.394 20.834 -12.565 816 H ARG 155 H ARG 155 -7.507 24.325 -6.805 817 HA ARG 155 HA ARG 155 -7.567 26.864 -5.471 818 HB2 ARG 155 2HB ARG 155 -9.329 26.751 -7.651 819 HB3 ARG 155 1HB ARG 155 -10.340 26.451 -6.240 820 HG2 ARG 155 2HG ARG 155 -10.321 28.808 -6.448 821 HG3 ARG 155 1HG ARG 155 -9.173 28.463 -5.158 822 HD2 ARG 155 2HD ARG 155 -8.412 30.149 -6.924 823 HD3 ARG 155 1HD ARG 155 -7.300 28.825 -6.591 824 HE ARG 155 HE ARG 155 -9.037 28.097 -8.756 825 HH11 ARG 155 1HH1 ARG 155 -8.189 28.164 -10.851 826 HH12 ARG 155 2HH1 ARG 155 -6.758 29.088 -11.162 827 HH21 ARG 155 1HH2 ARG 155 -6.415 30.159 -7.881 828 HH22 ARG 155 2HH2 ARG 155 -5.754 30.218 -9.480 829 HA PRO 156 HA PRO 156 -10.176 23.719 -3.150 830 HB2 PRO 156 2HB PRO 156 -11.772 22.000 -4.429 831 HB3 PRO 156 1HB PRO 156 -12.101 23.741 -4.485 832 HG2 PRO 156 2HG PRO 156 -11.096 21.968 -6.604 833 HG3 PRO 156 1HG PRO 156 -11.908 23.536 -6.733 834 HD2 PRO 156 2HD PRO 156 -9.034 22.963 -6.775 835 HD3 PRO 156 1HD PRO 156 -9.866 24.487 -7.137 836 H ASP 157 H ASP 157 -10.509 20.990 -5.167 837 HA ASP 157 HA ASP 157 -7.968 19.724 -4.742 838 HB2 ASP 157 2HB ASP 157 -8.685 18.110 -2.990 839 HB3 ASP 157 1HB ASP 157 -8.682 19.766 -2.389 840 H ASP 158 H ASP 158 -8.778 19.464 -7.055 841 HA ASP 158 HA ASP 158 -11.043 17.862 -7.708 842 HB2 ASP 158 2HB ASP 158 -8.377 18.144 -9.133 843 HB3 ASP 158 1HB ASP 158 -9.789 17.347 -9.828 844 H VAL 159 H VAL 159 -11.157 15.534 -8.131 845 HA VAL 159 HA VAL 159 -8.871 13.970 -7.016 846 HB VAL 159 HB VAL 159 -10.409 12.582 -5.714 847 HG11 VAL 159 1HG1 VAL 159 -9.542 15.044 -5.031 848 HG12 VAL 159 2HG1 VAL 159 -10.525 14.051 -3.953 849 HG13 VAL 159 3HG1 VAL 159 -11.282 15.315 -4.922 850 HG21 VAL 159 1HG2 VAL 159 -12.403 14.181 -7.230 851 HG22 VAL 159 2HG2 VAL 159 -12.799 13.857 -5.542 852 HG23 VAL 159 3HG2 VAL 159 -12.501 12.518 -6.650 853 H LEU 160 H LEU 160 -8.643 11.878 -7.859 854 HA LEU 160 HA LEU 160 -10.490 11.126 -10.094 855 HB2 LEU 160 2HB LEU 160 -8.178 11.995 -10.822 856 HB3 LEU 160 1HB LEU 160 -7.528 10.545 -10.067 857 HG LEU 160 HG LEU 160 -9.061 9.168 -11.488 858 HD11 LEU 160 1HD1 LEU 160 -10.827 10.423 -12.246 859 HD12 LEU 160 2HD1 LEU 160 -9.743 10.689 -13.612 860 HD13 LEU 160 3HD1 LEU 160 -9.871 11.902 -12.340 861 HD21 LEU 160 1HD2 LEU 160 -6.819 10.837 -12.451 862 HD22 LEU 160 2HD2 LEU 160 -7.822 10.145 -13.725 863 HD23 LEU 160 3HD2 LEU 160 -7.043 9.091 -12.545 864 H LEU 161 H LEU 161 -10.850 8.815 -10.260 865 HA LEU 161 HA LEU 161 -9.647 7.207 -8.045 866 HB2 LEU 161 2HB LEU 161 -12.001 7.962 -7.522 867 HB3 LEU 161 1HB LEU 161 -12.539 6.989 -8.893 868 HG LEU 161 HG LEU 161 -10.997 5.162 -7.641 869 HD11 LEU 161 1HD1 LEU 161 -10.459 6.768 -5.814 870 HD12 LEU 161 2HD1 LEU 161 -11.302 5.337 -5.223 871 HD13 LEU 161 3HD1 LEU 161 -12.175 6.856 -5.418 872 HD21 LEU 161 1HD2 LEU 161 -13.322 4.824 -8.294 873 HD22 LEU 161 2HD2 LEU 161 -13.874 5.876 -6.991 874 HD23 LEU 161 3HD2 LEU 161 -13.119 4.327 -6.615 875 H HIS 162 H HIS 162 -8.358 6.740 -10.236 876 HA HIS 162 HA HIS 162 -9.661 4.947 -12.114 877 HB2 HIS 162 2HB HIS 162 -6.759 5.581 -11.535 878 HB3 HIS 162 1HB HIS 162 -7.242 4.403 -12.754 879 HD1 HIS 162 1HD HIS 162 -5.842 6.599 -14.035 880 HD2 HIS 162 2HD HIS 162 -9.880 7.004 -13.062 881 HE1 HIS 162 1HE HIS 162 -6.753 8.454 -15.503 882 HE2 HIS 162 2HE HIS 162 -9.209 8.706 -14.919 883 H ARG 163 H ARG 163 -9.284 2.618 -12.250 884 HA ARG 163 HA ARG 163 -8.594 1.409 -9.595 885 HB2 ARG 163 2HB ARG 163 -10.547 0.449 -11.705 886 HB3 ARG 163 1HB ARG 163 -10.155 -0.421 -10.221 887 HG2 ARG 163 2HG ARG 163 -10.930 1.534 -8.896 888 HG3 ARG 163 1HG ARG 163 -11.385 2.345 -10.396 889 HD2 ARG 163 2HD ARG 163 -13.378 1.313 -9.526 890 HD3 ARG 163 1HD ARG 163 -12.861 0.352 -10.910 891 HE ARG 163 HE ARG 163 -12.438 -1.439 -9.433 892 HH11 ARG 163 1HH1 ARG 163 -12.361 -2.379 -7.379 893 HH12 ARG 163 2HH1 ARG 163 -12.451 -1.366 -5.975 894 HH21 ARG 163 1HH2 ARG 163 -12.701 1.578 -7.787 895 HH22 ARG 163 2HH2 ARG 163 -12.643 0.873 -6.207 896 H THR 164 H THR 164 -7.507 -0.658 -9.641 897 HA THR 164 HA THR 164 -5.727 -0.949 -11.986 898 HB THR 164 HB THR 164 -5.668 -2.521 -9.401 899 HG1 THR 164 1HG THR 164 -5.303 0.046 -9.717 900 HG21 THR 164 1HG2 THR 164 -3.339 -1.837 -11.170 901 HG22 THR 164 2HG2 THR 164 -4.391 -3.188 -11.586 902 HG23 THR 164 3HG2 THR 164 -3.524 -3.185 -10.050 903 H HIS 165 H HIS 165 -5.720 -2.770 -13.309 904 HA HIS 165 HA HIS 165 -7.988 -4.673 -12.889 905 HB2 HIS 165 2HB HIS 165 -6.527 -3.931 -15.442 906 HB3 HIS 165 1HB HIS 165 -7.872 -5.065 -15.324 907 HD1 HIS 165 1HD HIS 165 -10.146 -3.952 -14.223 908 HD2 HIS 165 2HD HIS 165 -7.345 -1.319 -15.841 909 HE1 HIS 165 1HE HIS 165 -11.356 -1.756 -14.594 910 HE2 HIS 165 2HE HIS 165 -9.661 -0.146 -15.579 911 H ASP 166 H ASP 166 -7.526 -6.850 -12.744 912 HA ASP 166 HA ASP 166 -4.750 -7.627 -12.343 913 HB2 ASP 166 2HB ASP 166 -7.315 -9.243 -12.446 914 HB3 ASP 166 1HB ASP 166 -5.739 -9.915 -12.025 Start of MODEL 16 1 H1 GLN 45 1HT GLN 45 4.971 12.760 -3.482 2 H2 GLN 45 2HT GLN 45 5.279 14.288 -2.804 3 H3 GLN 45 3HT GLN 45 5.878 12.886 -2.054 4 HA GLN 45 HA GLN 45 7.771 13.425 -3.112 5 HB2 GLN 45 2HB GLN 45 6.109 12.239 -5.356 6 HB3 GLN 45 1HB GLN 45 7.867 12.379 -5.376 7 HG2 GLN 45 2HG GLN 45 8.023 10.969 -3.370 8 HG3 GLN 45 1HG GLN 45 6.264 10.851 -3.306 9 HE21 GLN 45 1HE2 GLN 45 7.818 8.492 -3.571 10 HE22 GLN 45 2HE2 GLN 45 7.581 7.846 -5.125 11 H ASP 46 H ASP 46 4.960 14.615 -4.903 12 HA ASP 46 HA ASP 46 6.472 16.426 -6.574 13 HB2 ASP 46 2HB ASP 46 3.545 16.391 -5.782 14 HB3 ASP 46 1HB ASP 46 4.232 17.471 -6.997 15 H LEU 47 H LEU 47 6.943 18.599 -6.232 16 HA LEU 47 HA LEU 47 7.289 19.534 -3.569 17 HB2 LEU 47 2HB LEU 47 7.045 21.185 -6.104 18 HB3 LEU 47 1HB LEU 47 7.797 21.700 -4.593 19 HG LEU 47 HG LEU 47 8.717 19.399 -6.342 20 HD11 LEU 47 1HD1 LEU 47 9.977 22.089 -5.726 21 HD12 LEU 47 2HD1 LEU 47 9.224 21.640 -7.256 22 HD13 LEU 47 3HD1 LEU 47 10.690 20.821 -6.723 23 HD21 LEU 47 1HD2 LEU 47 9.343 18.719 -4.203 24 HD22 LEU 47 2HD2 LEU 47 9.481 20.373 -3.608 25 HD23 LEU 47 3HD2 LEU 47 10.733 19.706 -4.654 26 H GLN 48 H GLN 48 4.602 19.783 -5.803 27 HA GLN 48 HA GLN 48 3.033 21.144 -3.656 28 HB2 GLN 48 2HB GLN 48 1.826 22.378 -5.476 29 HB3 GLN 48 1HB GLN 48 3.526 22.826 -5.342 30 HG2 GLN 48 2HG GLN 48 3.936 22.132 -7.442 31 HG3 GLN 48 1HG GLN 48 3.229 20.551 -7.103 32 HE21 GLN 48 1HE2 GLN 48 1.247 20.103 -8.085 33 HE22 GLN 48 2HE2 GLN 48 0.265 21.258 -8.846 34 H ALA 49 H ALA 49 0.622 20.830 -4.035 35 HA ALA 49 HA ALA 49 -0.000 18.064 -4.236 36 HB1 ALA 49 1HB ALA 49 -1.503 19.478 -3.038 37 HB2 ALA 49 2HB ALA 49 -2.390 18.908 -4.452 38 HB3 ALA 49 3HB ALA 49 -1.720 20.540 -4.429 39 H THR 50 H THR 50 -0.866 16.823 -5.890 40 HA THR 50 HA THR 50 -1.760 17.773 -8.422 41 HB THR 50 HB THR 50 1.067 16.671 -8.425 42 HG1 THR 50 1HG THR 50 1.493 18.693 -8.057 43 HG21 THR 50 1HG2 THR 50 0.869 16.421 -10.666 44 HG22 THR 50 2HG2 THR 50 -0.000 17.942 -10.845 45 HG23 THR 50 3HG2 THR 50 -0.871 16.480 -10.389 46 H GLU 51 H GLU 51 0.324 15.125 -7.259 47 HA GLU 51 HA GLU 51 -1.757 13.213 -8.214 48 HB2 GLU 51 2HB GLU 51 1.226 12.803 -7.949 49 HB3 GLU 51 1HB GLU 51 0.071 11.624 -8.569 50 HG2 GLU 51 2HG GLU 51 -0.543 13.233 -10.376 51 HG3 GLU 51 1HG GLU 51 0.706 14.326 -9.786 52 H ALA 52 H ALA 52 -2.452 11.654 -6.846 53 HA ALA 52 HA ALA 52 -1.019 11.060 -4.340 54 HB1 ALA 52 1HB ALA 52 -3.920 11.960 -4.343 55 HB2 ALA 52 2HB ALA 52 -2.577 12.968 -3.799 56 HB3 ALA 52 3HB ALA 52 -2.972 11.480 -2.935 57 H ASN 53 H ASN 53 -0.908 8.826 -4.696 58 HA ASN 53 HA ASN 53 -3.331 7.590 -5.876 59 HB2 ASN 53 2HB ASN 53 -0.511 6.544 -5.705 60 HB3 ASN 53 1HB ASN 53 -1.871 5.611 -6.322 61 HD21 ASN 53 1HD2 ASN 53 -3.227 7.903 -7.611 62 HD22 ASN 53 2HD2 ASN 53 -2.281 8.334 -8.954 63 H CYS 54 H CYS 54 -4.490 6.002 -4.928 64 HA CYS 54 HA CYS 54 -3.644 5.167 -2.189 65 HB2 CYS 54 2HB CYS 54 -6.526 5.376 -2.527 66 HB3 CYS 54 1HB CYS 54 -5.508 6.098 -1.288 67 H THR 55 H THR 55 -3.099 3.044 -2.812 68 HA THR 55 HA THR 55 -5.312 1.556 -4.154 69 HB THR 55 HB THR 55 -3.942 1.057 -5.858 70 HG1 THR 55 1HG THR 55 -2.425 -0.402 -5.472 71 HG21 THR 55 1HG2 THR 55 -1.731 2.470 -4.341 72 HG22 THR 55 2HG2 THR 55 -2.943 3.303 -5.311 73 HG23 THR 55 3HG2 THR 55 -1.810 2.193 -6.079 74 H VAL 56 H VAL 56 -5.564 -0.608 -3.690 75 HA VAL 56 HA VAL 56 -4.416 -1.460 -1.087 76 HB VAL 56 HB VAL 56 -6.806 -2.388 -2.699 77 HG11 VAL 56 1HG1 VAL 56 -5.164 -3.811 -0.696 78 HG12 VAL 56 2HG1 VAL 56 -6.282 -4.454 -1.899 79 HG13 VAL 56 3HG1 VAL 56 -6.897 -3.821 -0.372 80 HG21 VAL 56 1HG2 VAL 56 -6.477 -0.473 -0.686 81 HG22 VAL 56 2HG2 VAL 56 -7.127 -1.884 0.152 82 HG23 VAL 56 3HG2 VAL 56 -8.004 -1.185 -1.209 83 H LEU 57 H LEU 57 -2.638 -2.701 -1.309 84 HA LEU 57 HA LEU 57 -1.590 -3.665 -3.704 85 HB2 LEU 57 2HB LEU 57 -0.495 -3.580 -1.390 86 HB3 LEU 57 1HB LEU 57 -1.270 -5.134 -1.092 87 HG LEU 57 HG LEU 57 -0.191 -5.995 -3.199 88 HD11 LEU 57 1HD1 LEU 57 1.987 -4.272 -3.454 89 HD12 LEU 57 2HD1 LEU 57 0.603 -3.189 -3.329 90 HD13 LEU 57 3HD1 LEU 57 0.645 -4.424 -4.587 91 HD21 LEU 57 1HD2 LEU 57 0.974 -6.746 -1.351 92 HD22 LEU 57 2HD2 LEU 57 1.293 -5.115 -0.760 93 HD23 LEU 57 3HD2 LEU 57 2.231 -5.766 -2.105 94 H SER 58 H SER 58 -1.485 -5.838 -4.579 95 HA SER 58 HA SER 58 -4.067 -7.257 -4.296 96 HB2 SER 58 2HB SER 58 -3.250 -6.690 -6.582 97 HB3 SER 58 1HB SER 58 -1.806 -7.654 -6.287 98 HG SER 58 HG SER 58 -3.396 -8.861 -7.375 99 H VAL 59 H VAL 59 -4.053 -9.557 -3.792 100 HA VAL 59 HA VAL 59 -1.690 -10.285 -2.163 101 HB VAL 59 HB VAL 59 -4.274 -11.836 -2.443 102 HG11 VAL 59 1HG1 VAL 59 -2.256 -11.620 -0.188 103 HG12 VAL 59 2HG1 VAL 59 -2.308 -12.936 -1.362 104 HG13 VAL 59 3HG1 VAL 59 -3.653 -12.696 -0.245 105 HG21 VAL 59 1HG2 VAL 59 -3.624 -9.634 -0.453 106 HG22 VAL 59 2HG2 VAL 59 -5.113 -10.575 -0.517 107 HG23 VAL 59 3HG2 VAL 59 -4.723 -9.452 -1.819 108 H GLN 60 H GLN 60 -0.131 -11.472 -3.097 109 HA GLN 60 HA GLN 60 -0.886 -13.650 -4.958 110 HB2 GLN 60 2HB GLN 60 1.183 -11.519 -5.581 111 HB3 GLN 60 1HB GLN 60 0.882 -12.960 -6.553 112 HG2 GLN 60 2HG GLN 60 -1.445 -12.230 -6.925 113 HG3 GLN 60 1HG GLN 60 -1.149 -10.788 -5.953 114 HE21 GLN 60 1HE2 GLN 60 -1.934 -10.240 -8.502 115 HE22 GLN 60 2HE2 GLN 60 -0.624 -9.747 -9.463 116 H GLN 61 H GLN 61 0.825 -15.262 -5.166 117 HA GLN 61 HA GLN 61 2.244 -15.728 -2.698 118 HB2 GLN 61 2HB GLN 61 2.688 -17.045 -5.389 119 HB3 GLN 61 1HB GLN 61 3.143 -17.693 -3.817 120 HG2 GLN 61 2HG GLN 61 0.328 -17.165 -4.810 121 HG3 GLN 61 1HG GLN 61 1.070 -18.744 -4.543 122 HE21 GLN 61 1HE2 GLN 61 -0.939 -16.487 -3.096 123 HE22 GLN 61 2HE2 GLN 61 -0.711 -16.934 -1.478 124 H ILE 62 H ILE 62 4.648 -16.068 -2.627 125 HA ILE 62 HA ILE 62 6.110 -13.755 -3.099 126 HB ILE 62 HB ILE 62 6.690 -16.133 -1.968 127 HG12 ILE 62 2HG1 ILE 62 8.792 -14.227 -3.040 128 HG13 ILE 62 1HG1 ILE 62 7.813 -13.926 -1.603 129 HG21 ILE 62 1HG2 ILE 62 8.477 -16.095 -4.401 130 HG22 ILE 62 2HG2 ILE 62 7.010 -17.071 -4.337 131 HG23 ILE 62 3HG2 ILE 62 8.313 -17.362 -3.188 132 HD11 ILE 62 1HD1 ILE 62 9.591 -16.350 -1.970 133 HD12 ILE 62 2HD1 ILE 62 8.711 -15.896 -0.511 134 HD13 ILE 62 3HD1 ILE 62 10.056 -14.904 -1.074 135 H GLY 63 H GLY 63 8.179 -13.801 -4.651 136 HA2 GLY 63 2HA GLY 63 9.037 -14.203 -6.871 137 HA3 GLY 63 1HA GLY 63 7.455 -14.831 -7.338 138 H GLU 64 H GLU 64 6.773 -12.166 -5.592 139 HA GLU 64 HA GLU 64 6.724 -10.431 -8.019 140 HB2 GLU 64 2HB GLU 64 4.493 -11.101 -7.086 141 HB3 GLU 64 1HB GLU 64 4.929 -10.289 -5.581 142 HG2 GLU 64 2HG GLU 64 3.626 -8.736 -6.898 143 HG3 GLU 64 1HG GLU 64 5.301 -8.182 -6.915 144 H VAL 65 H VAL 65 7.526 -8.319 -7.821 145 HA VAL 65 HA VAL 65 8.883 -7.712 -5.231 146 HB VAL 65 HB VAL 65 10.461 -6.360 -6.555 147 HG11 VAL 65 1HG1 VAL 65 11.709 -8.166 -7.326 148 HG12 VAL 65 2HG1 VAL 65 10.302 -8.981 -8.006 149 HG13 VAL 65 3HG1 VAL 65 10.565 -8.986 -6.263 150 HG21 VAL 65 1HG2 VAL 65 10.304 -6.709 -9.105 151 HG22 VAL 65 2HG2 VAL 65 9.144 -5.595 -8.381 152 HG23 VAL 65 3HG2 VAL 65 8.645 -7.232 -8.810 153 H PHE 66 H PHE 66 8.462 -5.754 -4.262 154 HA PHE 66 HA PHE 66 6.599 -3.909 -5.692 155 HB2 PHE 66 2HB PHE 66 6.661 -4.611 -2.744 156 HB3 PHE 66 1HB PHE 66 5.603 -3.405 -3.475 157 HD1 PHE 66 1HD PHE 66 3.833 -4.084 -5.076 158 HD2 PHE 66 2HD PHE 66 6.244 -6.975 -3.009 159 HE1 PHE 66 1HE PHE 66 2.209 -5.861 -5.667 160 HE2 PHE 66 2HE PHE 66 4.619 -8.752 -3.599 161 HZ PHE 66 HZ PHE 66 2.600 -8.195 -4.927 162 H GLU 67 H GLU 67 6.825 -1.635 -5.063 163 HA GLU 67 HA GLU 67 9.573 -1.029 -4.048 164 HB2 GLU 67 2HB GLU 67 9.590 0.918 -5.465 165 HB3 GLU 67 1HB GLU 67 9.076 -0.444 -6.458 166 HG2 GLU 67 2HG GLU 67 6.689 0.215 -6.012 167 HG3 GLU 67 1HG GLU 67 7.292 1.661 -5.202 168 H CYS 68 H CYS 68 9.802 0.800 -2.659 169 HA CYS 68 HA CYS 68 7.264 1.587 -1.282 170 HB2 CYS 68 2HB CYS 68 9.045 0.318 0.045 171 HB3 CYS 68 1HB CYS 68 10.064 1.743 -0.139 172 H THR 69 H THR 69 7.235 3.875 -0.503 173 HA THR 69 HA THR 69 8.828 5.629 -2.323 174 HB THR 69 HB THR 69 6.989 7.096 -2.467 175 HG1 THR 69 1HG THR 69 5.156 6.178 -0.872 176 HG21 THR 69 1HG2 THR 69 6.695 4.585 -3.328 177 HG22 THR 69 2HG2 THR 69 5.395 5.768 -3.474 178 HG23 THR 69 3HG2 THR 69 5.381 4.602 -2.151 179 H PHE 70 H PHE 70 9.676 7.573 -1.446 180 HA PHE 70 HA PHE 70 9.348 8.131 1.419 181 HB2 PHE 70 2HB PHE 70 11.687 7.891 1.995 182 HB3 PHE 70 1HB PHE 70 11.149 6.368 1.290 183 HD1 PHE 70 1HD PHE 70 13.269 9.318 0.854 184 HD2 PHE 70 2HD PHE 70 11.777 5.755 -1.028 185 HE1 PHE 70 1HE PHE 70 15.023 9.504 -0.890 186 HE2 PHE 70 2HE PHE 70 13.530 5.943 -2.772 187 HZ PHE 70 HZ PHE 70 15.153 7.817 -2.702 188 H THR 71 H THR 71 10.594 10.171 1.985 189 HA THR 71 HA THR 71 11.131 11.838 -0.428 190 HB THR 71 HB THR 71 10.099 13.570 1.526 191 HG1 THR 71 1HG THR 71 9.261 11.568 2.449 192 HG21 THR 71 1HG2 THR 71 8.149 13.657 -0.119 193 HG22 THR 71 2HG2 THR 71 8.970 12.374 -1.010 194 HG23 THR 71 3HG2 THR 71 9.749 13.943 -0.804 195 H CYS 72 H CYS 72 12.651 13.558 -0.063 196 HA CYS 72 HA CYS 72 14.153 13.358 2.511 197 HB2 CYS 72 2HB CYS 72 15.785 12.393 1.250 198 HB3 CYS 72 1HB CYS 72 15.106 12.984 -0.260 199 H GLY 73 H GLY 73 15.504 15.364 2.876 200 HA2 GLY 73 2HA GLY 73 13.848 17.718 2.306 201 HA3 GLY 73 1HA GLY 73 15.244 17.671 3.384 202 H ALA 74 H ALA 74 14.352 19.349 0.944 203 HA ALA 74 HA ALA 74 15.832 20.793 -0.302 204 HB1 ALA 74 1HB ALA 74 17.657 18.445 -0.796 205 HB2 ALA 74 2HB ALA 74 17.837 19.469 0.634 206 HB3 ALA 74 3HB ALA 74 18.000 20.161 -0.976 207 H ASP 75 H ASP 75 13.564 19.324 -1.046 208 HA ASP 75 HA ASP 75 12.410 18.602 -2.950 209 HB2 ASP 75 2HB ASP 75 14.747 19.997 -4.291 210 HB3 ASP 75 1HB ASP 75 13.288 19.464 -5.123 211 H CYS 76 H CYS 76 13.970 16.636 -1.754 212 HA CYS 76 HA CYS 76 15.055 15.152 -4.123 213 HB2 CYS 76 2HB CYS 76 16.190 13.868 -2.042 214 HB3 CYS 76 1HB CYS 76 16.942 15.265 -2.810 215 H ARG 77 H ARG 77 13.579 13.622 -4.690 216 HA ARG 77 HA ARG 77 12.317 12.039 -2.498 217 HB2 ARG 77 2HB ARG 77 10.277 11.945 -4.114 218 HB3 ARG 77 1HB ARG 77 10.511 13.403 -3.149 219 HG2 ARG 77 2HG ARG 77 11.893 13.334 -5.779 220 HG3 ARG 77 1HG ARG 77 10.135 13.466 -5.825 221 HD2 ARG 77 2HD ARG 77 10.270 15.393 -4.247 222 HD3 ARG 77 1HD ARG 77 12.029 15.295 -4.317 223 HE ARG 77 HE ARG 77 10.272 16.312 -6.442 224 HH11 ARG 77 1HH1 ARG 77 11.363 17.240 -8.189 225 HH12 ARG 77 2HH1 ARG 77 13.071 17.007 -8.348 226 HH21 ARG 77 1HH2 ARG 77 13.344 15.078 -5.479 227 HH22 ARG 77 2HH2 ARG 77 14.193 15.784 -6.815 228 H GLY 78 H GLY 78 11.834 9.832 -3.111 229 HA2 GLY 78 2HA GLY 78 12.407 8.843 -5.771 230 HA3 GLY 78 1HA GLY 78 13.743 8.512 -4.666 231 H THR 79 H THR 79 12.733 6.270 -5.525 232 HA THR 79 HA THR 79 10.896 5.338 -3.366 233 HB THR 79 HB THR 79 9.875 3.785 -4.952 234 HG1 THR 79 1HG THR 79 11.682 4.986 -6.774 235 HG21 THR 79 1HG2 THR 79 8.488 5.335 -5.931 236 HG22 THR 79 2HG2 THR 79 9.827 6.341 -6.485 237 HG23 THR 79 3HG2 THR 79 9.325 6.393 -4.795 238 H SER 80 H SER 80 11.164 3.026 -2.848 239 HA SER 80 HA SER 80 13.963 2.096 -3.362 240 HB2 SER 80 2HB SER 80 12.187 1.552 -0.963 241 HB3 SER 80 1HB SER 80 13.828 0.954 -1.182 242 HG SER 80 HG SER 80 14.124 3.438 -1.568 243 H GLN 81 H GLN 81 14.189 -0.304 -3.433 244 HA GLN 81 HA GLN 81 11.728 -1.565 -4.561 245 HB2 GLN 81 2HB GLN 81 13.664 -1.284 -6.130 246 HB3 GLN 81 1HB GLN 81 14.613 -2.320 -5.070 247 HG2 GLN 81 2HG GLN 81 13.740 -3.735 -6.794 248 HG3 GLN 81 1HG GLN 81 12.805 -4.077 -5.337 249 HE21 GLN 81 1HE2 GLN 81 10.564 -3.733 -5.433 250 HE22 GLN 81 2HE2 GLN 81 9.772 -3.003 -6.739 251 H TYR 82 H TYR 82 10.862 -3.121 -3.304 252 HA TYR 82 HA TYR 82 12.674 -4.618 -1.447 253 HB2 TYR 82 2HB TYR 82 10.212 -3.112 -0.940 254 HB3 TYR 82 1HB TYR 82 10.134 -4.766 -0.337 255 HD1 TYR 82 1HD TYR 82 12.952 -2.306 -0.631 256 HD2 TYR 82 2HD TYR 82 10.572 -4.773 1.956 257 HE1 TYR 82 1HE TYR 82 14.385 -1.672 1.290 258 HE2 TYR 82 2HE TYR 82 12.005 -4.139 3.878 259 HH TYR 82 HH TYR 82 13.617 -2.739 4.584 260 HA PRO 83 HA PRO 83 11.124 -8.348 -3.205 261 HB2 PRO 83 2HB PRO 83 10.872 -9.949 -0.967 262 HB3 PRO 83 1HB PRO 83 12.415 -9.561 -1.743 263 HG2 PRO 83 2HG PRO 83 11.182 -8.418 0.700 264 HG3 PRO 83 1HG PRO 83 12.883 -8.750 0.337 265 HD2 PRO 83 2HD PRO 83 11.784 -6.238 0.235 266 HD3 PRO 83 1HD PRO 83 13.184 -6.733 -0.740 267 H CYS 84 H CYS 84 9.353 -10.230 -1.779 268 HA CYS 84 HA CYS 84 6.813 -9.109 -2.547 269 HB2 CYS 84 2HB CYS 84 6.462 -11.342 -2.610 270 HB3 CYS 84 1HB CYS 84 7.827 -11.654 -1.535 271 H VAL 85 H VAL 85 5.153 -8.284 -1.232 272 HA VAL 85 HA VAL 85 5.818 -7.932 1.662 273 HB VAL 85 HB VAL 85 4.703 -5.696 1.527 274 HG11 VAL 85 1HG1 VAL 85 6.620 -4.575 0.566 275 HG12 VAL 85 2HG1 VAL 85 7.038 -6.007 -0.374 276 HG13 VAL 85 3HG1 VAL 85 7.185 -6.032 1.384 277 HG21 VAL 85 1HG2 VAL 85 3.539 -5.180 -0.329 278 HG22 VAL 85 2HG2 VAL 85 4.069 -6.676 -1.098 279 HG23 VAL 85 3HG2 VAL 85 5.036 -5.211 -1.258 280 H GLN 86 H GLN 86 3.859 -7.475 2.987 281 HA GLN 86 HA GLN 86 1.807 -9.415 2.415 282 HB2 GLN 86 2HB GLN 86 1.745 -7.192 4.469 283 HB3 GLN 86 1HB GLN 86 0.828 -8.702 4.498 284 HG2 GLN 86 2HG GLN 86 3.853 -8.495 4.575 285 HG3 GLN 86 1HG GLN 86 2.827 -8.836 5.962 286 HE21 GLN 86 1HE2 GLN 86 4.846 -10.461 4.057 287 HE22 GLN 86 2HE2 GLN 86 4.031 -11.939 3.887 288 H VAL 87 H VAL 87 -0.527 -7.961 3.285 289 HA VAL 87 HA VAL 87 -0.959 -6.216 0.888 290 HB VAL 87 HB VAL 87 -2.104 -8.400 0.715 291 HG11 VAL 87 1HG1 VAL 87 -2.557 -7.988 3.459 292 HG12 VAL 87 2HG1 VAL 87 -3.169 -9.317 2.476 293 HG13 VAL 87 3HG1 VAL 87 -4.147 -7.867 2.704 294 HG21 VAL 87 1HG2 VAL 87 -4.276 -7.513 0.137 295 HG22 VAL 87 2HG2 VAL 87 -3.086 -6.261 -0.212 296 HG23 VAL 87 3HG2 VAL 87 -4.073 -6.157 1.245 297 H TYR 88 H TYR 88 -2.155 -4.357 1.143 298 HA TYR 88 HA TYR 88 -3.765 -3.702 3.378 299 HB2 TYR 88 2HB TYR 88 -1.566 -3.712 4.552 300 HB3 TYR 88 1HB TYR 88 -1.017 -2.451 3.471 301 HD1 TYR 88 1HD TYR 88 -4.475 -1.788 4.040 302 HD2 TYR 88 2HD TYR 88 -0.635 -1.598 5.986 303 HE1 TYR 88 1HE TYR 88 -5.347 -0.112 5.605 304 HE2 TYR 88 2HE TYR 88 -1.532 0.092 7.552 305 HH TYR 88 HH TYR 88 -4.739 1.476 7.133 306 H VAL 89 H VAL 89 -2.260 -0.862 3.115 307 HA VAL 89 HA VAL 89 -3.386 -0.201 0.438 308 HB VAL 89 HB VAL 89 -5.041 0.364 2.225 309 HG11 VAL 89 1HG1 VAL 89 -4.532 1.966 3.899 310 HG12 VAL 89 2HG1 VAL 89 -3.054 2.471 3.080 311 HG13 VAL 89 3HG1 VAL 89 -3.127 0.899 3.876 312 HG21 VAL 89 1HG2 VAL 89 -5.018 1.650 0.145 313 HG22 VAL 89 2HG2 VAL 89 -3.727 2.679 0.765 314 HG23 VAL 89 3HG2 VAL 89 -5.332 2.740 1.497 315 H ASN 90 H ASN 90 -2.159 1.203 -0.725 316 HA ASN 90 HA ASN 90 0.348 2.158 0.512 317 HB2 ASN 90 2HB ASN 90 -0.635 2.222 -2.357 318 HB3 ASN 90 1HB ASN 90 0.962 2.727 -1.822 319 HD21 ASN 90 1HD2 ASN 90 0.011 0.161 0.129 320 HD22 ASN 90 2HD2 ASN 90 0.755 -1.104 -0.721 321 H ASN 91 H ASN 91 0.299 4.181 1.405 322 HA ASN 91 HA ASN 91 -1.790 6.070 0.494 323 HB2 ASN 91 2HB ASN 91 0.151 6.179 2.821 324 HB3 ASN 91 1HB ASN 91 -1.050 7.420 2.465 325 HD21 ASN 91 1HD2 ASN 91 -1.133 5.948 4.921 326 HD22 ASN 91 2HD2 ASN 91 -2.516 4.967 4.912 327 H SER 92 H SER 92 -0.815 6.586 -1.548 328 HA SER 92 HA SER 92 1.862 7.804 -1.557 329 HB2 SER 92 2HB SER 92 -0.175 7.571 -3.774 330 HB3 SER 92 1HB SER 92 1.506 8.044 -3.968 331 HG SER 92 HG SER 92 0.676 5.585 -2.817 332 H GLU 93 H GLU 93 -0.278 9.055 0.017 333 HA GLU 93 HA GLU 93 -1.341 11.353 -1.338 334 HB2 GLU 93 2HB GLU 93 -0.624 11.119 1.602 335 HB3 GLU 93 1HB GLU 93 -1.825 12.195 0.884 336 HG2 GLU 93 2HG GLU 93 -3.090 10.188 0.099 337 HG3 GLU 93 1HG GLU 93 -1.928 9.168 0.953 338 H SER 94 H SER 94 1.777 10.478 -0.382 339 HA SER 94 HA SER 94 2.919 12.975 -1.306 340 HB2 SER 94 2HB SER 94 3.746 13.865 0.693 341 HB3 SER 94 1HB SER 94 2.157 13.293 1.199 342 HG SER 94 HG SER 94 3.077 11.570 2.161 343 H ASN 95 H ASN 95 3.454 10.023 0.623 344 HA ASN 95 HA ASN 95 5.183 8.724 -1.120 345 HB2 ASN 95 2HB ASN 95 7.412 9.333 0.192 346 HB3 ASN 95 1HB ASN 95 6.875 10.315 -1.166 347 HD21 ASN 95 1HD2 ASN 95 6.824 10.155 2.413 348 HD22 ASN 95 2HD2 ASN 95 6.595 11.821 2.642 349 H SER 96 H SER 96 3.279 8.094 0.952 350 HA SER 96 HA SER 96 5.043 6.514 2.801 351 HB2 SER 96 2HB SER 96 3.171 6.651 4.448 352 HB3 SER 96 1HB SER 96 3.876 8.223 4.074 353 HG SER 96 HG SER 96 2.032 7.892 2.289 354 H ARG 97 H ARG 97 4.485 4.359 3.132 355 HA ARG 97 HA ARG 97 2.092 3.347 1.683 356 HB2 ARG 97 2HB ARG 97 3.946 2.809 0.236 357 HB3 ARG 97 1HB ARG 97 4.888 2.193 1.594 358 HG2 ARG 97 2HG ARG 97 3.655 0.245 1.755 359 HG3 ARG 97 1HG ARG 97 2.196 0.990 1.103 360 HD2 ARG 97 2HD ARG 97 3.077 -0.551 -0.549 361 HD3 ARG 97 1HD ARG 97 3.316 1.095 -1.135 362 HE ARG 97 HE ARG 97 5.646 0.745 -0.981 363 HH11 ARG 97 1HH1 ARG 97 7.468 -0.495 -0.480 364 HH12 ARG 97 2HH1 ARG 97 7.289 -1.919 0.487 365 HH21 ARG 97 1HH2 ARG 97 3.858 -1.567 0.848 366 HH22 ARG 97 2HH2 ARG 97 5.245 -2.526 1.239 367 H ALA 98 H ALA 98 0.836 2.167 3.016 368 HA ALA 98 HA ALA 98 1.994 1.264 5.595 369 HB1 ALA 98 1HB ALA 98 -0.265 2.649 5.160 370 HB2 ALA 98 2HB ALA 98 -0.101 1.521 6.505 371 HB3 ALA 98 3HB ALA 98 -0.917 1.016 5.026 372 H LEU 99 H LEU 99 2.333 -0.878 5.972 373 HA LEU 99 HA LEU 99 1.125 -2.847 4.068 374 HB2 LEU 99 2HB LEU 99 3.140 -4.273 4.674 375 HB3 LEU 99 1HB LEU 99 3.491 -2.838 3.711 376 HG LEU 99 HG LEU 99 3.537 -2.123 6.490 377 HD11 LEU 99 1HD1 LEU 99 5.570 -3.527 7.078 378 HD12 LEU 99 2HD1 LEU 99 5.164 -4.552 5.700 379 HD13 LEU 99 3HD1 LEU 99 4.039 -4.403 7.051 380 HD21 LEU 99 1HD2 LEU 99 5.870 -1.488 5.887 381 HD22 LEU 99 2HD2 LEU 99 4.699 -0.926 4.695 382 HD23 LEU 99 3HD2 LEU 99 5.686 -2.349 4.359 383 H LEU 100 H LEU 100 -0.082 -4.456 4.970 384 HA LEU 100 HA LEU 100 0.000 -4.738 7.951 385 HB2 LEU 100 2HB LEU 100 -2.106 -3.705 7.067 386 HB3 LEU 100 1HB LEU 100 -2.379 -5.168 6.121 387 HG LEU 100 HG LEU 100 -2.277 -6.488 8.266 388 HD11 LEU 100 1HD1 LEU 100 -2.855 -4.876 10.288 389 HD12 LEU 100 2HD1 LEU 100 -1.949 -3.705 9.331 390 HD13 LEU 100 3HD1 LEU 100 -1.177 -5.202 9.854 391 HD21 LEU 100 1HD2 LEU 100 -4.535 -5.572 9.096 392 HD22 LEU 100 2HD2 LEU 100 -4.452 -6.059 7.405 393 HD23 LEU 100 3HD2 LEU 100 -4.371 -4.351 7.833 394 H HIS 101 H HIS 101 0.047 -6.857 8.753 395 HA HIS 101 HA HIS 101 0.713 -8.921 6.746 396 HB2 HIS 101 2HB HIS 101 0.925 -8.780 9.756 397 HB3 HIS 101 1HB HIS 101 1.207 -10.277 8.867 398 HD1 HIS 101 1HD HIS 101 2.215 -6.844 7.643 399 HD2 HIS 101 2HD HIS 101 4.012 -10.321 9.088 400 HE1 HIS 101 1HE HIS 101 4.705 -6.575 7.264 401 HE2 HIS 101 2HE HIS 101 5.811 -8.680 8.153 402 H SER 102 H SER 102 -0.899 -10.166 5.971 403 HA SER 102 HA SER 102 -3.513 -10.267 7.189 404 HB2 SER 102 2HB SER 102 -2.329 -12.164 5.143 405 HB3 SER 102 1HB SER 102 -4.040 -11.908 5.471 406 HG SER 102 HG SER 102 -3.906 -9.900 4.605 407 H ASP 103 H ASP 103 -0.706 -12.441 7.148 408 HA ASP 103 HA ASP 103 -1.366 -13.557 9.711 409 HB2 ASP 103 2HB ASP 103 -3.113 -14.624 8.128 410 HB3 ASP 103 1HB ASP 103 -1.755 -15.529 7.463 411 H GLU 104 H GLU 104 0.239 -15.121 10.386 412 HA GLU 104 HA GLU 104 2.835 -14.697 9.212 413 HB2 GLU 104 2HB GLU 104 1.864 -16.726 11.249 414 HB3 GLU 104 1HB GLU 104 3.556 -16.441 10.851 415 HG2 GLU 104 2HG GLU 104 3.294 -14.064 11.519 416 HG3 GLU 104 1HG GLU 104 1.626 -14.397 11.979 417 H HIS 105 H HIS 105 0.345 -17.137 8.824 418 HA HIS 105 HA HIS 105 1.861 -19.242 7.721 419 HB2 HIS 105 2HB HIS 105 -0.507 -19.491 8.258 420 HB3 HIS 105 1HB HIS 105 -0.935 -18.314 7.016 421 HD1 HIS 105 1HD HIS 105 0.721 -21.733 7.324 422 HD2 HIS 105 2HD HIS 105 -1.237 -19.385 4.492 423 HE1 HIS 105 1HE HIS 105 0.427 -23.189 5.268 424 HE2 HIS 105 2HE HIS 105 -0.767 -21.769 3.536 425 H GLN 106 H GLN 106 0.554 -16.325 6.153 426 HA GLN 106 HA GLN 106 1.279 -17.047 3.489 427 HB2 GLN 106 2HB GLN 106 1.059 -14.321 4.797 428 HB3 GLN 106 1HB GLN 106 1.227 -14.583 3.063 429 HG2 GLN 106 2HG GLN 106 -0.847 -15.925 3.064 430 HG3 GLN 106 1HG GLN 106 -1.024 -15.635 4.795 431 HE21 GLN 106 1HE2 GLN 106 -3.101 -14.742 3.188 432 HE22 GLN 106 2HE2 GLN 106 -3.063 -13.050 3.058 433 H LEU 107 H LEU 107 3.053 -15.419 6.084 434 HA LEU 107 HA LEU 107 5.389 -14.748 4.604 435 HB2 LEU 107 2HB LEU 107 4.942 -13.936 6.907 436 HB3 LEU 107 1HB LEU 107 5.174 -15.574 7.518 437 HG LEU 107 HG LEU 107 7.491 -15.546 6.561 438 HD11 LEU 107 1HD1 LEU 107 8.064 -12.855 6.329 439 HD12 LEU 107 2HD1 LEU 107 6.490 -12.976 5.543 440 HD13 LEU 107 3HD1 LEU 107 7.839 -13.962 4.975 441 HD21 LEU 107 1HD2 LEU 107 6.460 -14.215 8.863 442 HD22 LEU 107 2HD2 LEU 107 7.783 -13.233 8.229 443 HD23 LEU 107 3HD2 LEU 107 8.062 -14.923 8.648 444 H LEU 108 H LEU 108 4.513 -17.706 6.391 445 HA LEU 108 HA LEU 108 6.942 -19.124 5.845 446 HB2 LEU 108 2HB LEU 108 5.182 -19.804 7.532 447 HB3 LEU 108 1HB LEU 108 4.165 -20.300 6.180 448 HG LEU 108 HG LEU 108 6.026 -21.809 5.417 449 HD11 LEU 108 1HD1 LEU 108 8.053 -21.379 6.329 450 HD12 LEU 108 2HD1 LEU 108 7.459 -22.211 7.765 451 HD13 LEU 108 3HD1 LEU 108 7.346 -20.456 7.655 452 HD21 LEU 108 1HD2 LEU 108 4.798 -23.345 6.514 453 HD22 LEU 108 2HD2 LEU 108 4.221 -22.104 7.627 454 HD23 LEU 108 3HD2 LEU 108 5.700 -22.994 7.989 455 H THR 109 H THR 109 3.948 -18.628 4.089 456 HA THR 109 HA THR 109 4.485 -20.519 1.975 457 HB THR 109 HB THR 109 2.692 -18.072 2.020 458 HG1 THR 109 1HG THR 109 1.298 -20.245 2.234 459 HG21 THR 109 1HG2 THR 109 2.756 -18.650 -0.206 460 HG22 THR 109 2HG2 THR 109 1.466 -19.715 0.351 461 HG23 THR 109 3HG2 THR 109 3.098 -20.345 0.132 462 H ASN 110 H ASN 110 5.193 -17.119 2.547 463 HA ASN 110 HA ASN 110 6.859 -17.121 0.075 464 HB2 ASN 110 2HB ASN 110 6.214 -14.660 -0.140 465 HB3 ASN 110 1HB ASN 110 4.948 -15.822 -0.533 466 HD21 ASN 110 1HD2 ASN 110 6.165 -13.957 2.314 467 HD22 ASN 110 2HD2 ASN 110 4.626 -13.713 2.989 468 HA PRO 111 HA PRO 111 9.200 -16.077 4.010 469 HB2 PRO 111 2HB PRO 111 11.252 -17.486 2.382 470 HB3 PRO 111 1HB PRO 111 10.872 -17.654 4.105 471 HG2 PRO 111 2HG PRO 111 10.161 -19.496 2.301 472 HG3 PRO 111 1HG PRO 111 9.171 -19.129 3.722 473 HD2 PRO 111 2HD PRO 111 8.699 -18.417 0.871 474 HD3 PRO 111 1HD PRO 111 7.535 -18.684 2.180 475 H LYS 112 H LYS 112 10.844 -14.534 4.191 476 HA LYS 112 HA LYS 112 12.137 -12.689 3.603 477 HB2 LYS 112 2HB LYS 112 12.376 -14.126 0.944 478 HB3 LYS 112 1HB LYS 112 13.355 -12.758 1.461 479 HG2 LYS 112 2HG LYS 112 14.121 -14.090 3.425 480 HG3 LYS 112 1HG LYS 112 13.229 -15.475 2.794 481 HD2 LYS 112 2HD LYS 112 14.559 -15.324 0.687 482 HD3 LYS 112 1HD LYS 112 15.506 -14.025 1.414 483 HE2 LYS 112 2HE LYS 112 15.339 -16.308 3.200 484 HE3 LYS 112 1HE LYS 112 16.000 -16.780 1.634 485 HZ1 LYS 112 1HZ LYS 112 17.000 -14.710 3.496 486 HZ2 LYS 112 2HZ LYS 112 17.467 -14.748 1.862 487 HZ3 LYS 112 3HZ LYS 112 17.823 -16.060 2.882 488 H CYS 113 H CYS 113 9.533 -12.090 3.593 489 HA CYS 113 HA CYS 113 8.984 -10.743 0.989 490 HB2 CYS 113 2HB CYS 113 7.262 -11.657 3.272 491 HB3 CYS 113 1HB CYS 113 6.695 -10.351 2.233 492 H SER 114 H SER 114 8.768 -10.044 4.511 493 HA SER 114 HA SER 114 9.564 -7.236 3.855 494 HB2 SER 114 2HB SER 114 7.266 -6.978 4.304 495 HB3 SER 114 1HB SER 114 7.281 -8.211 5.561 496 HG SER 114 HG SER 114 7.281 -6.273 6.604 497 H TYR 115 H TYR 115 11.073 -9.603 4.912 498 HA TYR 115 HA TYR 115 11.511 -9.248 7.723 499 HB2 TYR 115 2HB TYR 115 13.408 -10.678 7.453 500 HB3 TYR 115 1HB TYR 115 12.189 -11.252 6.317 501 HD1 TYR 115 1HD TYR 115 15.538 -9.990 6.700 502 HD2 TYR 115 2HD TYR 115 12.323 -10.445 3.888 503 HE1 TYR 115 1HE TYR 115 17.132 -9.678 4.825 504 HE2 TYR 115 2HE TYR 115 13.916 -10.134 2.015 505 HH TYR 115 HH TYR 115 16.945 -8.863 2.371 506 H ILE 116 H ILE 116 12.842 -7.642 4.884 507 HA ILE 116 HA ILE 116 14.929 -6.283 6.424 508 HB ILE 116 HB ILE 116 14.692 -4.809 4.135 509 HG12 ILE 116 2HG1 ILE 116 13.855 -7.632 3.415 510 HG13 ILE 116 1HG1 ILE 116 12.752 -6.258 3.448 511 HG21 ILE 116 1HG2 ILE 116 16.174 -7.323 4.841 512 HG22 ILE 116 2HG2 ILE 116 16.798 -5.694 4.589 513 HG23 ILE 116 3HG2 ILE 116 16.319 -6.679 3.208 514 HD11 ILE 116 1HD1 ILE 116 14.244 -7.046 1.260 515 HD12 ILE 116 2HD1 ILE 116 15.210 -5.734 1.931 516 HD13 ILE 116 3HD1 ILE 116 13.531 -5.449 1.480 517 HA PRO 117 HA PRO 117 13.041 -2.749 8.206 518 HB2 PRO 117 2HB PRO 117 14.419 -1.160 6.071 519 HB3 PRO 117 1HB PRO 117 14.333 -0.861 7.818 520 HG2 PRO 117 2HG PRO 117 16.488 -1.959 6.638 521 HG3 PRO 117 1HG PRO 117 15.993 -2.347 8.293 522 HD2 PRO 117 2HD PRO 117 15.924 -4.055 5.906 523 HD3 PRO 117 1HD PRO 117 15.753 -4.512 7.613 524 HA PRO 118 HA PRO 118 9.793 -2.348 4.968 525 HB2 PRO 118 2HB PRO 118 7.659 -2.720 6.599 526 HB3 PRO 118 1HB PRO 118 8.623 -4.072 5.975 527 HG2 PRO 118 2HG PRO 118 8.599 -2.851 8.672 528 HG3 PRO 118 1HG PRO 118 8.881 -4.531 8.190 529 HD2 PRO 118 2HD PRO 118 10.869 -2.666 8.870 530 HD3 PRO 118 1HD PRO 118 11.136 -4.209 8.032 531 H CYS 119 H CYS 119 8.440 -0.532 4.493 532 HA CYS 119 HA CYS 119 8.728 1.725 6.407 533 HB2 CYS 119 2HB CYS 119 7.618 2.796 4.132 534 HB3 CYS 119 1HB CYS 119 9.349 2.726 4.462 535 H LYS 120 H LYS 120 7.011 1.837 7.780 536 HA LYS 120 HA LYS 120 4.287 1.758 6.578 537 HB2 LYS 120 2HB LYS 120 3.915 0.739 9.141 538 HB3 LYS 120 1HB LYS 120 3.868 -0.188 7.647 539 HG2 LYS 120 2HG LYS 120 5.411 -1.299 9.112 540 HG3 LYS 120 1HG LYS 120 6.381 -0.501 7.879 541 HD2 LYS 120 2HD LYS 120 6.733 1.411 9.436 542 HD3 LYS 120 1HD LYS 120 5.815 0.548 10.670 543 HE2 LYS 120 2HE LYS 120 8.226 -0.686 9.333 544 HE3 LYS 120 1HE LYS 120 8.378 0.331 10.766 545 HZ1 LYS 120 1HZ LYS 120 6.799 -1.146 11.896 546 HZ2 LYS 120 2HZ LYS 120 8.206 -1.963 11.411 547 HZ3 LYS 120 3HZ LYS 120 6.765 -2.151 10.531 548 H ARG 121 H ARG 121 2.918 3.349 7.401 549 HA ARG 121 HA ARG 121 4.062 5.524 8.860 550 HB2 ARG 121 2HB ARG 121 1.158 4.770 8.411 551 HB3 ARG 121 1HB ARG 121 1.714 6.329 9.014 552 HG2 ARG 121 2HG ARG 121 3.048 6.629 6.933 553 HG3 ARG 121 1HG ARG 121 2.387 5.111 6.322 554 HD2 ARG 121 2HD ARG 121 1.073 6.946 5.419 555 HD3 ARG 121 1HD ARG 121 0.086 6.073 6.593 556 HE ARG 121 HE ARG 121 1.363 8.126 8.022 557 HH11 ARG 121 1HH1 ARG 121 0.307 10.091 8.393 558 HH12 ARG 121 2HH1 ARG 121 -0.989 10.574 7.350 559 HH21 ARG 121 1HH2 ARG 121 -0.795 7.741 5.362 560 HH22 ARG 121 2HH2 ARG 121 -1.612 9.242 5.634 561 H GLU 122 H GLU 122 2.004 2.805 9.834 562 HA GLU 122 HA GLU 122 2.923 3.151 12.615 563 HB2 GLU 122 2HB GLU 122 -0.006 3.154 11.822 564 HB3 GLU 122 1HB GLU 122 0.577 2.979 13.477 565 HG2 GLU 122 2HG GLU 122 1.738 5.173 13.263 566 HG3 GLU 122 1HG GLU 122 1.050 5.352 11.649 567 H ASN 123 H ASN 123 2.844 1.171 13.784 568 HA ASN 123 HA ASN 123 3.058 -1.221 12.264 569 HB2 ASN 123 2HB ASN 123 2.306 -1.033 15.191 570 HB3 ASN 123 1HB ASN 123 3.119 -2.375 14.384 571 HD21 ASN 123 1HD2 ASN 123 3.563 0.868 15.682 572 HD22 ASN 123 2HD2 ASN 123 5.255 0.900 15.528 573 H GLN 124 H GLN 124 0.346 0.071 14.163 574 HA GLN 124 HA GLN 124 -1.922 -0.548 14.197 575 HB2 GLN 124 2HB GLN 124 -1.259 -1.345 11.345 576 HB3 GLN 124 1HB GLN 124 -2.884 -1.119 11.992 577 HG2 GLN 124 2HG GLN 124 -2.347 1.234 12.518 578 HG3 GLN 124 1HG GLN 124 -0.728 1.005 11.855 579 HE21 GLN 124 1HE2 GLN 124 -2.281 2.957 10.639 580 HE22 GLN 124 2HE2 GLN 124 -2.818 2.424 9.120 581 H LYS 125 H LYS 125 -0.323 -2.478 15.386 582 HA LYS 125 HA LYS 125 -0.769 -5.097 14.210 583 HB2 LYS 125 2HB LYS 125 1.099 -4.546 15.810 584 HB3 LYS 125 1HB LYS 125 -0.107 -4.439 17.094 585 HG2 LYS 125 2HG LYS 125 -0.770 -6.762 16.711 586 HG3 LYS 125 1HG LYS 125 0.356 -6.883 15.360 587 HD2 LYS 125 2HD LYS 125 1.399 -7.870 17.320 588 HD3 LYS 125 1HD LYS 125 2.231 -6.361 16.938 589 HE2 LYS 125 2HE LYS 125 -0.088 -6.220 18.816 590 HE3 LYS 125 1HE LYS 125 1.414 -6.916 19.423 591 HZ1 LYS 125 1HZ LYS 125 1.057 -4.392 19.596 592 HZ2 LYS 125 2HZ LYS 125 1.443 -4.369 17.942 593 HZ3 LYS 125 3HZ LYS 125 2.565 -4.964 19.070 594 H ASN 126 H ASN 126 -2.759 -5.999 14.116 595 HA ASN 126 HA ASN 126 -4.454 -5.992 16.536 596 HB2 ASN 126 2HB ASN 126 -5.072 -3.977 15.093 597 HB3 ASN 126 1HB ASN 126 -5.616 -5.136 13.880 598 HD21 ASN 126 1HD2 ASN 126 -7.679 -3.666 14.698 599 HD22 ASN 126 2HD2 ASN 126 -8.635 -4.448 15.862 600 H LEU 127 H LEU 127 -4.543 -8.207 16.739 601 HA LEU 127 HA LEU 127 -4.489 -10.051 14.556 602 HB2 LEU 127 2HB LEU 127 -5.517 -10.368 17.389 603 HB3 LEU 127 1HB LEU 127 -5.331 -11.701 16.253 604 HG LEU 127 HG LEU 127 -2.907 -11.046 16.005 605 HD11 LEU 127 1HD1 LEU 127 -3.795 -9.069 18.081 606 HD12 LEU 127 2HD1 LEU 127 -2.686 -8.846 16.727 607 HD13 LEU 127 3HD1 LEU 127 -2.158 -9.716 18.166 608 HD21 LEU 127 1HD2 LEU 127 -2.631 -12.719 17.486 609 HD22 LEU 127 2HD2 LEU 127 -4.244 -12.415 18.133 610 HD23 LEU 127 3HD2 LEU 127 -2.848 -11.575 18.811 611 H GLU 128 H GLU 128 -7.176 -8.537 16.301 612 HA GLU 128 HA GLU 128 -9.262 -10.120 15.165 613 HB2 GLU 128 2HB GLU 128 -9.293 -7.248 16.140 614 HB3 GLU 128 1HB GLU 128 -10.736 -8.192 15.767 615 HG2 GLU 128 2HG GLU 128 -10.043 -9.881 17.454 616 HG3 GLU 128 1HG GLU 128 -8.652 -8.873 17.861 617 H SER 129 H SER 129 -7.611 -7.211 14.008 618 HA SER 129 HA SER 129 -9.350 -6.588 11.851 619 HB2 SER 129 2HB SER 129 -6.346 -6.234 12.015 620 HB3 SER 129 1HB SER 129 -7.406 -5.436 10.857 621 HG SER 129 HG SER 129 -7.075 -4.078 12.612 622 H VAL 130 H VAL 130 -6.777 -8.986 12.127 623 HA VAL 130 HA VAL 130 -6.483 -9.602 9.372 624 HB VAL 130 HB VAL 130 -6.206 -11.317 11.849 625 HG11 VAL 130 1HG1 VAL 130 -6.659 -12.862 10.074 626 HG12 VAL 130 2HG1 VAL 130 -4.906 -12.839 10.269 627 HG13 VAL 130 3HG1 VAL 130 -5.657 -11.954 8.941 628 HG21 VAL 130 1HG2 VAL 130 -4.543 -9.589 11.735 629 HG22 VAL 130 2HG2 VAL 130 -4.292 -9.856 10.010 630 HG23 VAL 130 3HG2 VAL 130 -3.758 -11.067 11.176 631 H MET 131 H MET 131 -8.775 -10.936 11.778 632 HA MET 131 HA MET 131 -9.981 -12.805 9.965 633 HB2 MET 131 2HB MET 131 -10.394 -13.067 12.324 634 HB3 MET 131 1HB MET 131 -11.042 -11.431 12.447 635 HG2 MET 131 2HG MET 131 -12.374 -13.140 10.439 636 HG3 MET 131 1HG MET 131 -12.585 -13.659 12.111 637 HE1 MET 131 1HE MET 131 -13.869 -11.787 9.363 638 HE2 MET 131 2HE MET 131 -15.255 -10.993 10.104 639 HE3 MET 131 3HE MET 131 -15.042 -12.732 10.292 640 H ASN 132 H ASN 132 -10.900 -9.511 10.932 641 HA ASN 132 HA ASN 132 -13.161 -9.326 9.175 642 HB2 ASN 132 2HB ASN 132 -12.611 -7.816 11.161 643 HB3 ASN 132 1HB ASN 132 -11.457 -7.005 10.100 644 HD21 ASN 132 1HD2 ASN 132 -12.984 -5.079 10.454 645 HD22 ASN 132 2HD2 ASN 132 -14.347 -4.955 9.451 646 H TRP 133 H TRP 133 -9.721 -8.577 8.773 647 HA TRP 133 HA TRP 133 -9.903 -7.166 6.322 648 HB2 TRP 133 2HB TRP 133 -7.789 -7.130 7.367 649 HB3 TRP 133 1HB TRP 133 -7.744 -8.886 7.531 650 HD1 TRP 133 HD TRP 133 -7.188 -6.088 5.007 651 HE1 TRP 133 1HE TRP 133 -6.048 -7.063 2.913 652 HE3 TRP 133 3HE TRP 133 -7.443 -11.068 6.102 653 HZ2 TRP 133 2HZ TRP 133 -5.340 -9.619 1.841 654 HZ3 TRP 133 3HZ TRP 133 -6.529 -12.750 4.529 655 HH2 TRP 133 HH TRP 133 -5.478 -12.032 2.402 656 H GLN 134 H GLN 134 -9.418 -10.682 6.832 657 HA GLN 134 HA GLN 134 -9.307 -11.360 4.079 658 HB2 GLN 134 2HB GLN 134 -8.784 -12.913 5.974 659 HB3 GLN 134 1HB GLN 134 -10.515 -13.040 6.293 660 HG2 GLN 134 2HG GLN 134 -10.297 -13.494 3.548 661 HG3 GLN 134 1HG GLN 134 -8.920 -14.354 4.238 662 HE21 GLN 134 1HE2 GLN 134 -12.431 -13.881 4.930 663 HE22 GLN 134 2HE2 GLN 134 -12.697 -15.483 5.425 664 H GLN 135 H GLN 135 -12.146 -11.253 6.261 665 HA GLN 135 HA GLN 135 -14.004 -11.930 4.156 666 HB2 GLN 135 2HB GLN 135 -14.403 -10.636 6.865 667 HB3 GLN 135 1HB GLN 135 -15.718 -11.150 5.814 668 HG2 GLN 135 2HG GLN 135 -14.820 -13.461 5.839 669 HG3 GLN 135 1HG GLN 135 -13.550 -12.937 6.945 670 HE21 GLN 135 1HE2 GLN 135 -15.130 -14.899 7.976 671 HE22 GLN 135 2HE2 GLN 135 -16.246 -14.279 9.096 672 H TYR 136 H TYR 136 -13.023 -8.878 5.675 673 HA TYR 136 HA TYR 136 -14.787 -7.216 4.113 674 HB2 TYR 136 2HB TYR 136 -13.858 -6.436 6.223 675 HB3 TYR 136 1HB TYR 136 -12.220 -6.576 5.588 676 HD1 TYR 136 1HD TYR 136 -11.435 -5.081 3.780 677 HD2 TYR 136 2HD TYR 136 -15.281 -4.572 5.627 678 HE1 TYR 136 1HE TYR 136 -11.579 -2.789 2.848 679 HE2 TYR 136 2HE TYR 136 -15.427 -2.279 4.691 680 HH TYR 136 HH TYR 136 -14.077 -0.566 3.814 681 H TRP 137 H TRP 137 -11.290 -7.854 3.852 682 HA TRP 137 HA TRP 137 -10.893 -6.276 1.508 683 HB2 TRP 137 2HB TRP 137 -9.095 -7.059 3.053 684 HB3 TRP 137 1HB TRP 137 -9.321 -8.692 2.431 685 HD1 TRP 137 HD TRP 137 -7.725 -5.392 1.612 686 HE1 TRP 137 1HE TRP 137 -6.407 -5.614 -0.592 687 HE3 TRP 137 3HE TRP 137 -9.365 -9.951 0.095 688 HZ2 TRP 137 2HZ TRP 137 -6.095 -7.497 -2.727 689 HZ3 TRP 137 3HZ TRP 137 -8.549 -10.955 -2.027 690 HH2 TRP 137 HH TRP 137 -6.917 -9.730 -3.438 691 H LYS 138 H LYS 138 -11.537 -9.765 1.894 692 HA LYS 138 HA LYS 138 -11.370 -10.300 -0.943 693 HB2 LYS 138 2HB LYS 138 -11.067 -12.030 0.836 694 HB3 LYS 138 1HB LYS 138 -12.793 -11.914 1.186 695 HG2 LYS 138 2HG LYS 138 -13.292 -12.528 -1.167 696 HG3 LYS 138 1HG LYS 138 -11.564 -12.706 -1.472 697 HD2 LYS 138 2HD LYS 138 -11.479 -14.415 0.367 698 HD3 LYS 138 1HD LYS 138 -13.237 -14.316 0.476 699 HE2 LYS 138 2HE LYS 138 -12.779 -16.170 -0.962 700 HE3 LYS 138 1HE LYS 138 -13.290 -14.852 -2.018 701 HZ1 LYS 138 1HZ LYS 138 -10.697 -14.386 -1.950 702 HZ2 LYS 138 2HZ LYS 138 -11.404 -15.433 -3.087 703 HZ3 LYS 138 3HZ LYS 138 -10.659 -16.062 -1.694 704 H ASP 139 H ASP 139 -14.119 -9.822 1.270 705 HA ASP 139 HA ASP 139 -16.140 -10.252 -0.708 706 HB2 ASP 139 2HB ASP 139 -16.227 -8.670 1.870 707 HB3 ASP 139 1HB ASP 139 -17.643 -9.100 0.912 708 H GLU 140 H GLU 140 -14.540 -7.234 0.357 709 HA GLU 140 HA GLU 140 -16.227 -5.736 -1.544 710 HB2 GLU 140 2HB GLU 140 -14.135 -4.798 0.429 711 HB3 GLU 140 1HB GLU 140 -15.118 -3.735 -0.575 712 HG2 GLU 140 2HG GLU 140 -17.168 -4.733 0.441 713 HG3 GLU 140 1HG GLU 140 -16.137 -5.680 1.515 714 H ILE 141 H ILE 141 -12.731 -6.229 -0.975 715 HA ILE 141 HA ILE 141 -12.210 -5.024 -3.611 716 HB ILE 141 HB ILE 141 -10.286 -6.091 -1.532 717 HG12 ILE 141 2HG1 ILE 141 -11.087 -3.250 -2.241 718 HG13 ILE 141 1HG1 ILE 141 -11.620 -4.121 -0.802 719 HG21 ILE 141 1HG2 ILE 141 -9.936 -5.338 -4.285 720 HG22 ILE 141 2HG2 ILE 141 -8.716 -5.871 -3.129 721 HG23 ILE 141 3HG2 ILE 141 -9.120 -4.159 -3.257 722 HD11 ILE 141 1HD1 ILE 141 -9.747 -2.778 -0.132 723 HD12 ILE 141 2HD1 ILE 141 -8.798 -3.306 -1.523 724 HD13 ILE 141 3HD1 ILE 141 -9.168 -4.442 -0.227 725 H GLY 142 H GLY 142 -10.624 -7.859 -2.156 726 HA2 GLY 142 2HA GLY 142 -10.388 -10.045 -3.029 727 HA3 GLY 142 1HA GLY 142 -11.615 -9.650 -4.236 728 H SER 143 H SER 143 -8.697 -7.769 -3.640 729 HA SER 143 HA SER 143 -6.701 -7.605 -4.916 730 HB2 SER 143 2HB SER 143 -7.391 -10.080 -5.642 731 HB3 SER 143 1HB SER 143 -7.803 -9.265 -7.147 732 HG SER 143 HG SER 143 -5.628 -8.295 -6.934 733 H GLN 144 H GLN 144 -7.583 -5.403 -5.130 734 HA GLN 144 HA GLN 144 -7.992 -4.710 -7.934 735 HB2 GLN 144 2HB GLN 144 -10.290 -5.397 -6.909 736 HB3 GLN 144 1HB GLN 144 -10.196 -3.842 -6.083 737 HG2 GLN 144 2HG GLN 144 -9.908 -4.197 -9.079 738 HG3 GLN 144 1HG GLN 144 -11.405 -3.719 -8.276 739 HE21 GLN 144 1HE2 GLN 144 -11.516 -1.564 -7.347 740 HE22 GLN 144 2HE2 GLN 144 -10.341 -0.386 -7.679 741 HA PRO 145 HA PRO 145 -5.836 -1.602 -5.101 742 HB2 PRO 145 2HB PRO 145 -4.070 -1.453 -7.471 743 HB3 PRO 145 1HB PRO 145 -3.648 -1.647 -5.764 744 HG2 PRO 145 2HG PRO 145 -3.462 -3.638 -7.576 745 HG3 PRO 145 1HG PRO 145 -3.756 -3.910 -5.857 746 HD2 PRO 145 2HD PRO 145 -5.639 -4.155 -8.137 747 HD3 PRO 145 1HD PRO 145 -5.671 -4.959 -6.554 748 H PHE 146 H PHE 146 -5.734 0.779 -5.563 749 HA PHE 146 HA PHE 146 -6.817 1.565 -8.191 750 HB2 PHE 146 2HB PHE 146 -8.482 3.070 -7.120 751 HB3 PHE 146 1HB PHE 146 -8.818 1.364 -6.847 752 HD1 PHE 146 1HD PHE 146 -8.676 4.494 -5.336 753 HD2 PHE 146 2HD PHE 146 -7.587 0.399 -4.605 754 HE1 PHE 146 1HE PHE 146 -8.708 4.918 -2.896 755 HE2 PHE 146 2HE PHE 146 -7.604 0.836 -2.169 756 HZ PHE 146 HZ PHE 146 -8.168 3.091 -1.310 757 H THR 147 H THR 147 -6.451 3.771 -8.732 758 HA THR 147 HA THR 147 -4.345 5.063 -7.058 759 HB THR 147 HB THR 147 -3.388 5.959 -9.107 760 HG1 THR 147 1HG THR 147 -5.319 6.136 -10.285 761 HG21 THR 147 1HG2 THR 147 -3.038 3.630 -10.317 762 HG22 THR 147 2HG2 THR 147 -3.859 3.016 -8.881 763 HG23 THR 147 3HG2 THR 147 -2.358 3.928 -8.718 764 H CYS 148 H CYS 148 -4.389 7.390 -7.096 765 HA CYS 148 HA CYS 148 -6.945 8.581 -7.974 766 HB2 CYS 148 2HB CYS 148 -5.950 9.513 -5.345 767 HB3 CYS 148 1HB CYS 148 -7.592 9.149 -5.849 768 H TYR 149 H TYR 149 -6.790 10.927 -8.198 769 HA TYR 149 HA TYR 149 -3.996 12.004 -8.166 770 HB2 TYR 149 2HB TYR 149 -5.957 12.186 -10.471 771 HB3 TYR 149 1HB TYR 149 -4.506 13.168 -10.339 772 HD1 TYR 149 1HD TYR 149 -2.484 12.368 -11.179 773 HD2 TYR 149 2HD TYR 149 -5.625 9.587 -10.265 774 HE1 TYR 149 1HE TYR 149 -1.129 10.523 -12.136 775 HE2 TYR 149 2HE TYR 149 -4.274 7.743 -11.223 776 HH TYR 149 HH TYR 149 -1.246 7.691 -11.602 777 H PHE 150 H PHE 150 -3.952 14.051 -7.264 778 HA PHE 150 HA PHE 150 -6.480 15.572 -7.231 779 HB2 PHE 150 2HB PHE 150 -6.947 15.119 -5.078 780 HB3 PHE 150 1HB PHE 150 -5.568 14.024 -5.031 781 HD1 PHE 150 1HD PHE 150 -6.899 17.164 -3.938 782 HD2 PHE 150 2HD PHE 150 -3.257 15.004 -4.587 783 HE1 PHE 150 1HE PHE 150 -5.715 18.750 -2.449 784 HE2 PHE 150 2HE PHE 150 -2.048 16.573 -3.110 785 HZ PHE 150 HZ PHE 150 -3.276 18.456 -2.028 786 H ASN 151 H ASN 151 -6.216 17.817 -6.868 787 HA ASN 151 HA ASN 151 -3.429 18.780 -6.537 788 HB2 ASN 151 2HB ASN 151 -3.555 20.177 -8.526 789 HB3 ASN 151 1HB ASN 151 -3.812 18.492 -8.965 790 HD21 ASN 151 1HD2 ASN 151 -4.782 20.425 -10.723 791 HD22 ASN 151 2HD2 ASN 151 -6.475 20.482 -10.641 792 H GLN 152 H GLN 152 -3.513 20.237 -4.965 793 HA GLN 152 HA GLN 152 -5.943 21.844 -4.465 794 HB2 GLN 152 2HB GLN 152 -4.831 20.809 -2.528 795 HB3 GLN 152 1HB GLN 152 -3.323 21.618 -2.943 796 HG2 GLN 152 2HG GLN 152 -4.369 23.806 -2.593 797 HG3 GLN 152 1HG GLN 152 -5.916 23.033 -2.252 798 HE21 GLN 152 1HE2 GLN 152 -4.970 24.617 -0.224 799 HE22 GLN 152 2HE2 GLN 152 -4.344 23.678 1.045 800 H HIS 153 H HIS 153 -2.794 22.096 -5.893 801 HA HIS 153 HA HIS 153 -2.174 24.799 -5.540 802 HB2 HIS 153 2HB HIS 153 -0.764 24.620 -7.435 803 HB3 HIS 153 1HB HIS 153 -0.809 23.004 -6.740 804 HD1 HIS 153 1HD HIS 153 -2.703 24.982 -9.410 805 HD2 HIS 153 2HD HIS 153 -1.463 21.081 -8.597 806 HE1 HIS 153 1HE HIS 153 -3.335 23.592 -11.433 807 HE2 HIS 153 2HE HIS 153 -2.582 21.219 -10.951 808 H GLN 154 H GLN 154 -4.737 23.424 -7.496 809 HA GLN 154 HA GLN 154 -5.139 25.761 -9.146 810 HB2 GLN 154 2HB GLN 154 -7.063 23.581 -8.273 811 HB3 GLN 154 1HB GLN 154 -7.422 24.798 -9.495 812 HG2 GLN 154 2HG GLN 154 -5.509 24.010 -10.844 813 HG3 GLN 154 1HG GLN 154 -5.165 22.782 -9.624 814 HE21 GLN 154 1HE2 GLN 154 -5.789 21.996 -12.283 815 HE22 GLN 154 2HE2 GLN 154 -7.306 21.238 -12.288 816 H ARG 155 H ARG 155 -7.161 24.544 -6.470 817 HA ARG 155 HA ARG 155 -7.083 27.034 -5.047 818 HB2 ARG 155 2HB ARG 155 -8.949 26.868 -7.195 819 HB3 ARG 155 1HB ARG 155 -9.860 26.855 -5.681 820 HG2 ARG 155 2HG ARG 155 -8.823 28.900 -4.951 821 HG3 ARG 155 1HG ARG 155 -7.664 28.854 -6.281 822 HD2 ARG 155 2HD ARG 155 -9.110 30.082 -7.490 823 HD3 ARG 155 1HD ARG 155 -10.190 28.687 -7.498 824 HE ARG 155 HE ARG 155 -10.473 31.077 -5.818 825 HH11 ARG 155 1HH1 ARG 155 -12.363 31.137 -4.581 826 HH12 ARG 155 2HH1 ARG 155 -13.319 29.702 -4.411 827 HH21 ARG 155 1HH2 ARG 155 -11.218 27.756 -6.369 828 HH22 ARG 155 2HH2 ARG 155 -12.670 27.788 -5.424 829 HA PRO 156 HA PRO 156 -9.758 23.931 -2.738 830 HB2 PRO 156 2HB PRO 156 -11.417 22.258 -3.966 831 HB3 PRO 156 1HB PRO 156 -11.702 24.007 -4.054 832 HG2 PRO 156 2HG PRO 156 -10.674 22.166 -6.129 833 HG3 PRO 156 1HG PRO 156 -11.599 23.667 -6.303 834 HD2 PRO 156 2HD PRO 156 -8.730 23.327 -6.486 835 HD3 PRO 156 1HD PRO 156 -9.672 24.819 -6.670 836 H ASP 157 H ASP 157 -10.208 21.212 -4.721 837 HA ASP 157 HA ASP 157 -7.670 19.904 -4.446 838 HB2 ASP 157 2HB ASP 157 -8.315 18.316 -2.630 839 HB3 ASP 157 1HB ASP 157 -8.199 19.976 -2.051 840 H ASP 158 H ASP 158 -8.572 19.566 -6.692 841 HA ASP 158 HA ASP 158 -10.950 18.008 -7.126 842 HB2 ASP 158 2HB ASP 158 -8.445 18.212 -8.828 843 HB3 ASP 158 1HB ASP 158 -9.972 17.514 -9.360 844 H VAL 159 H VAL 159 -11.097 15.681 -7.587 845 HA VAL 159 HA VAL 159 -8.742 14.104 -6.644 846 HB VAL 159 HB VAL 159 -11.600 13.613 -5.768 847 HG11 VAL 159 1HG1 VAL 159 -8.960 12.248 -5.310 848 HG12 VAL 159 2HG1 VAL 159 -10.526 11.534 -5.693 849 HG13 VAL 159 3HG1 VAL 159 -10.216 12.165 -4.075 850 HG21 VAL 159 1HG2 VAL 159 -11.098 15.413 -4.431 851 HG22 VAL 159 2HG2 VAL 159 -9.358 15.200 -4.620 852 HG23 VAL 159 3HG2 VAL 159 -10.254 14.180 -3.495 853 H LEU 160 H LEU 160 -8.525 12.060 -7.582 854 HA LEU 160 HA LEU 160 -10.495 11.360 -9.731 855 HB2 LEU 160 2HB LEU 160 -8.197 12.177 -10.529 856 HB3 LEU 160 1HB LEU 160 -7.542 10.717 -9.795 857 HG LEU 160 HG LEU 160 -9.149 9.368 -11.171 858 HD11 LEU 160 1HD1 LEU 160 -10.041 12.072 -11.856 859 HD12 LEU 160 2HD1 LEU 160 -10.872 10.530 -12.066 860 HD13 LEU 160 3HD1 LEU 160 -9.721 11.084 -13.280 861 HD21 LEU 160 1HD2 LEU 160 -6.874 10.961 -12.163 862 HD22 LEU 160 2HD2 LEU 160 -7.922 10.334 -13.431 863 HD23 LEU 160 3HD2 LEU 160 -7.169 9.228 -12.283 864 H LEU 161 H LEU 161 -10.920 9.059 -9.924 865 HA LEU 161 HA LEU 161 -9.714 7.392 -7.751 866 HB2 LEU 161 2HB LEU 161 -12.049 8.178 -7.197 867 HB3 LEU 161 1HB LEU 161 -12.615 7.238 -8.581 868 HG LEU 161 HG LEU 161 -11.087 5.367 -7.362 869 HD11 LEU 161 1HD1 LEU 161 -11.076 5.541 -5.030 870 HD12 LEU 161 2HD1 LEU 161 -12.369 6.741 -5.013 871 HD13 LEU 161 3HD1 LEU 161 -10.744 7.202 -5.522 872 HD21 LEU 161 1HD2 LEU 161 -13.411 5.056 -8.026 873 HD22 LEU 161 2HD2 LEU 161 -13.960 6.105 -6.718 874 HD23 LEU 161 3HD2 LEU 161 -13.224 4.546 -6.349 875 H HIS 162 H HIS 162 -8.448 6.933 -9.957 876 HA HIS 162 HA HIS 162 -9.798 5.186 -11.848 877 HB2 HIS 162 2HB HIS 162 -6.888 5.800 -11.299 878 HB3 HIS 162 1HB HIS 162 -7.384 4.621 -12.512 879 HD1 HIS 162 1HD HIS 162 -6.006 6.786 -13.838 880 HD2 HIS 162 2HD HIS 162 -10.010 7.256 -12.765 881 HE1 HIS 162 1HE HIS 162 -6.926 8.649 -15.288 882 HE2 HIS 162 2HE HIS 162 -9.361 8.942 -14.644 883 H ARG 163 H ARG 163 -9.297 2.846 -12.076 884 HA ARG 163 HA ARG 163 -8.739 1.589 -9.413 885 HB2 ARG 163 2HB ARG 163 -10.517 0.631 -11.672 886 HB3 ARG 163 1HB ARG 163 -10.188 -0.277 -10.196 887 HG2 ARG 163 2HG ARG 163 -11.102 1.626 -8.865 888 HG3 ARG 163 1HG ARG 163 -11.518 2.444 -10.372 889 HD2 ARG 163 2HD ARG 163 -12.882 0.410 -10.996 890 HD3 ARG 163 1HD ARG 163 -12.603 -0.199 -9.366 891 HE ARG 163 HE ARG 163 -14.211 1.336 -8.594 892 HH11 ARG 163 1HH1 ARG 163 -15.643 3.067 -8.848 893 HH12 ARG 163 2HH1 ARG 163 -15.567 4.033 -10.284 894 HH21 ARG 163 1HH2 ARG 163 -12.955 2.227 -11.679 895 HH22 ARG 163 2HH2 ARG 163 -14.046 3.558 -11.887 896 H THR 164 H THR 164 -7.626 -0.489 -9.462 897 HA THR 164 HA THR 164 -5.755 -0.695 -11.771 898 HB THR 164 HB THR 164 -5.526 -2.103 -9.108 899 HG1 THR 164 1HG THR 164 -5.601 0.216 -8.918 900 HG21 THR 164 1HG2 THR 164 -4.196 -2.662 -11.332 901 HG22 THR 164 2HG2 THR 164 -3.379 -2.647 -9.770 902 HG23 THR 164 3HG2 THR 164 -3.246 -1.258 -10.847 903 H HIS 165 H HIS 165 -5.643 -2.567 -12.995 904 HA HIS 165 HA HIS 165 -7.654 -4.689 -12.338 905 HB2 HIS 165 2HB HIS 165 -6.592 -3.780 -15.031 906 HB3 HIS 165 1HB HIS 165 -7.685 -5.145 -14.790 907 HD1 HIS 165 1HD HIS 165 -7.560 -1.399 -14.744 908 HD2 HIS 165 2HD HIS 165 -10.357 -4.419 -14.061 909 HE1 HIS 165 1HE HIS 165 -9.827 -0.270 -14.652 910 HE2 HIS 165 2HE HIS 165 -11.536 -2.098 -14.237 911 H ASP 166 H ASP 166 -6.929 -6.807 -12.282 912 HA ASP 166 HA ASP 166 -5.336 -8.517 -12.026 913 HB2 ASP 166 2HB ASP 166 -4.295 -7.115 -14.505 914 HB3 ASP 166 1HB ASP 166 -3.722 -8.686 -13.942 Start of MODEL 17 1 H1 GLN 45 1HT GLN 45 5.373 18.554 -5.265 2 H2 GLN 45 2HT GLN 45 5.973 17.359 -6.313 3 H3 GLN 45 3HT GLN 45 6.308 17.279 -4.650 4 HA GLN 45 HA GLN 45 3.544 17.183 -5.698 5 HB2 GLN 45 2HB GLN 45 5.448 14.886 -5.145 6 HB3 GLN 45 1HB GLN 45 3.718 14.710 -5.445 7 HG2 GLN 45 2HG GLN 45 3.980 15.730 -7.665 8 HG3 GLN 45 1HG GLN 45 5.705 15.955 -7.370 9 HE21 GLN 45 1HE2 GLN 45 4.832 14.366 -9.563 10 HE22 GLN 45 2HE2 GLN 45 5.229 12.744 -9.256 11 H ASP 46 H ASP 46 5.926 16.902 -3.141 12 HA ASP 46 HA ASP 46 4.041 15.995 -1.120 13 HB2 ASP 46 2HB ASP 46 6.774 17.294 -0.896 14 HB3 ASP 46 1HB ASP 46 5.867 16.641 0.469 15 H LEU 47 H LEU 47 5.885 19.041 -1.134 16 HA LEU 47 HA LEU 47 3.974 20.446 0.463 17 HB2 LEU 47 2HB LEU 47 5.991 21.587 -1.500 18 HB3 LEU 47 1HB LEU 47 5.218 22.461 -0.176 19 HG LEU 47 HG LEU 47 7.047 20.059 0.113 20 HD11 LEU 47 1HD1 LEU 47 8.565 21.746 -0.209 21 HD12 LEU 47 2HD1 LEU 47 8.226 22.053 1.494 22 HD13 LEU 47 3HD1 LEU 47 7.419 23.007 0.249 23 HD21 LEU 47 1HD2 LEU 47 5.638 19.862 1.953 24 HD22 LEU 47 2HD2 LEU 47 5.304 21.593 2.011 25 HD23 LEU 47 3HD2 LEU 47 6.848 20.972 2.595 26 H GLN 48 H GLN 48 4.296 19.942 -2.993 27 HA GLN 48 HA GLN 48 2.017 21.778 -3.506 28 HB2 GLN 48 2HB GLN 48 3.823 20.302 -5.448 29 HB3 GLN 48 1HB GLN 48 2.595 21.492 -5.883 30 HG2 GLN 48 2HG GLN 48 4.866 22.127 -3.988 31 HG3 GLN 48 1HG GLN 48 4.988 22.374 -5.731 32 HE21 GLN 48 1HE2 GLN 48 1.776 22.821 -5.039 33 HE22 GLN 48 2HE2 GLN 48 1.770 24.500 -4.788 34 H ALA 49 H ALA 49 0.133 21.006 -4.599 35 HA ALA 49 HA ALA 49 -0.350 18.106 -4.172 36 HB1 ALA 49 1HB ALA 49 -2.168 20.490 -4.482 37 HB2 ALA 49 2HB ALA 49 -1.999 19.424 -3.087 38 HB3 ALA 49 3HB ALA 49 -2.772 18.834 -4.558 39 H THR 50 H THR 50 -0.956 16.771 -5.862 40 HA THR 50 HA THR 50 -1.795 17.640 -8.449 41 HB THR 50 HB THR 50 1.092 16.735 -8.301 42 HG1 THR 50 1HG THR 50 -0.109 19.261 -8.529 43 HG21 THR 50 1HG2 THR 50 -0.250 16.088 -10.331 44 HG22 THR 50 2HG2 THR 50 1.122 17.138 -10.683 45 HG23 THR 50 3HG2 THR 50 -0.508 17.806 -10.636 46 H GLU 51 H GLU 51 0.400 15.156 -7.138 47 HA GLU 51 HA GLU 51 -1.449 13.099 -8.255 48 HB2 GLU 51 2HB GLU 51 1.518 12.883 -7.722 49 HB3 GLU 51 1HB GLU 51 0.504 11.657 -8.482 50 HG2 GLU 51 2HG GLU 51 -0.035 13.296 -10.298 51 HG3 GLU 51 1HG GLU 51 1.105 14.423 -9.565 52 H ALA 52 H ALA 52 -2.144 11.489 -6.956 53 HA ALA 52 HA ALA 52 -0.895 10.957 -4.346 54 HB1 ALA 52 1HB ALA 52 -2.435 12.124 -3.160 55 HB2 ALA 52 2HB ALA 52 -3.670 11.039 -3.803 56 HB3 ALA 52 3HB ALA 52 -3.301 12.550 -4.636 57 H ASN 53 H ASN 53 -0.623 8.737 -4.701 58 HA ASN 53 HA ASN 53 -2.827 7.348 -6.119 59 HB2 ASN 53 2HB ASN 53 0.009 6.489 -5.558 60 HB3 ASN 53 1HB ASN 53 -1.192 5.467 -6.343 61 HD21 ASN 53 1HD2 ASN 53 -2.496 7.599 -7.865 62 HD22 ASN 53 2HD2 ASN 53 -1.400 8.103 -9.060 63 H CYS 54 H CYS 54 -4.078 5.818 -5.193 64 HA CYS 54 HA CYS 54 -3.377 4.957 -2.420 65 HB2 CYS 54 2HB CYS 54 -6.234 5.153 -2.877 66 HB3 CYS 54 1HB CYS 54 -5.273 5.904 -1.610 67 H THR 55 H THR 55 -2.784 2.852 -3.068 68 HA THR 55 HA THR 55 -4.948 1.351 -4.470 69 HB THR 55 HB THR 55 -3.553 0.989 -6.195 70 HG1 THR 55 1HG THR 55 -2.881 -0.756 -4.686 71 HG21 THR 55 1HG2 THR 55 -1.370 2.075 -6.286 72 HG22 THR 55 2HG2 THR 55 -1.391 2.312 -4.539 73 HG23 THR 55 3HG2 THR 55 -2.541 3.175 -5.558 74 H VAL 56 H VAL 56 -5.142 -0.828 -4.045 75 HA VAL 56 HA VAL 56 -3.872 -1.717 -1.512 76 HB VAL 56 HB VAL 56 -6.341 -2.707 -2.972 77 HG11 VAL 56 1HG1 VAL 56 -5.920 -4.691 -1.970 78 HG12 VAL 56 2HG1 VAL 56 -6.206 -3.876 -0.433 79 HG13 VAL 56 3HG1 VAL 56 -4.567 -4.019 -1.063 80 HG21 VAL 56 1HG2 VAL 56 -7.524 -1.449 -1.506 81 HG22 VAL 56 2HG2 VAL 56 -6.004 -0.615 -1.177 82 HG23 VAL 56 3HG2 VAL 56 -6.518 -1.952 -0.148 83 H LEU 57 H LEU 57 -2.252 -3.141 -1.742 84 HA LEU 57 HA LEU 57 -1.339 -4.029 -4.273 85 HB2 LEU 57 2HB LEU 57 -0.104 -3.945 -1.993 86 HB3 LEU 57 1HB LEU 57 -0.806 -5.538 -1.725 87 HG LEU 57 HG LEU 57 0.155 -6.176 -4.017 88 HD11 LEU 57 1HD1 LEU 57 0.829 -3.429 -3.991 89 HD12 LEU 57 2HD1 LEU 57 1.297 -4.633 -5.190 90 HD13 LEU 57 3HD1 LEU 57 2.346 -4.309 -3.811 91 HD21 LEU 57 1HD2 LEU 57 2.576 -6.190 -2.912 92 HD22 LEU 57 2HD2 LEU 57 1.281 -7.202 -2.275 93 HD23 LEU 57 3HD2 LEU 57 1.672 -5.673 -1.489 94 H SER 58 H SER 58 -1.263 -6.294 -5.051 95 HA SER 58 HA SER 58 -3.881 -7.604 -4.620 96 HB2 SER 58 2HB SER 58 -3.390 -8.840 -6.644 97 HB3 SER 58 1HB SER 58 -2.988 -7.153 -6.951 98 HG SER 58 HG SER 58 -0.903 -7.634 -6.940 99 H VAL 59 H VAL 59 -3.888 -9.947 -4.127 100 HA VAL 59 HA VAL 59 -1.579 -10.610 -2.395 101 HB VAL 59 HB VAL 59 -4.179 -12.133 -2.691 102 HG11 VAL 59 1HG1 VAL 59 -1.814 -12.716 -1.344 103 HG12 VAL 59 2HG1 VAL 59 -3.393 -13.427 -1.010 104 HG13 VAL 59 3HG1 VAL 59 -2.846 -12.024 -0.092 105 HG21 VAL 59 1HG2 VAL 59 -5.027 -10.819 -0.822 106 HG22 VAL 59 2HG2 VAL 59 -4.543 -9.711 -2.106 107 HG23 VAL 59 3HG2 VAL 59 -3.503 -9.940 -0.701 108 H GLN 60 H GLN 60 0.027 -11.684 -3.377 109 HA GLN 60 HA GLN 60 -0.631 -14.062 -5.010 110 HB2 GLN 60 2HB GLN 60 1.222 -11.838 -5.922 111 HB3 GLN 60 1HB GLN 60 1.025 -13.390 -6.737 112 HG2 GLN 60 2HG GLN 60 -1.374 -12.912 -7.074 113 HG3 GLN 60 1HG GLN 60 -1.175 -11.357 -6.265 114 HE21 GLN 60 1HE2 GLN 60 -2.100 -11.213 -8.851 115 HE22 GLN 60 2HE2 GLN 60 -0.877 -10.683 -9.902 116 H GLN 61 H GLN 61 1.202 -15.564 -5.126 117 HA GLN 61 HA GLN 61 2.722 -15.625 -2.676 118 HB2 GLN 61 2HB GLN 61 2.181 -17.393 -4.881 119 HB3 GLN 61 1HB GLN 61 3.914 -17.371 -4.575 120 HG2 GLN 61 2HG GLN 61 2.997 -19.079 -3.164 121 HG3 GLN 61 1HG GLN 61 3.368 -17.714 -2.112 122 HE21 GLN 61 1HE2 GLN 61 1.487 -16.268 -1.523 123 HE22 GLN 61 2HE2 GLN 61 -0.074 -16.927 -1.497 124 H ILE 62 H ILE 62 5.277 -16.476 -3.559 125 HA ILE 62 HA ILE 62 6.624 -13.953 -3.853 126 HB ILE 62 HB ILE 62 7.677 -16.763 -4.325 127 HG12 ILE 62 2HG1 ILE 62 7.797 -15.048 -1.827 128 HG13 ILE 62 1HG1 ILE 62 6.613 -16.333 -2.078 129 HG21 ILE 62 1HG2 ILE 62 8.965 -14.059 -4.023 130 HG22 ILE 62 2HG2 ILE 62 9.333 -15.339 -5.181 131 HG23 ILE 62 3HG2 ILE 62 9.823 -15.505 -3.497 132 HD11 ILE 62 1HD1 ILE 62 9.408 -17.125 -2.601 133 HD12 ILE 62 2HD1 ILE 62 8.142 -17.981 -1.720 134 HD13 ILE 62 3HD1 ILE 62 9.066 -16.709 -0.922 135 H GLY 63 H GLY 63 8.373 -13.801 -5.746 136 HA2 GLY 63 2HA GLY 63 8.849 -14.061 -8.099 137 HA3 GLY 63 1HA GLY 63 7.224 -14.705 -8.328 138 H GLU 64 H GLU 64 7.021 -12.052 -6.322 139 HA GLU 64 HA GLU 64 6.554 -10.205 -8.623 140 HB2 GLU 64 2HB GLU 64 4.924 -10.501 -6.083 141 HB3 GLU 64 1HB GLU 64 4.688 -9.227 -7.281 142 HG2 GLU 64 2HG GLU 64 3.122 -10.852 -7.933 143 HG3 GLU 64 1HG GLU 64 4.496 -11.185 -8.986 144 H VAL 65 H VAL 65 7.281 -8.087 -8.330 145 HA VAL 65 HA VAL 65 8.737 -7.553 -5.775 146 HB VAL 65 HB VAL 65 9.424 -6.513 -8.537 147 HG11 VAL 65 1HG1 VAL 65 10.086 -5.493 -6.061 148 HG12 VAL 65 2HG1 VAL 65 11.026 -5.261 -7.532 149 HG13 VAL 65 3HG1 VAL 65 11.453 -6.551 -6.410 150 HG21 VAL 65 1HG2 VAL 65 9.761 -8.965 -8.333 151 HG22 VAL 65 2HG2 VAL 65 10.740 -8.696 -6.891 152 HG23 VAL 65 3HG2 VAL 65 11.296 -8.104 -8.457 153 H PHE 66 H PHE 66 8.220 -5.669 -4.738 154 HA PHE 66 HA PHE 66 6.493 -3.718 -6.197 155 HB2 PHE 66 2HB PHE 66 6.288 -4.515 -3.279 156 HB3 PHE 66 1HB PHE 66 5.251 -3.358 -4.120 157 HD1 PHE 66 1HD PHE 66 5.956 -6.867 -3.497 158 HD2 PHE 66 2HD PHE 66 3.767 -4.141 -5.989 159 HE1 PHE 66 1HE PHE 66 4.519 -8.732 -4.271 160 HE2 PHE 66 2HE PHE 66 2.325 -6.004 -6.760 161 HZ PHE 66 HZ PHE 66 2.700 -8.301 -5.902 162 H GLU 67 H GLU 67 6.718 -1.489 -5.429 163 HA GLU 67 HA GLU 67 9.384 -1.016 -4.160 164 HB2 GLU 67 2HB GLU 67 9.541 1.019 -5.438 165 HB3 GLU 67 1HB GLU 67 9.084 -0.266 -6.555 166 HG2 GLU 67 2HG GLU 67 6.683 0.415 -6.251 167 HG3 GLU 67 1HG GLU 67 7.244 1.792 -5.301 168 H CYS 68 H CYS 68 9.548 0.734 -2.655 169 HA CYS 68 HA CYS 68 6.935 1.493 -1.412 170 HB2 CYS 68 2HB CYS 68 8.565 0.103 -0.032 171 HB3 CYS 68 1HB CYS 68 9.657 1.485 -0.078 172 H THR 69 H THR 69 6.896 3.731 -0.498 173 HA THR 69 HA THR 69 8.589 5.551 -2.148 174 HB THR 69 HB THR 69 6.812 7.103 -2.144 175 HG1 THR 69 1HG THR 69 6.417 6.930 0.116 176 HG21 THR 69 1HG2 THR 69 6.414 4.669 -3.193 177 HG22 THR 69 2HG2 THR 69 5.180 5.929 -3.260 178 HG23 THR 69 3HG2 THR 69 5.093 4.674 -2.023 179 H PHE 70 H PHE 70 9.527 7.392 -1.136 180 HA PHE 70 HA PHE 70 9.263 7.692 1.781 181 HB2 PHE 70 2HB PHE 70 11.602 7.380 2.276 182 HB3 PHE 70 1HB PHE 70 11.054 5.945 1.413 183 HD1 PHE 70 1HD PHE 70 11.681 5.571 -0.945 184 HD2 PHE 70 2HD PHE 70 13.132 8.960 1.260 185 HE1 PHE 70 1HE PHE 70 13.410 5.959 -2.680 186 HE2 PHE 70 2HE PHE 70 14.862 9.348 -0.476 187 HZ PHE 70 HZ PHE 70 15.001 7.848 -2.444 188 H THR 71 H THR 71 10.587 9.642 2.507 189 HA THR 71 HA THR 71 10.978 11.574 0.270 190 HB THR 71 HB THR 71 10.132 13.058 2.499 191 HG1 THR 71 1HG THR 71 8.843 11.783 3.518 192 HG21 THR 71 1HG2 THR 71 8.043 13.334 1.040 193 HG22 THR 71 2HG2 THR 71 8.808 12.206 -0.078 194 HG23 THR 71 3HG2 THR 71 9.584 13.745 0.294 195 H CYS 72 H CYS 72 12.587 13.173 0.674 196 HA CYS 72 HA CYS 72 14.254 12.707 3.109 197 HB2 CYS 72 2HB CYS 72 15.717 11.779 1.617 198 HB3 CYS 72 1HB CYS 72 15.000 12.609 0.241 199 H GLY 73 H GLY 73 15.634 14.620 3.619 200 HA2 GLY 73 2HA GLY 73 14.064 17.079 3.293 201 HA3 GLY 73 1HA GLY 73 15.474 16.879 4.335 202 H ALA 74 H ALA 74 14.631 18.823 2.097 203 HA ALA 74 HA ALA 74 16.167 20.309 0.968 204 HB1 ALA 74 1HB ALA 74 17.833 17.920 0.182 205 HB2 ALA 74 2HB ALA 74 18.114 18.788 1.697 206 HB3 ALA 74 3HB ALA 74 18.273 19.624 0.155 207 H ASP 75 H ASP 75 13.799 18.980 0.155 208 HA ASP 75 HA ASP 75 12.561 18.568 -1.789 209 HB2 ASP 75 2HB ASP 75 13.691 20.747 -2.417 210 HB3 ASP 75 1HB ASP 75 14.924 19.790 -3.237 211 H CYS 76 H CYS 76 14.119 16.423 -0.829 212 HA CYS 76 HA CYS 76 15.014 15.123 -3.376 213 HB2 CYS 76 2HB CYS 76 16.121 13.565 -1.471 214 HB3 CYS 76 1HB CYS 76 16.939 14.984 -2.124 215 H ARG 77 H ARG 77 13.509 13.679 -4.051 216 HA ARG 77 HA ARG 77 12.091 12.054 -1.979 217 HB2 ARG 77 2HB ARG 77 10.901 13.359 -4.450 218 HB3 ARG 77 1HB ARG 77 10.055 12.186 -3.440 219 HG2 ARG 77 2HG ARG 77 9.494 13.795 -1.977 220 HG3 ARG 77 1HG ARG 77 11.191 14.228 -1.760 221 HD2 ARG 77 2HD ARG 77 9.987 16.179 -2.575 222 HD3 ARG 77 1HD ARG 77 11.052 15.595 -3.855 223 HE ARG 77 HE ARG 77 8.578 14.328 -4.268 224 HH11 ARG 77 1HH1 ARG 77 7.083 15.191 -5.728 225 HH12 ARG 77 2HH1 ARG 77 7.156 16.875 -6.128 226 HH21 ARG 77 1HH2 ARG 77 9.882 17.513 -4.082 227 HH22 ARG 77 2HH2 ARG 77 8.742 18.189 -5.197 228 H GLY 78 H GLY 78 11.543 9.890 -2.702 229 HA2 GLY 78 2HA GLY 78 12.064 8.986 -5.385 230 HA3 GLY 78 1HA GLY 78 13.446 8.617 -4.349 231 H THR 79 H THR 79 12.389 6.423 -5.274 232 HA THR 79 HA THR 79 10.674 5.372 -3.072 233 HB THR 79 HB THR 79 9.553 3.912 -4.678 234 HG1 THR 79 1HG THR 79 11.536 3.987 -6.074 235 HG21 THR 79 1HG2 THR 79 8.103 5.590 -5.001 236 HG22 THR 79 2HG2 THR 79 9.116 6.220 -6.300 237 HG23 THR 79 3HG2 THR 79 9.375 6.757 -4.641 238 H SER 80 H SER 80 10.978 3.021 -2.709 239 HA SER 80 HA SER 80 13.762 2.171 -3.414 240 HB2 SER 80 2HB SER 80 12.084 1.420 -1.002 241 HB3 SER 80 1HB SER 80 13.725 0.863 -1.325 242 HG SER 80 HG SER 80 13.634 3.524 -1.540 243 H GLN 81 H GLN 81 14.054 -0.074 -3.955 244 HA GLN 81 HA GLN 81 11.532 -1.421 -4.821 245 HB2 GLN 81 2HB GLN 81 13.103 -0.728 -6.647 246 HB3 GLN 81 1HB GLN 81 14.318 -1.789 -5.942 247 HG2 GLN 81 2HG GLN 81 13.248 -3.046 -7.678 248 HG3 GLN 81 1HG GLN 81 12.637 -3.678 -6.149 249 HE21 GLN 81 1HE2 GLN 81 10.399 -3.571 -5.799 250 HE22 GLN 81 2HE2 GLN 81 9.318 -2.758 -6.816 251 H TYR 82 H TYR 82 11.077 -3.332 -3.844 252 HA TYR 82 HA TYR 82 13.304 -4.947 -2.735 253 HB2 TYR 82 2HB TYR 82 10.870 -4.019 -1.184 254 HB3 TYR 82 1HB TYR 82 11.978 -5.263 -0.619 255 HD1 TYR 82 1HD TYR 82 14.593 -4.509 -0.916 256 HD2 TYR 82 2HD TYR 82 11.238 -1.885 -0.347 257 HE1 TYR 82 1HE TYR 82 16.110 -2.755 -0.040 258 HE2 TYR 82 2HE TYR 82 12.757 -0.134 0.530 259 HH TYR 82 HH TYR 82 15.743 0.122 0.042 260 HA PRO 83 HA PRO 83 11.256 -8.510 -4.422 261 HB2 PRO 83 2HB PRO 83 11.186 -9.602 -1.638 262 HB3 PRO 83 1HB PRO 83 11.744 -10.367 -3.137 263 HG2 PRO 83 2HG PRO 83 13.459 -9.405 -1.347 264 HG3 PRO 83 1HG PRO 83 13.772 -9.304 -3.087 265 HD2 PRO 83 2HD PRO 83 13.043 -7.142 -1.191 266 HD3 PRO 83 1HD PRO 83 13.933 -7.055 -2.725 267 H CYS 84 H CYS 84 9.480 -10.251 -2.875 268 HA CYS 84 HA CYS 84 6.988 -8.895 -3.377 269 HB2 CYS 84 2HB CYS 84 6.443 -11.077 -3.513 270 HB3 CYS 84 1HB CYS 84 7.869 -11.561 -2.595 271 H VAL 85 H VAL 85 5.471 -8.078 -1.922 272 HA VAL 85 HA VAL 85 6.340 -7.835 0.929 273 HB VAL 85 HB VAL 85 6.693 -5.701 -0.342 274 HG11 VAL 85 1HG1 VAL 85 4.951 -4.596 -1.423 275 HG12 VAL 85 2HG1 VAL 85 3.709 -5.421 -0.482 276 HG13 VAL 85 3HG1 VAL 85 4.553 -6.279 -1.771 277 HG21 VAL 85 1HG2 VAL 85 6.205 -5.659 2.073 278 HG22 VAL 85 2HG2 VAL 85 4.475 -5.668 1.731 279 HG23 VAL 85 3HG2 VAL 85 5.458 -4.278 1.269 280 H GLN 86 H GLN 86 4.581 -7.801 2.458 281 HA GLN 86 HA GLN 86 2.407 -9.488 1.915 282 HB2 GLN 86 2HB GLN 86 2.396 -7.232 3.935 283 HB3 GLN 86 1HB GLN 86 1.456 -8.724 3.997 284 HG2 GLN 86 2HG GLN 86 4.478 -8.516 4.118 285 HG3 GLN 86 1HG GLN 86 3.410 -8.922 5.460 286 HE21 GLN 86 1HE2 GLN 86 5.519 -10.448 3.559 287 HE22 GLN 86 2HE2 GLN 86 4.734 -11.933 3.315 288 H VAL 87 H VAL 87 0.024 -8.268 2.606 289 HA VAL 87 HA VAL 87 -0.380 -6.344 0.348 290 HB VAL 87 HB VAL 87 -2.227 -8.500 1.388 291 HG11 VAL 87 1HG1 VAL 87 -3.612 -6.620 0.864 292 HG12 VAL 87 2HG1 VAL 87 -3.671 -7.666 -0.557 293 HG13 VAL 87 3HG1 VAL 87 -2.654 -6.226 -0.565 294 HG21 VAL 87 1HG2 VAL 87 -0.235 -8.378 -0.686 295 HG22 VAL 87 2HG2 VAL 87 -1.826 -8.552 -1.428 296 HG23 VAL 87 3HG2 VAL 87 -1.272 -9.733 -0.240 297 H TYR 88 H TYR 88 -1.707 -4.589 0.657 298 HA TYR 88 HA TYR 88 -3.475 -4.221 2.838 299 HB2 TYR 88 2HB TYR 88 -1.370 -4.164 4.136 300 HB3 TYR 88 1HB TYR 88 -0.825 -2.820 3.163 301 HD1 TYR 88 1HD TYR 88 -0.600 -1.985 5.660 302 HD2 TYR 88 2HD TYR 88 -4.368 -2.467 3.623 303 HE1 TYR 88 1HE TYR 88 -1.676 -0.416 7.240 304 HE2 TYR 88 2HE TYR 88 -5.416 -0.912 5.196 305 HH TYR 88 HH TYR 88 -3.527 0.866 7.584 306 H VAL 89 H VAL 89 -2.158 -1.274 2.865 307 HA VAL 89 HA VAL 89 -3.292 -0.471 0.228 308 HB VAL 89 HB VAL 89 -4.940 -0.070 2.053 309 HG11 VAL 89 1HG1 VAL 89 -4.458 1.374 3.862 310 HG12 VAL 89 2HG1 VAL 89 -3.010 2.010 3.082 311 HG13 VAL 89 3HG1 VAL 89 -3.014 0.371 3.731 312 HG21 VAL 89 1HG2 VAL 89 -3.693 2.421 0.845 313 HG22 VAL 89 2HG2 VAL 89 -5.327 2.313 1.502 314 HG23 VAL 89 3HG2 VAL 89 -4.892 1.391 0.064 315 H ASN 90 H ASN 90 -2.024 0.918 -0.884 316 HA ASN 90 HA ASN 90 0.432 1.907 0.427 317 HB2 ASN 90 2HB ASN 90 -0.488 1.981 -2.464 318 HB3 ASN 90 1HB ASN 90 1.085 2.521 -1.887 319 HD21 ASN 90 1HD2 ASN 90 0.161 -0.082 0.023 320 HD22 ASN 90 2HD2 ASN 90 0.953 -1.323 -0.821 321 H ASN 91 H ASN 91 0.270 3.902 1.383 322 HA ASN 91 HA ASN 91 -1.779 5.784 0.363 323 HB2 ASN 91 2HB ASN 91 -0.022 5.853 2.834 324 HB3 ASN 91 1HB ASN 91 -1.193 7.103 2.413 325 HD21 ASN 91 1HD2 ASN 91 -1.465 5.586 4.825 326 HD22 ASN 91 2HD2 ASN 91 -2.843 4.603 4.688 327 H SER 92 H SER 92 -0.664 6.347 -1.590 328 HA SER 92 HA SER 92 1.988 7.604 -1.348 329 HB2 SER 92 2HB SER 92 0.699 7.897 -3.933 330 HB3 SER 92 1HB SER 92 2.199 7.074 -3.525 331 HG SER 92 HG SER 92 0.808 5.345 -2.717 332 H GLU 93 H GLU 93 -0.283 8.838 -0.001 333 HA GLU 93 HA GLU 93 -1.300 11.079 -1.471 334 HB2 GLU 93 2HB GLU 93 -0.734 10.940 1.508 335 HB3 GLU 93 1HB GLU 93 -1.907 11.979 0.699 336 HG2 GLU 93 2HG GLU 93 -3.107 9.938 -0.094 337 HG3 GLU 93 1HG GLU 93 -1.979 8.954 0.842 338 H SER 94 H SER 94 1.778 10.287 -0.334 339 HA SER 94 HA SER 94 2.939 12.759 -1.289 340 HB2 SER 94 2HB SER 94 4.006 13.292 0.977 341 HB3 SER 94 1HB SER 94 2.299 13.693 0.816 342 HG SER 94 HG SER 94 1.909 12.328 2.354 343 H ASN 95 H ASN 95 3.388 9.903 0.799 344 HA ASN 95 HA ASN 95 5.290 8.607 -0.786 345 HB2 ASN 95 2HB ASN 95 7.362 9.252 0.735 346 HB3 ASN 95 1HB ASN 95 6.937 10.248 -0.654 347 HD21 ASN 95 1HD2 ASN 95 6.775 10.072 2.892 348 HD22 ASN 95 2HD2 ASN 95 6.390 11.709 3.126 349 H SER 96 H SER 96 3.210 7.851 0.991 350 HA SER 96 HA SER 96 4.773 6.394 3.103 351 HB2 SER 96 2HB SER 96 3.089 8.184 3.881 352 HB3 SER 96 1HB SER 96 1.842 7.072 3.321 353 HG SER 96 HG SER 96 3.867 6.575 5.250 354 H ARG 97 H ARG 97 4.404 4.195 3.276 355 HA ARG 97 HA ARG 97 2.298 3.023 1.525 356 HB2 ARG 97 2HB ARG 97 4.566 2.812 0.468 357 HB3 ARG 97 1HB ARG 97 5.093 1.901 1.882 358 HG2 ARG 97 2HG ARG 97 2.576 0.934 0.674 359 HG3 ARG 97 1HG ARG 97 3.997 0.766 -0.357 360 HD2 ARG 97 2HD ARG 97 4.059 -0.096 2.533 361 HD3 ARG 97 1HD ARG 97 3.466 -1.175 1.270 362 HE ARG 97 HE ARG 97 6.258 -0.337 1.655 363 HH11 ARG 97 1HH1 ARG 97 7.738 -1.412 0.328 364 HH12 ARG 97 2HH1 ARG 97 7.161 -2.348 -1.009 365 HH21 ARG 97 1HH2 ARG 97 3.819 -1.667 -0.389 366 HH22 ARG 97 2HH2 ARG 97 4.943 -2.495 -1.414 367 H ALA 98 H ALA 98 0.932 1.884 2.810 368 HA ALA 98 HA ALA 98 1.927 0.909 5.427 369 HB1 ALA 98 1HB ALA 98 -0.374 2.205 4.812 370 HB2 ALA 98 2HB ALA 98 -0.217 1.122 6.195 371 HB3 ALA 98 3HB ALA 98 -0.920 0.534 4.689 372 H LEU 99 H LEU 99 2.335 -1.223 5.757 373 HA LEU 99 HA LEU 99 1.322 -3.181 3.732 374 HB2 LEU 99 2HB LEU 99 3.333 -4.552 4.341 375 HB3 LEU 99 1HB LEU 99 3.732 -3.017 3.572 376 HG LEU 99 HG LEU 99 3.595 -2.381 6.284 377 HD11 LEU 99 1HD1 LEU 99 4.982 -5.051 5.897 378 HD12 LEU 99 2HD1 LEU 99 3.530 -4.767 6.857 379 HD13 LEU 99 3HD1 LEU 99 5.068 -4.062 7.355 380 HD21 LEU 99 1HD2 LEU 99 5.956 -1.998 6.084 381 HD22 LEU 99 2HD2 LEU 99 5.271 -1.680 4.493 382 HD23 LEU 99 3HD2 LEU 99 6.109 -3.199 4.804 383 H LEU 100 H LEU 100 0.163 -4.889 4.513 384 HA LEU 100 HA LEU 100 0.103 -5.298 7.477 385 HB2 LEU 100 2HB LEU 100 -1.960 -4.158 6.515 386 HB3 LEU 100 1HB LEU 100 -2.253 -5.638 5.607 387 HG LEU 100 HG LEU 100 -2.208 -6.904 7.779 388 HD11 LEU 100 1HD1 LEU 100 -1.120 -5.637 9.377 389 HD12 LEU 100 2HD1 LEU 100 -2.785 -5.189 9.742 390 HD13 LEU 100 3HD1 LEU 100 -1.776 -4.115 8.774 391 HD21 LEU 100 1HD2 LEU 100 -4.403 -5.395 8.543 392 HD22 LEU 100 2HD2 LEU 100 -4.418 -6.678 7.333 393 HD23 LEU 100 3HD2 LEU 100 -4.227 -4.999 6.833 394 H HIS 101 H HIS 101 0.024 -7.474 8.143 395 HA HIS 101 HA HIS 101 0.741 -9.431 6.043 396 HB2 HIS 101 2HB HIS 101 0.625 -9.675 9.066 397 HB3 HIS 101 1HB HIS 101 1.183 -10.943 7.976 398 HD1 HIS 101 1HD HIS 101 2.050 -7.453 7.058 399 HD2 HIS 101 2HD HIS 101 3.840 -10.615 9.106 400 HE1 HIS 101 1HE HIS 101 4.506 -6.873 7.271 401 HE2 HIS 101 2HE HIS 101 5.604 -8.786 8.522 402 H SER 102 H SER 102 -0.855 -10.606 5.108 403 HA SER 102 HA SER 102 -3.572 -10.564 5.939 404 HB2 SER 102 2HB SER 102 -2.120 -12.653 4.293 405 HB3 SER 102 1HB SER 102 -3.867 -12.467 4.383 406 HG SER 102 HG SER 102 -2.331 -11.308 2.693 407 H ASP 103 H ASP 103 -0.972 -12.898 6.581 408 HA ASP 103 HA ASP 103 -2.085 -13.652 9.110 409 HB2 ASP 103 2HB ASP 103 -3.661 -14.791 7.401 410 HB3 ASP 103 1HB ASP 103 -2.296 -15.854 7.060 411 H GLU 104 H GLU 104 -0.722 -15.246 10.186 412 HA GLU 104 HA GLU 104 2.040 -15.052 9.431 413 HB2 GLU 104 2HB GLU 104 1.225 -15.404 11.774 414 HB3 GLU 104 1HB GLU 104 0.770 -17.049 11.327 415 HG2 GLU 104 2HG GLU 104 3.132 -17.487 10.663 416 HG3 GLU 104 1HG GLU 104 3.564 -15.873 11.227 417 H HIS 105 H HIS 105 -0.402 -17.596 9.006 418 HA HIS 105 HA HIS 105 1.309 -19.657 8.090 419 HB2 HIS 105 2HB HIS 105 -1.522 -19.011 7.218 420 HB3 HIS 105 1HB HIS 105 -0.696 -20.541 6.921 421 HD1 HIS 105 1HD HIS 105 0.253 -21.719 9.251 422 HD2 HIS 105 2HD HIS 105 -2.883 -18.992 9.625 423 HE1 HIS 105 1HE HIS 105 -0.806 -22.148 11.514 424 HE2 HIS 105 2HE HIS 105 -2.714 -20.493 11.751 425 H GLN 106 H GLN 106 -0.173 -16.958 6.322 426 HA GLN 106 HA GLN 106 0.704 -17.768 3.728 427 HB2 GLN 106 2HB GLN 106 0.116 -15.010 4.840 428 HB3 GLN 106 1HB GLN 106 0.363 -15.365 3.132 429 HG2 GLN 106 2HG GLN 106 -1.511 -17.027 3.262 430 HG3 GLN 106 1HG GLN 106 -1.813 -16.487 4.914 431 HE21 GLN 106 1HE2 GLN 106 -3.909 -15.557 4.402 432 HE22 GLN 106 2HE2 GLN 106 -4.057 -14.160 3.451 433 H LEU 107 H LEU 107 2.233 -15.810 6.257 434 HA LEU 107 HA LEU 107 4.471 -14.881 4.817 435 HB2 LEU 107 2HB LEU 107 4.000 -14.237 7.168 436 HB3 LEU 107 1HB LEU 107 4.423 -15.869 7.690 437 HG LEU 107 HG LEU 107 6.698 -15.548 6.694 438 HD11 LEU 107 1HD1 LEU 107 6.800 -13.888 5.146 439 HD12 LEU 107 2HD1 LEU 107 6.997 -12.819 6.536 440 HD13 LEU 107 3HD1 LEU 107 5.403 -13.049 5.821 441 HD21 LEU 107 1HD2 LEU 107 5.588 -14.374 9.060 442 HD22 LEU 107 2HD2 LEU 107 6.825 -13.287 8.430 443 HD23 LEU 107 3HD2 LEU 107 7.230 -14.963 8.801 444 H LEU 108 H LEU 108 3.922 -18.024 6.395 445 HA LEU 108 HA LEU 108 6.499 -19.131 5.766 446 HB2 LEU 108 2HB LEU 108 3.842 -20.576 6.066 447 HB3 LEU 108 1HB LEU 108 5.442 -21.308 6.183 448 HG LEU 108 HG LEU 108 4.301 -19.191 8.030 449 HD11 LEU 108 1HD1 LEU 108 4.316 -20.930 9.703 450 HD12 LEU 108 2HD1 LEU 108 5.145 -22.043 8.615 451 HD13 LEU 108 3HD1 LEU 108 3.477 -21.569 8.290 452 HD21 LEU 108 1HD2 LEU 108 6.511 -19.923 9.287 453 HD22 LEU 108 2HD2 LEU 108 6.578 -18.690 8.029 454 HD23 LEU 108 3HD2 LEU 108 7.047 -20.350 7.663 455 H THR 109 H THR 109 3.470 -18.803 4.033 456 HA THR 109 HA THR 109 4.211 -20.470 1.783 457 HB THR 109 HB THR 109 2.118 -18.285 2.008 458 HG1 THR 109 1HG THR 109 1.905 -21.089 2.357 459 HG21 THR 109 1HG2 THR 109 2.356 -20.623 0.114 460 HG22 THR 109 2HG2 THR 109 2.702 -18.943 -0.295 461 HG23 THR 109 3HG2 THR 109 1.063 -19.426 0.137 462 H ASN 110 H ASN 110 4.607 -17.109 2.678 463 HA ASN 110 HA ASN 110 6.077 -16.635 0.123 464 HB2 ASN 110 2HB ASN 110 5.276 -14.139 0.741 465 HB3 ASN 110 1HB ASN 110 4.320 -15.209 -0.284 466 HD21 ASN 110 1HD2 ASN 110 2.448 -16.297 0.701 467 HD22 ASN 110 2HD2 ASN 110 1.781 -15.730 2.155 468 HA PRO 111 HA PRO 111 8.600 -15.870 3.953 469 HB2 PRO 111 2HB PRO 111 10.760 -17.353 3.098 470 HB3 PRO 111 1HB PRO 111 9.464 -17.973 4.129 471 HG2 PRO 111 2HG PRO 111 9.949 -18.385 1.250 472 HG3 PRO 111 1HG PRO 111 9.172 -19.447 2.434 473 HD2 PRO 111 2HD PRO 111 7.819 -17.948 0.542 474 HD3 PRO 111 1HD PRO 111 7.097 -18.558 2.040 475 H LYS 112 H LYS 112 10.468 -14.555 4.086 476 HA LYS 112 HA LYS 112 11.929 -12.864 3.407 477 HB2 LYS 112 2HB LYS 112 11.922 -14.362 0.764 478 HB3 LYS 112 1HB LYS 112 13.071 -13.119 1.246 479 HG2 LYS 112 2HG LYS 112 13.733 -14.529 3.193 480 HG3 LYS 112 1HG LYS 112 12.661 -15.799 2.599 481 HD2 LYS 112 2HD LYS 112 13.935 -15.799 0.445 482 HD3 LYS 112 1HD LYS 112 15.063 -14.643 1.155 483 HE2 LYS 112 2HE LYS 112 16.201 -16.363 2.050 484 HE3 LYS 112 1HE LYS 112 14.789 -16.746 3.032 485 HZ1 LYS 112 1HZ LYS 112 14.010 -18.252 1.462 486 HZ2 LYS 112 2HZ LYS 112 15.684 -18.541 1.482 487 HZ3 LYS 112 3HZ LYS 112 14.990 -17.635 0.224 488 H CYS 113 H CYS 113 9.154 -12.392 3.298 489 HA CYS 113 HA CYS 113 8.932 -10.626 0.891 490 HB2 CYS 113 2HB CYS 113 6.918 -12.261 2.395 491 HB3 CYS 113 1HB CYS 113 6.390 -10.770 1.613 492 H SER 114 H SER 114 7.843 -10.882 4.298 493 HA SER 114 HA SER 114 7.571 -7.949 4.431 494 HB2 SER 114 2HB SER 114 6.614 -8.314 6.608 495 HB3 SER 114 1HB SER 114 5.955 -9.553 5.544 496 HG SER 114 HG SER 114 8.339 -10.194 6.781 497 H TYR 115 H TYR 115 9.946 -10.344 5.135 498 HA TYR 115 HA TYR 115 11.328 -9.047 7.278 499 HB2 TYR 115 2HB TYR 115 12.380 -10.866 5.091 500 HB3 TYR 115 1HB TYR 115 13.274 -10.416 6.544 501 HD1 TYR 115 1HD TYR 115 12.496 -11.143 8.782 502 HD2 TYR 115 2HD TYR 115 10.551 -12.443 5.181 503 HE1 TYR 115 1HE TYR 115 11.350 -12.941 10.049 504 HE2 TYR 115 2HE TYR 115 9.407 -14.241 6.446 505 HH TYR 115 HH TYR 115 10.335 -15.197 9.524 506 H ILE 116 H ILE 116 11.412 -8.603 3.785 507 HA ILE 116 HA ILE 116 13.772 -7.002 3.643 508 HB ILE 116 HB ILE 116 12.422 -5.997 1.602 509 HG12 ILE 116 2HG1 ILE 116 10.868 -8.539 1.881 510 HG13 ILE 116 1HG1 ILE 116 10.321 -7.131 2.793 511 HG21 ILE 116 1HG2 ILE 116 13.681 -8.642 2.058 512 HG22 ILE 116 2HG2 ILE 116 14.048 -7.415 0.845 513 HG23 ILE 116 3HG2 ILE 116 12.691 -8.517 0.605 514 HD11 ILE 116 1HD1 ILE 116 10.225 -5.808 0.729 515 HD12 ILE 116 2HD1 ILE 116 9.238 -7.258 0.566 516 HD13 ILE 116 3HD1 ILE 116 10.825 -7.183 -0.197 517 HA PRO 117 HA PRO 117 13.040 -3.117 5.613 518 HB2 PRO 117 2HB PRO 117 13.118 -2.008 2.824 519 HB3 PRO 117 1HB PRO 117 13.918 -1.413 4.292 520 HG2 PRO 117 2HG PRO 117 15.199 -2.868 2.416 521 HG3 PRO 117 1HG PRO 117 15.627 -2.910 4.131 522 HD2 PRO 117 2HD PRO 117 14.428 -5.023 2.499 523 HD3 PRO 117 1HD PRO 117 15.103 -5.130 4.139 524 HA PRO 118 HA PRO 118 8.622 -3.041 4.361 525 HB2 PRO 118 2HB PRO 118 7.557 -3.432 6.815 526 HB3 PRO 118 1HB PRO 118 8.221 -4.765 5.853 527 HG2 PRO 118 2HG PRO 118 9.331 -3.418 8.230 528 HG3 PRO 118 1HG PRO 118 9.566 -5.074 7.652 529 HD2 PRO 118 2HD PRO 118 11.343 -2.866 7.306 530 HD3 PRO 118 1HD PRO 118 11.496 -4.486 6.596 531 H CYS 119 H CYS 119 7.246 -1.254 4.362 532 HA CYS 119 HA CYS 119 8.071 1.049 6.058 533 HB2 CYS 119 2HB CYS 119 6.053 1.368 3.885 534 HB3 CYS 119 1HB CYS 119 7.359 2.449 4.369 535 H LYS 120 H LYS 120 6.882 1.092 7.934 536 HA LYS 120 HA LYS 120 4.045 0.192 7.819 537 HB2 LYS 120 2HB LYS 120 5.885 0.699 10.175 538 HB3 LYS 120 1HB LYS 120 4.208 0.168 10.307 539 HG2 LYS 120 2HG LYS 120 4.774 -1.833 8.924 540 HG3 LYS 120 1HG LYS 120 6.463 -1.323 8.935 541 HD2 LYS 120 2HD LYS 120 6.423 -1.395 11.434 542 HD3 LYS 120 1HD LYS 120 4.781 -2.038 11.354 543 HE2 LYS 120 2HE LYS 120 5.883 -3.806 9.730 544 HE3 LYS 120 1HE LYS 120 7.365 -3.339 10.564 545 HZ1 LYS 120 1HZ LYS 120 5.661 -5.195 11.457 546 HZ2 LYS 120 2HZ LYS 120 5.088 -3.824 12.281 547 HZ3 LYS 120 3HZ LYS 120 6.706 -4.309 12.457 548 H ARG 121 H ARG 121 2.371 1.596 8.252 549 HA ARG 121 HA ARG 121 2.780 4.417 7.976 550 HB2 ARG 121 2HB ARG 121 0.641 3.119 7.519 551 HB3 ARG 121 1HB ARG 121 0.390 3.071 9.259 552 HG2 ARG 121 2HG ARG 121 0.511 5.561 9.315 553 HG3 ARG 121 1HG ARG 121 0.633 5.565 7.555 554 HD2 ARG 121 2HD ARG 121 -1.669 4.408 9.154 555 HD3 ARG 121 1HD ARG 121 -1.699 5.937 8.280 556 HE ARG 121 HE ARG 121 -1.025 4.206 6.294 557 HH11 ARG 121 1HH1 ARG 121 -2.482 2.959 5.097 558 HH12 ARG 121 2HH1 ARG 121 -3.998 2.506 5.803 559 HH21 ARG 121 1HH2 ARG 121 -3.378 4.116 8.811 560 HH22 ARG 121 2HH2 ARG 121 -4.504 3.161 7.906 561 H GLU 122 H GLU 122 2.188 2.344 10.775 562 HA GLU 122 HA GLU 122 3.132 4.564 12.528 563 HB2 GLU 122 2HB GLU 122 0.942 2.553 13.136 564 HB3 GLU 122 1HB GLU 122 1.554 3.770 14.257 565 HG2 GLU 122 2HG GLU 122 0.872 5.551 12.665 566 HG3 GLU 122 1HG GLU 122 0.198 4.315 11.602 567 H ASN 123 H ASN 123 4.371 3.871 14.350 568 HA ASN 123 HA ASN 123 6.117 1.683 13.915 569 HB2 ASN 123 2HB ASN 123 5.387 2.889 16.594 570 HB3 ASN 123 1HB ASN 123 6.891 2.066 16.176 571 HD21 ASN 123 1HD2 ASN 123 5.006 5.026 15.625 572 HD22 ASN 123 2HD2 ASN 123 6.297 5.940 15.005 573 H GLN 124 H GLN 124 3.099 1.909 15.742 574 HA GLN 124 HA GLN 124 3.252 -1.034 16.237 575 HB2 GLN 124 2HB GLN 124 1.718 1.109 17.737 576 HB3 GLN 124 1HB GLN 124 1.652 -0.618 18.093 577 HG2 GLN 124 2HG GLN 124 4.065 -0.636 18.554 578 HG3 GLN 124 1HG GLN 124 4.164 1.080 18.158 579 HE21 GLN 124 1HE2 GLN 124 4.905 0.147 20.752 580 HE22 GLN 124 2HE2 GLN 124 3.773 0.721 21.879 581 H LYS 125 H LYS 125 1.325 -2.269 15.872 582 HA LYS 125 HA LYS 125 -0.815 -0.881 14.337 583 HB2 LYS 125 2HB LYS 125 -0.839 -2.637 12.670 584 HB3 LYS 125 1HB LYS 125 0.812 -2.032 12.794 585 HG2 LYS 125 2HG LYS 125 1.322 -3.908 14.379 586 HG3 LYS 125 1HG LYS 125 -0.293 -4.549 14.075 587 HD2 LYS 125 2HD LYS 125 0.307 -4.533 11.597 588 HD3 LYS 125 1HD LYS 125 1.972 -4.230 12.096 589 HE2 LYS 125 2HE LYS 125 0.270 -6.604 12.910 590 HE3 LYS 125 1HE LYS 125 1.627 -6.635 11.784 591 HZ1 LYS 125 1HZ LYS 125 1.653 -6.206 14.700 592 HZ2 LYS 125 2HZ LYS 125 2.929 -5.632 13.735 593 HZ3 LYS 125 3HZ LYS 125 2.568 -7.293 13.774 594 H ASN 126 H ASN 126 -2.821 -2.293 14.200 595 HA ASN 126 HA ASN 126 -3.155 -3.718 16.793 596 HB2 ASN 126 2HB ASN 126 -4.694 -1.799 16.125 597 HB3 ASN 126 1HB ASN 126 -5.335 -2.864 14.873 598 HD21 ASN 126 1HD2 ASN 126 -7.264 -2.213 16.601 599 HD22 ASN 126 2HD2 ASN 126 -7.554 -3.425 17.753 600 H LEU 127 H LEU 127 -3.156 -5.909 16.738 601 HA LEU 127 HA LEU 127 -2.986 -7.433 14.339 602 HB2 LEU 127 2HB LEU 127 -3.822 -8.266 17.133 603 HB3 LEU 127 1HB LEU 127 -3.483 -9.394 15.822 604 HG LEU 127 HG LEU 127 -1.199 -8.328 15.613 605 HD11 LEU 127 1HD1 LEU 127 -2.291 -6.826 17.969 606 HD12 LEU 127 2HD1 LEU 127 -1.282 -6.248 16.644 607 HD13 LEU 127 3HD1 LEU 127 -0.573 -7.219 17.933 608 HD21 LEU 127 1HD2 LEU 127 -0.276 -9.570 17.486 609 HD22 LEU 127 2HD2 LEU 127 -1.664 -10.460 16.858 610 HD23 LEU 127 3HD2 LEU 127 -1.821 -9.511 18.335 611 H GLU 128 H GLU 128 -5.750 -6.543 16.359 612 HA GLU 128 HA GLU 128 -7.691 -8.241 15.185 613 HB2 GLU 128 2HB GLU 128 -8.057 -6.816 17.214 614 HB3 GLU 128 1HB GLU 128 -8.126 -5.403 16.162 615 HG2 GLU 128 2HG GLU 128 -10.015 -6.460 14.923 616 HG3 GLU 128 1HG GLU 128 -9.982 -7.798 16.071 617 H SER 129 H SER 129 -6.325 -5.186 14.091 618 HA SER 129 HA SER 129 -8.193 -4.582 12.036 619 HB2 SER 129 2HB SER 129 -6.446 -3.199 11.080 620 HB3 SER 129 1HB SER 129 -6.349 -3.070 12.834 621 HG SER 129 HG SER 129 -4.905 -5.127 11.666 622 H VAL 130 H VAL 130 -5.486 -6.841 12.129 623 HA VAL 130 HA VAL 130 -5.274 -7.350 9.342 624 HB VAL 130 HB VAL 130 -4.794 -9.146 11.732 625 HG11 VAL 130 1HG1 VAL 130 -4.886 -10.807 10.169 626 HG12 VAL 130 2HG1 VAL 130 -3.297 -10.195 9.709 627 HG13 VAL 130 3HG1 VAL 130 -4.730 -9.680 8.820 628 HG21 VAL 130 1HG2 VAL 130 -2.413 -8.661 11.157 629 HG22 VAL 130 2HG2 VAL 130 -3.311 -7.202 11.573 630 HG23 VAL 130 3HG2 VAL 130 -2.967 -7.576 9.884 631 H MET 131 H MET 131 -7.381 -8.866 11.803 632 HA MET 131 HA MET 131 -8.542 -10.806 10.071 633 HB2 MET 131 2HB MET 131 -8.849 -10.680 12.581 634 HB3 MET 131 1HB MET 131 -9.977 -9.351 12.309 635 HG2 MET 131 2HG MET 131 -10.674 -11.487 10.537 636 HG3 MET 131 1HG MET 131 -10.499 -12.154 12.160 637 HE1 MET 131 1HE MET 131 -12.404 -9.868 9.759 638 HE2 MET 131 2HE MET 131 -14.001 -10.127 10.454 639 HE3 MET 131 3HE MET 131 -13.011 -11.511 9.998 640 H ASN 132 H ASN 132 -9.380 -7.427 10.712 641 HA ASN 132 HA ASN 132 -11.764 -7.320 9.165 642 HB2 ASN 132 2HB ASN 132 -9.694 -5.210 9.783 643 HB3 ASN 132 1HB ASN 132 -11.239 -4.869 9.018 644 HD21 ASN 132 1HD2 ASN 132 -10.596 -3.750 11.570 645 HD22 ASN 132 2HD2 ASN 132 -11.606 -4.453 12.738 646 H TRP 133 H TRP 133 -8.359 -6.886 8.274 647 HA TRP 133 HA TRP 133 -8.761 -6.009 5.607 648 HB2 TRP 133 2HB TRP 133 -6.545 -5.914 6.538 649 HB3 TRP 133 1HB TRP 133 -6.535 -7.652 6.838 650 HD1 TRP 133 HD TRP 133 -6.058 -5.077 4.101 651 HE1 TRP 133 1HE TRP 133 -5.215 -6.248 1.968 652 HE3 TRP 133 3HE TRP 133 -6.605 -9.958 5.500 653 HZ2 TRP 133 2HZ TRP 133 -4.824 -8.904 0.982 654 HZ3 TRP 133 3HZ TRP 133 -5.996 -11.784 3.943 655 HH2 TRP 133 HH TRP 133 -5.104 -11.267 1.689 656 H GLN 134 H GLN 134 -8.445 -9.329 6.881 657 HA GLN 134 HA GLN 134 -8.631 -10.632 4.353 658 HB2 GLN 134 2HB GLN 134 -7.959 -11.735 6.500 659 HB3 GLN 134 1HB GLN 134 -9.643 -11.666 7.016 660 HG2 GLN 134 2HG GLN 134 -9.788 -12.765 4.464 661 HG3 GLN 134 1HG GLN 134 -8.353 -13.517 5.164 662 HE21 GLN 134 1HE2 GLN 134 -11.800 -12.837 5.924 663 HE22 GLN 134 2HE2 GLN 134 -12.010 -14.201 6.913 664 H GLN 135 H GLN 135 -11.174 -9.791 6.717 665 HA GLN 135 HA GLN 135 -13.316 -10.832 5.084 666 HB2 GLN 135 2HB GLN 135 -13.447 -10.434 7.568 667 HB3 GLN 135 1HB GLN 135 -13.484 -8.704 7.233 668 HG2 GLN 135 2HG GLN 135 -15.498 -9.095 5.781 669 HG3 GLN 135 1HG GLN 135 -15.502 -10.773 6.324 670 HE21 GLN 135 1HE2 GLN 135 -16.994 -11.063 7.977 671 HE22 GLN 135 2HE2 GLN 135 -17.333 -9.934 9.199 672 H TYR 136 H TYR 136 -12.083 -7.545 5.664 673 HA TYR 136 HA TYR 136 -13.911 -6.261 3.852 674 HB2 TYR 136 2HB TYR 136 -12.780 -4.990 5.585 675 HB3 TYR 136 1HB TYR 136 -11.208 -5.377 4.884 676 HD1 TYR 136 1HD TYR 136 -14.130 -3.225 4.689 677 HD2 TYR 136 2HD TYR 136 -10.644 -4.583 2.583 678 HE1 TYR 136 1HE TYR 136 -14.327 -1.307 3.128 679 HE2 TYR 136 2HE TYR 136 -10.838 -2.669 1.028 680 HH TYR 136 HH TYR 136 -11.865 -0.703 0.644 681 H TRP 137 H TRP 137 -10.571 -7.408 3.455 682 HA TRP 137 HA TRP 137 -10.170 -6.393 0.826 683 HB2 TRP 137 2HB TRP 137 -8.365 -7.257 2.298 684 HB3 TRP 137 1HB TRP 137 -9.010 -8.886 2.114 685 HD1 TRP 137 HD TRP 137 -6.768 -6.390 0.488 686 HE1 TRP 137 1HE TRP 137 -5.872 -7.339 -1.736 687 HE3 TRP 137 3HE TRP 137 -9.758 -10.468 0.036 688 HZ2 TRP 137 2HZ TRP 137 -6.365 -9.564 -3.475 689 HZ3 TRP 137 3HZ TRP 137 -9.538 -12.000 -1.907 690 HH2 TRP 137 HH TRP 137 -7.844 -11.550 -3.662 691 H LYS 138 H LYS 138 -11.444 -9.521 1.953 692 HA LYS 138 HA LYS 138 -11.880 -10.522 -0.745 693 HB2 LYS 138 2HB LYS 138 -11.591 -11.995 1.267 694 HB3 LYS 138 1HB LYS 138 -13.164 -11.445 1.841 695 HG2 LYS 138 2HG LYS 138 -14.200 -12.272 -0.259 696 HG3 LYS 138 1HG LYS 138 -12.626 -12.877 -0.777 697 HD2 LYS 138 2HD LYS 138 -12.544 -14.273 1.310 698 HD3 LYS 138 1HD LYS 138 -14.194 -13.761 1.662 699 HE2 LYS 138 2HE LYS 138 -14.827 -14.637 -0.645 700 HE3 LYS 138 1HE LYS 138 -13.228 -15.376 -0.706 701 HZ1 LYS 138 1HZ LYS 138 -13.812 -16.945 0.756 702 HZ2 LYS 138 2HZ LYS 138 -15.410 -16.530 0.357 703 HZ3 LYS 138 3HZ LYS 138 -14.676 -15.868 1.740 704 H ASP 139 H ASP 139 -13.774 -8.764 1.630 705 HA ASP 139 HA ASP 139 -16.354 -9.127 0.558 706 HB2 ASP 139 2HB ASP 139 -15.878 -8.059 2.739 707 HB3 ASP 139 1HB ASP 139 -15.278 -6.633 1.891 708 H GLU 140 H GLU 140 -13.884 -6.714 -0.443 709 HA GLU 140 HA GLU 140 -15.595 -6.249 -2.830 710 HB2 GLU 140 2HB GLU 140 -14.425 -4.041 -1.126 711 HB3 GLU 140 1HB GLU 140 -15.322 -3.817 -2.629 712 HG2 GLU 140 2HG GLU 140 -17.281 -4.959 -1.586 713 HG3 GLU 140 1HG GLU 140 -16.383 -5.048 -0.069 714 H ILE 141 H ILE 141 -12.415 -5.482 -1.369 715 HA ILE 141 HA ILE 141 -11.142 -4.585 -3.696 716 HB ILE 141 HB ILE 141 -9.931 -6.323 -1.527 717 HG12 ILE 141 2HG1 ILE 141 -10.069 -3.303 -1.839 718 HG13 ILE 141 1HG1 ILE 141 -11.015 -4.249 -0.690 719 HG21 ILE 141 1HG2 ILE 141 -8.878 -5.249 -3.984 720 HG22 ILE 141 2HG2 ILE 141 -8.051 -6.215 -2.763 721 HG23 ILE 141 3HG2 ILE 141 -8.094 -4.459 -2.620 722 HD11 ILE 141 1HD1 ILE 141 -8.424 -3.203 -0.304 723 HD12 ILE 141 2HD1 ILE 141 -8.220 -4.944 -0.474 724 HD13 ILE 141 3HD1 ILE 141 -9.294 -4.301 0.763 725 H GLY 142 H GLY 142 -11.181 -7.979 -2.532 726 HA2 GLY 142 2HA GLY 142 -10.829 -9.968 -3.738 727 HA3 GLY 142 1HA GLY 142 -11.720 -9.160 -5.028 728 H SER 143 H SER 143 -8.766 -7.757 -3.827 729 HA SER 143 HA SER 143 -6.589 -7.694 -4.748 730 HB2 SER 143 2HB SER 143 -7.326 -10.187 -5.439 731 HB3 SER 143 1HB SER 143 -7.313 -9.463 -7.042 732 HG SER 143 HG SER 143 -5.252 -10.190 -5.472 733 H GLN 144 H GLN 144 -7.691 -5.511 -5.235 734 HA GLN 144 HA GLN 144 -7.398 -5.013 -8.132 735 HB2 GLN 144 2HB GLN 144 -9.761 -5.385 -8.017 736 HB3 GLN 144 1HB GLN 144 -9.904 -4.419 -6.549 737 HG2 GLN 144 2HG GLN 144 -9.822 -2.431 -7.684 738 HG3 GLN 144 1HG GLN 144 -8.711 -3.055 -8.903 739 HE21 GLN 144 1HE2 GLN 144 -9.752 -2.943 -10.900 740 HE22 GLN 144 2HE2 GLN 144 -11.361 -3.402 -11.184 741 HA PRO 145 HA PRO 145 -5.415 -1.779 -5.453 742 HB2 PRO 145 2HB PRO 145 -3.560 -1.581 -7.717 743 HB3 PRO 145 1HB PRO 145 -3.217 -1.921 -6.016 744 HG2 PRO 145 2HG PRO 145 -3.036 -3.756 -8.016 745 HG3 PRO 145 1HG PRO 145 -3.291 -4.152 -6.315 746 HD2 PRO 145 2HD PRO 145 -5.222 -4.238 -8.567 747 HD3 PRO 145 1HD PRO 145 -5.228 -5.142 -7.040 748 H PHE 146 H PHE 146 -5.300 0.588 -5.911 749 HA PHE 146 HA PHE 146 -6.292 1.372 -8.577 750 HB2 PHE 146 2HB PHE 146 -7.984 2.889 -7.537 751 HB3 PHE 146 1HB PHE 146 -8.343 1.178 -7.330 752 HD1 PHE 146 1HD PHE 146 -8.244 4.264 -5.725 753 HD2 PHE 146 2HD PHE 146 -7.213 0.143 -5.067 754 HE1 PHE 146 1HE PHE 146 -8.374 4.619 -3.278 755 HE2 PHE 146 2HE PHE 146 -7.323 0.513 -2.623 756 HZ PHE 146 HZ PHE 146 -7.904 2.744 -1.725 757 H THR 147 H THR 147 -5.852 3.537 -9.142 758 HA THR 147 HA THR 147 -3.844 4.863 -7.377 759 HB THR 147 HB THR 147 -2.850 5.795 -9.403 760 HG1 THR 147 1HG THR 147 -3.961 5.843 -11.163 761 HG21 THR 147 1HG2 THR 147 -3.160 2.893 -8.995 762 HG22 THR 147 2HG2 THR 147 -1.694 3.859 -9.164 763 HG23 THR 147 3HG2 THR 147 -2.589 3.355 -10.599 764 H CYS 148 H CYS 148 -3.940 7.197 -7.378 765 HA CYS 148 HA CYS 148 -6.481 8.344 -8.371 766 HB2 CYS 148 2HB CYS 148 -5.670 9.286 -5.692 767 HB3 CYS 148 1HB CYS 148 -7.267 8.845 -6.289 768 H TYR 149 H TYR 149 -6.378 10.700 -8.530 769 HA TYR 149 HA TYR 149 -3.651 11.869 -8.267 770 HB2 TYR 149 2HB TYR 149 -5.334 12.016 -10.789 771 HB3 TYR 149 1HB TYR 149 -3.859 12.930 -10.504 772 HD1 TYR 149 1HD TYR 149 -1.689 11.738 -10.192 773 HD2 TYR 149 2HD TYR 149 -5.267 9.696 -11.401 774 HE1 TYR 149 1HE TYR 149 -0.329 9.808 -10.958 775 HE2 TYR 149 2HE TYR 149 -3.910 7.766 -12.166 776 HH TYR 149 HH TYR 149 -1.597 6.803 -11.590 777 H PHE 150 H PHE 150 -3.789 13.935 -7.417 778 HA PHE 150 HA PHE 150 -6.363 15.352 -7.705 779 HB2 PHE 150 2HB PHE 150 -7.053 14.955 -5.599 780 HB3 PHE 150 1HB PHE 150 -5.699 13.848 -5.410 781 HD1 PHE 150 1HD PHE 150 -7.120 16.977 -4.426 782 HD2 PHE 150 2HD PHE 150 -3.430 14.825 -4.751 783 HE1 PHE 150 1HE PHE 150 -6.086 18.544 -2.809 784 HE2 PHE 150 2HE PHE 150 -2.370 16.373 -3.145 785 HZ PHE 150 HZ PHE 150 -3.700 18.239 -2.158 786 H ASN 151 H ASN 151 -6.221 17.618 -7.333 787 HA ASN 151 HA ASN 151 -3.515 18.681 -6.739 788 HB2 ASN 151 2HB ASN 151 -3.453 20.021 -8.725 789 HB3 ASN 151 1HB ASN 151 -3.777 18.366 -9.219 790 HD21 ASN 151 1HD2 ASN 151 -4.531 20.773 -10.742 791 HD22 ASN 151 2HD2 ASN 151 -6.224 20.767 -10.852 792 H GLN 152 H GLN 152 -3.793 20.142 -5.182 793 HA GLN 152 HA GLN 152 -6.330 21.625 -4.893 794 HB2 GLN 152 2HB GLN 152 -5.329 20.662 -2.864 795 HB3 GLN 152 1HB GLN 152 -3.835 21.544 -3.163 796 HG2 GLN 152 2HG GLN 152 -5.014 23.676 -2.924 797 HG3 GLN 152 1HG GLN 152 -6.541 22.827 -2.699 798 HE21 GLN 152 1HE2 GLN 152 -5.835 24.476 -0.620 799 HE22 GLN 152 2HE2 GLN 152 -5.269 23.579 0.704 800 H HIS 153 H HIS 153 -3.090 22.039 -6.059 801 HA HIS 153 HA HIS 153 -2.672 24.788 -5.703 802 HB2 HIS 153 2HB HIS 153 -1.084 24.659 -7.460 803 HB3 HIS 153 1HB HIS 153 -1.092 23.059 -6.730 804 HD1 HIS 153 1HD HIS 153 -2.920 24.842 -9.578 805 HD2 HIS 153 2HD HIS 153 -1.423 21.068 -8.605 806 HE1 HIS 153 1HE HIS 153 -3.295 23.375 -11.611 807 HE2 HIS 153 2HE HIS 153 -2.380 21.082 -11.033 808 H GLN 154 H GLN 154 -4.930 23.180 -7.836 809 HA GLN 154 HA GLN 154 -5.346 25.420 -9.613 810 HB2 GLN 154 2HB GLN 154 -6.113 23.064 -10.076 811 HB3 GLN 154 1HB GLN 154 -7.343 23.275 -8.830 812 HG2 GLN 154 2HG GLN 154 -8.293 25.177 -10.068 813 HG3 GLN 154 1HG GLN 154 -7.051 24.999 -11.308 814 HE21 GLN 154 1HE2 GLN 154 -9.624 24.774 -12.237 815 HE22 GLN 154 2HE2 GLN 154 -10.017 23.154 -12.557 816 H ARG 155 H ARG 155 -7.467 24.176 -7.019 817 HA ARG 155 HA ARG 155 -7.682 26.728 -5.742 818 HB2 ARG 155 2HB ARG 155 -9.363 26.421 -8.009 819 HB3 ARG 155 1HB ARG 155 -10.396 26.320 -6.584 820 HG2 ARG 155 2HG ARG 155 -8.347 28.505 -7.048 821 HG3 ARG 155 1HG ARG 155 -10.066 28.667 -7.403 822 HD2 ARG 155 2HD ARG 155 -10.303 27.828 -4.884 823 HD3 ARG 155 1HD ARG 155 -8.683 28.511 -4.755 824 HE ARG 155 HE ARG 155 -10.052 30.539 -5.972 825 HH11 ARG 155 1HH1 ARG 155 -11.261 32.107 -4.878 826 HH12 ARG 155 2HH1 ARG 155 -11.940 31.734 -3.329 827 HH21 ARG 155 1HH2 ARG 155 -10.686 28.500 -3.264 828 HH22 ARG 155 2HH2 ARG 155 -11.615 29.692 -2.415 829 HA PRO 156 HA PRO 156 -10.308 23.557 -3.480 830 HB2 PRO 156 2HB PRO 156 -11.831 21.794 -4.773 831 HB3 PRO 156 1HB PRO 156 -12.181 23.530 -4.892 832 HG2 PRO 156 2HG PRO 156 -11.037 21.710 -6.909 833 HG3 PRO 156 1HG PRO 156 -11.918 23.231 -7.129 834 HD2 PRO 156 2HD PRO 156 -9.029 22.809 -7.081 835 HD3 PRO 156 1HD PRO 156 -9.924 24.292 -7.457 836 H ASP 157 H ASP 157 -10.524 20.807 -5.479 837 HA ASP 157 HA ASP 157 -7.973 19.592 -4.936 838 HB2 ASP 157 2HB ASP 157 -8.758 17.956 -3.235 839 HB3 ASP 157 1HB ASP 157 -8.826 19.608 -2.627 840 H ASP 158 H ASP 158 -8.698 19.376 -7.305 841 HA ASP 158 HA ASP 158 -10.881 17.710 -8.072 842 HB2 ASP 158 2HB ASP 158 -9.386 19.075 -9.625 843 HB3 ASP 158 1HB ASP 158 -8.189 17.790 -9.466 844 H VAL 159 H VAL 159 -10.953 15.384 -8.429 845 HA VAL 159 HA VAL 159 -8.615 13.879 -7.351 846 HB VAL 159 HB VAL 159 -10.234 14.205 -5.505 847 HG11 VAL 159 1HG1 VAL 159 -12.183 12.395 -6.860 848 HG12 VAL 159 2HG1 VAL 159 -12.169 14.088 -7.356 849 HG13 VAL 159 3HG1 VAL 159 -12.469 13.666 -5.671 850 HG21 VAL 159 1HG2 VAL 159 -10.035 12.022 -4.740 851 HG22 VAL 159 2HG2 VAL 159 -8.883 11.986 -6.074 852 HG23 VAL 159 3HG2 VAL 159 -10.504 11.326 -6.292 853 H LEU 160 H LEU 160 -8.368 11.796 -8.167 854 HA LEU 160 HA LEU 160 -10.321 10.913 -10.253 855 HB2 LEU 160 2HB LEU 160 -7.495 11.564 -10.534 856 HB3 LEU 160 1HB LEU 160 -7.827 9.904 -11.025 857 HG LEU 160 HG LEU 160 -8.077 11.517 -12.908 858 HD11 LEU 160 1HD1 LEU 160 -9.686 10.174 -13.744 859 HD12 LEU 160 2HD1 LEU 160 -10.879 10.772 -12.590 860 HD13 LEU 160 3HD1 LEU 160 -9.795 9.455 -12.137 861 HD21 LEU 160 1HD2 LEU 160 -9.157 13.188 -11.043 862 HD22 LEU 160 2HD2 LEU 160 -10.620 12.566 -11.805 863 HD23 LEU 160 3HD2 LEU 160 -9.397 13.379 -12.780 864 H LEU 161 H LEU 161 -10.561 8.596 -10.366 865 HA LEU 161 HA LEU 161 -9.148 7.079 -8.212 866 HB2 LEU 161 2HB LEU 161 -11.492 7.742 -7.558 867 HB3 LEU 161 1HB LEU 161 -12.074 6.745 -8.892 868 HG LEU 161 HG LEU 161 -10.441 4.956 -7.736 869 HD11 LEU 161 1HD1 LEU 161 -11.511 6.489 -5.363 870 HD12 LEU 161 2HD1 LEU 161 -9.878 6.741 -5.980 871 HD13 LEU 161 3HD1 LEU 161 -10.355 5.157 -5.369 872 HD21 LEU 161 1HD2 LEU 161 -13.259 5.658 -6.861 873 HD22 LEU 161 2HD2 LEU 161 -12.463 4.119 -6.526 874 HD23 LEU 161 3HD2 LEU 161 -12.805 4.591 -8.190 875 H HIS 162 H HIS 162 -7.968 6.629 -10.463 876 HA HIS 162 HA HIS 162 -9.266 4.815 -12.301 877 HB2 HIS 162 2HB HIS 162 -6.324 5.289 -11.714 878 HB3 HIS 162 1HB HIS 162 -6.927 4.316 -13.056 879 HD1 HIS 162 1HD HIS 162 -5.299 6.821 -13.711 880 HD2 HIS 162 2HD HIS 162 -9.453 6.847 -13.331 881 HE1 HIS 162 1HE HIS 162 -6.125 8.843 -14.998 882 HE2 HIS 162 2HE HIS 162 -8.652 8.867 -14.773 883 H ARG 163 H ARG 163 -8.870 2.473 -12.451 884 HA ARG 163 HA ARG 163 -8.226 1.266 -9.783 885 HB2 ARG 163 2HB ARG 163 -10.137 0.310 -11.929 886 HB3 ARG 163 1HB ARG 163 -9.759 -0.578 -10.453 887 HG2 ARG 163 2HG ARG 163 -10.547 1.379 -9.119 888 HG3 ARG 163 1HG ARG 163 -11.021 2.174 -10.621 889 HD2 ARG 163 2HD ARG 163 -12.475 0.175 -11.125 890 HD3 ARG 163 1HD ARG 163 -12.116 -0.422 -9.505 891 HE ARG 163 HE ARG 163 -13.062 2.248 -9.263 892 HH11 ARG 163 1HH1 ARG 163 -15.215 2.594 -8.670 893 HH12 ARG 163 2HH1 ARG 163 -16.375 1.329 -8.898 894 HH21 ARG 163 1HH2 ARG 163 -14.078 -0.901 -10.232 895 HH22 ARG 163 2HH2 ARG 163 -15.732 -0.650 -9.781 896 H THR 164 H THR 164 -7.223 -0.870 -9.827 897 HA THR 164 HA THR 164 -5.590 -1.318 -12.295 898 HB THR 164 HB THR 164 -4.875 -2.176 -9.483 899 HG1 THR 164 1HG THR 164 -3.401 -0.353 -9.680 900 HG21 THR 164 1HG2 THR 164 -2.597 -2.302 -10.512 901 HG22 THR 164 2HG2 THR 164 -3.329 -1.948 -12.077 902 HG23 THR 164 3HG2 THR 164 -3.748 -3.433 -11.223 903 H HIS 165 H HIS 165 -5.549 -3.392 -13.153 904 HA HIS 165 HA HIS 165 -7.324 -5.397 -11.809 905 HB2 HIS 165 2HB HIS 165 -6.707 -5.057 -14.760 906 HB3 HIS 165 1HB HIS 165 -7.755 -6.294 -14.069 907 HD1 HIS 165 1HD HIS 165 -9.809 -5.216 -12.529 908 HD2 HIS 165 2HD HIS 165 -8.086 -2.757 -15.427 909 HE1 HIS 165 1HE HIS 165 -11.453 -3.333 -12.944 910 HE2 HIS 165 2HE HIS 165 -10.416 -1.832 -14.705 911 H ASP 166 H ASP 166 -6.491 -7.449 -11.483 912 HA ASP 166 HA ASP 166 -4.742 -8.982 -11.092 913 HB2 ASP 166 2HB ASP 166 -4.359 -8.281 -14.018 914 HB3 ASP 166 1HB ASP 166 -3.574 -9.643 -13.217 Start of MODEL 18 1 H1 GLN 45 1HT GLN 45 4.962 16.038 -4.344 2 H2 GLN 45 2HT GLN 45 6.307 16.910 -4.910 3 H3 GLN 45 3HT GLN 45 4.761 17.615 -4.932 4 HA GLN 45 HA GLN 45 6.169 16.795 -2.453 5 HB2 GLN 45 2HB GLN 45 5.923 19.515 -3.777 6 HB3 GLN 45 1HB GLN 45 6.538 19.245 -2.146 7 HG2 GLN 45 2HG GLN 45 8.344 17.840 -3.036 8 HG3 GLN 45 1HG GLN 45 7.718 18.053 -4.671 9 HE21 GLN 45 1HE2 GLN 45 10.362 18.898 -4.032 10 HE22 GLN 45 2HE2 GLN 45 10.423 20.592 -4.089 11 H ASP 46 H ASP 46 4.985 17.370 -0.575 12 HA ASP 46 HA ASP 46 2.170 17.211 -0.703 13 HB2 ASP 46 2HB ASP 46 3.973 18.379 1.432 14 HB3 ASP 46 1HB ASP 46 2.242 18.127 1.652 15 H LEU 47 H LEU 47 4.280 20.061 -0.527 16 HA LEU 47 HA LEU 47 2.216 22.020 -0.314 17 HB2 LEU 47 2HB LEU 47 4.892 22.268 -1.727 18 HB3 LEU 47 1HB LEU 47 3.894 23.602 -1.147 19 HG LEU 47 HG LEU 47 5.151 21.445 0.576 20 HD11 LEU 47 1HD1 LEU 47 5.746 24.393 0.190 21 HD12 LEU 47 2HD1 LEU 47 6.813 23.037 -0.175 22 HD13 LEU 47 3HD1 LEU 47 6.414 23.418 1.501 23 HD21 LEU 47 1HD2 LEU 47 3.246 21.994 1.781 24 HD22 LEU 47 2HD2 LEU 47 3.143 23.610 1.083 25 HD23 LEU 47 3HD2 LEU 47 4.332 23.265 2.340 26 H GLN 48 H GLN 48 3.579 20.284 -3.050 27 HA GLN 48 HA GLN 48 1.823 21.787 -4.920 28 HB2 GLN 48 2HB GLN 48 4.240 21.422 -5.493 29 HB3 GLN 48 1HB GLN 48 3.932 19.686 -5.518 30 HG2 GLN 48 2HG GLN 48 2.150 21.439 -7.153 31 HG3 GLN 48 1HG GLN 48 3.786 21.140 -7.743 32 HE21 GLN 48 1HE2 GLN 48 0.740 19.532 -6.840 33 HE22 GLN 48 2HE2 GLN 48 1.090 18.068 -7.632 34 H ALA 49 H ALA 49 -0.142 20.905 -5.365 35 HA ALA 49 HA ALA 49 -0.587 18.031 -4.755 36 HB1 ALA 49 1HB ALA 49 -2.163 19.427 -3.660 37 HB2 ALA 49 2HB ALA 49 -3.030 18.750 -5.038 38 HB3 ALA 49 3HB ALA 49 -2.412 20.402 -5.103 39 H THR 50 H THR 50 -1.052 16.567 -6.353 40 HA THR 50 HA THR 50 -2.197 17.250 -8.888 41 HB THR 50 HB THR 50 0.771 16.653 -8.937 42 HG1 THR 50 1HG THR 50 -0.633 18.996 -9.697 43 HG21 THR 50 1HG2 THR 50 -0.547 15.696 -10.827 44 HG22 THR 50 2HG2 THR 50 0.563 16.961 -11.351 45 HG23 THR 50 3HG2 THR 50 -1.157 17.312 -11.182 46 H GLU 51 H GLU 51 0.347 14.967 -7.831 47 HA GLU 51 HA GLU 51 -1.425 12.763 -8.771 48 HB2 GLU 51 2HB GLU 51 1.563 12.715 -8.304 49 HB3 GLU 51 1HB GLU 51 0.597 11.455 -9.072 50 HG2 GLU 51 2HG GLU 51 -0.053 13.109 -10.842 51 HG3 GLU 51 1HG GLU 51 1.063 14.261 -10.111 52 H ALA 52 H ALA 52 -2.074 11.206 -7.392 53 HA ALA 52 HA ALA 52 -0.667 10.708 -4.857 54 HB1 ALA 52 1HB ALA 52 -3.460 11.841 -5.043 55 HB2 ALA 52 2HB ALA 52 -2.142 12.352 -3.988 56 HB3 ALA 52 3HB ALA 52 -2.982 10.832 -3.680 57 H ASN 53 H ASN 53 -0.428 8.477 -5.222 58 HA ASN 53 HA ASN 53 -2.779 7.102 -6.399 59 HB2 ASN 53 2HB ASN 53 0.097 6.241 -6.207 60 HB3 ASN 53 1HB ASN 53 -1.193 5.201 -6.801 61 HD21 ASN 53 1HD2 ASN 53 -2.704 7.356 -8.145 62 HD22 ASN 53 2HD2 ASN 53 -1.786 7.824 -9.493 63 H CYS 54 H CYS 54 -3.901 5.531 -5.395 64 HA CYS 54 HA CYS 54 -2.976 4.718 -2.672 65 HB2 CYS 54 2HB CYS 54 -5.863 4.861 -2.929 66 HB3 CYS 54 1HB CYS 54 -4.826 5.636 -1.737 67 H THR 55 H THR 55 -2.413 2.590 -3.295 68 HA THR 55 HA THR 55 -4.640 1.059 -4.553 69 HB THR 55 HB THR 55 -3.291 0.480 -6.255 70 HG1 THR 55 1HG THR 55 -1.624 -0.316 -4.124 71 HG21 THR 55 1HG2 THR 55 -1.072 2.010 -4.877 72 HG22 THR 55 2HG2 THR 55 -2.347 2.784 -5.811 73 HG23 THR 55 3HG2 THR 55 -1.226 1.679 -6.599 74 H VAL 56 H VAL 56 -4.951 -1.049 -3.960 75 HA VAL 56 HA VAL 56 -3.729 -1.836 -1.374 76 HB VAL 56 HB VAL 56 -6.201 -2.722 -2.873 77 HG11 VAL 56 1HG1 VAL 56 -5.638 -4.803 -2.090 78 HG12 VAL 56 2HG1 VAL 56 -6.312 -4.162 -0.592 79 HG13 VAL 56 3HG1 VAL 56 -4.567 -4.158 -0.847 80 HG21 VAL 56 1HG2 VAL 56 -7.314 -1.517 -1.310 81 HG22 VAL 56 2HG2 VAL 56 -5.752 -0.774 -0.955 82 HG23 VAL 56 3HG2 VAL 56 -6.313 -2.146 -0.001 83 H LEU 57 H LEU 57 -1.989 -3.127 -1.590 84 HA LEU 57 HA LEU 57 -1.020 -4.243 -3.949 85 HB2 LEU 57 2HB LEU 57 0.125 -4.105 -1.659 86 HB3 LEU 57 1HB LEU 57 -0.711 -5.610 -1.277 87 HG LEU 57 HG LEU 57 0.279 -6.597 -3.381 88 HD11 LEU 57 1HD1 LEU 57 2.549 -4.980 -3.673 89 HD12 LEU 57 2HD1 LEU 57 1.198 -3.849 -3.627 90 HD13 LEU 57 3HD1 LEU 57 1.221 -5.145 -4.822 91 HD21 LEU 57 1HD2 LEU 57 1.329 -7.263 -1.373 92 HD22 LEU 57 2HD2 LEU 57 1.979 -5.651 -1.077 93 HD23 LEU 57 3HD2 LEU 57 2.660 -6.656 -2.357 94 H SER 58 H SER 58 -1.053 -6.417 -4.782 95 HA SER 58 HA SER 58 -3.658 -7.754 -4.336 96 HB2 SER 58 2HB SER 58 -2.907 -7.231 -6.675 97 HB3 SER 58 1HB SER 58 -1.534 -8.308 -6.434 98 HG SER 58 HG SER 58 -3.153 -9.942 -5.908 99 H VAL 59 H VAL 59 -3.712 -9.990 -3.696 100 HA VAL 59 HA VAL 59 -1.248 -10.805 -2.272 101 HB VAL 59 HB VAL 59 -3.908 -12.231 -2.211 102 HG11 VAL 59 1HG1 VAL 59 -1.439 -12.754 -1.054 103 HG12 VAL 59 2HG1 VAL 59 -2.987 -13.399 -0.504 104 HG13 VAL 59 3HG1 VAL 59 -2.326 -11.939 0.235 105 HG21 VAL 59 1HG2 VAL 59 -3.799 -10.589 0.035 106 HG22 VAL 59 2HG2 VAL 59 -4.811 -10.321 -1.385 107 HG23 VAL 59 3HG2 VAL 59 -3.235 -9.541 -1.266 108 H GLN 60 H GLN 60 0.131 -12.138 -3.286 109 HA GLN 60 HA GLN 60 -0.944 -14.336 -4.962 110 HB2 GLN 60 2HB GLN 60 1.298 -12.489 -5.834 111 HB3 GLN 60 1HB GLN 60 0.692 -13.881 -6.730 112 HG2 GLN 60 2HG GLN 60 -0.935 -11.429 -5.994 113 HG3 GLN 60 1HG GLN 60 -0.274 -11.772 -7.592 114 HE21 GLN 60 1HE2 GLN 60 -3.174 -11.753 -6.275 115 HE22 GLN 60 2HE2 GLN 60 -3.862 -13.167 -6.915 116 H GLN 61 H GLN 61 0.609 -16.116 -5.178 117 HA GLN 61 HA GLN 61 2.314 -16.341 -2.797 118 HB2 GLN 61 2HB GLN 61 1.892 -18.310 -5.059 119 HB3 GLN 61 1HB GLN 61 2.613 -18.664 -3.492 120 HG2 GLN 61 2HG GLN 61 -0.237 -17.767 -4.000 121 HG3 GLN 61 1HG GLN 61 0.278 -19.378 -3.499 122 HE21 GLN 61 1HE2 GLN 61 -0.904 -16.487 -2.291 123 HE22 GLN 61 2HE2 GLN 61 -0.353 -16.625 -0.697 124 H ILE 62 H ILE 62 3.910 -14.697 -3.392 125 HA ILE 62 HA ILE 62 5.919 -13.973 -4.370 126 HB ILE 62 HB ILE 62 6.242 -16.980 -4.623 127 HG12 ILE 62 2HG1 ILE 62 7.270 -15.055 -2.516 128 HG13 ILE 62 1HG1 ILE 62 5.816 -16.036 -2.324 129 HG21 ILE 62 1HG2 ILE 62 7.913 -16.055 -6.024 130 HG22 ILE 62 2HG2 ILE 62 8.729 -16.276 -4.477 131 HG23 ILE 62 3HG2 ILE 62 8.165 -14.676 -4.954 132 HD11 ILE 62 1HD1 ILE 62 7.084 -17.770 -1.662 133 HD12 ILE 62 2HD1 ILE 62 8.541 -16.804 -1.889 134 HD13 ILE 62 3HD1 ILE 62 7.900 -17.760 -3.225 135 H GLY 63 H GLY 63 7.286 -14.163 -6.470 136 HA2 GLY 63 2HA GLY 63 7.374 -14.619 -8.841 137 HA3 GLY 63 1HA GLY 63 5.669 -15.071 -8.788 138 H GLU 64 H GLU 64 5.938 -12.352 -6.953 139 HA GLU 64 HA GLU 64 5.522 -10.530 -9.278 140 HB2 GLU 64 2HB GLU 64 3.928 -10.600 -6.700 141 HB3 GLU 64 1HB GLU 64 3.743 -9.399 -7.977 142 HG2 GLU 64 2HG GLU 64 2.069 -10.932 -8.528 143 HG3 GLU 64 1HG GLU 64 3.411 -11.490 -9.526 144 H VAL 65 H VAL 65 6.411 -8.474 -9.038 145 HA VAL 65 HA VAL 65 7.977 -8.015 -6.535 146 HB VAL 65 HB VAL 65 8.578 -6.991 -9.324 147 HG11 VAL 65 1HG1 VAL 65 10.159 -5.709 -8.350 148 HG12 VAL 65 2HG1 VAL 65 10.756 -7.071 -7.401 149 HG13 VAL 65 3HG1 VAL 65 9.415 -6.097 -6.799 150 HG21 VAL 65 1HG2 VAL 65 10.548 -8.789 -8.238 151 HG22 VAL 65 2HG2 VAL 65 9.614 -8.951 -9.725 152 HG23 VAL 65 3HG2 VAL 65 8.968 -9.573 -8.206 153 H PHE 66 H PHE 66 7.598 -6.091 -5.467 154 HA PHE 66 HA PHE 66 5.892 -4.083 -6.873 155 HB2 PHE 66 2HB PHE 66 5.672 -4.963 -3.983 156 HB3 PHE 66 1HB PHE 66 4.716 -3.688 -4.742 157 HD1 PHE 66 1HD PHE 66 3.185 -4.258 -6.662 158 HD2 PHE 66 2HD PHE 66 5.134 -7.261 -4.295 159 HE1 PHE 66 1HE PHE 66 1.596 -5.962 -7.515 160 HE2 PHE 66 2HE PHE 66 3.549 -8.965 -5.146 161 HZ PHE 66 HZ PHE 66 1.777 -8.316 -6.756 162 H GLU 67 H GLU 67 6.120 -1.886 -6.028 163 HA GLU 67 HA GLU 67 8.868 -1.426 -4.960 164 HB2 GLU 67 2HB GLU 67 8.249 -0.461 -7.209 165 HB3 GLU 67 1HB GLU 67 7.052 0.539 -6.384 166 HG2 GLU 67 2HG GLU 67 8.858 1.492 -4.971 167 HG3 GLU 67 1HG GLU 67 10.039 0.543 -5.871 168 H CYS 68 H CYS 68 9.138 -0.198 -3.097 169 HA CYS 68 HA CYS 68 6.626 0.513 -1.639 170 HB2 CYS 68 2HB CYS 68 7.735 -0.885 -0.164 171 HB3 CYS 68 1HB CYS 68 9.326 -0.454 -0.792 172 H THR 69 H THR 69 6.571 2.599 -0.558 173 HA THR 69 HA THR 69 8.575 4.538 -1.626 174 HB THR 69 HB THR 69 6.901 6.065 -2.170 175 HG1 THR 69 1HG THR 69 5.102 6.251 -1.047 176 HG21 THR 69 1HG2 THR 69 6.707 3.603 -3.256 177 HG22 THR 69 2HG2 THR 69 5.643 4.934 -3.711 178 HG23 THR 69 3HG2 THR 69 5.101 3.733 -2.538 179 H PHE 70 H PHE 70 9.091 6.306 -0.274 180 HA PHE 70 HA PHE 70 7.967 6.322 2.460 181 HB2 PHE 70 2HB PHE 70 10.207 6.368 3.487 182 HB3 PHE 70 1HB PHE 70 9.940 4.852 2.626 183 HD1 PHE 70 1HD PHE 70 11.002 4.458 0.414 184 HD2 PHE 70 2HD PHE 70 11.849 7.966 2.745 185 HE1 PHE 70 1HE PHE 70 13.018 4.888 -0.964 186 HE2 PHE 70 2HE PHE 70 13.864 8.395 1.366 187 HZ PHE 70 HZ PHE 70 14.449 6.856 -0.487 188 H THR 71 H THR 71 8.592 8.348 3.611 189 HA THR 71 HA THR 71 9.416 10.505 1.725 190 HB THR 71 HB THR 71 7.367 11.101 3.812 191 HG1 THR 71 1HG THR 71 6.158 10.441 1.538 192 HG21 THR 71 1HG2 THR 71 6.593 12.634 2.041 193 HG22 THR 71 2HG2 THR 71 7.794 11.960 0.941 194 HG23 THR 71 3HG2 THR 71 8.311 12.860 2.366 195 H CYS 72 H CYS 72 10.556 12.227 2.689 196 HA CYS 72 HA CYS 72 11.292 11.852 5.561 197 HB2 CYS 72 2HB CYS 72 13.531 12.997 4.452 198 HB3 CYS 72 1HB CYS 72 13.343 11.275 4.766 199 H GLY 73 H GLY 73 12.216 13.943 6.485 200 HA2 GLY 73 2HA GLY 73 10.458 16.151 5.675 201 HA3 GLY 73 1HA GLY 73 11.511 16.132 7.090 202 H ALA 74 H ALA 74 11.638 18.441 5.831 203 HA ALA 74 HA ALA 74 13.212 19.923 4.898 204 HB1 ALA 74 1HB ALA 74 15.136 17.790 4.175 205 HB2 ALA 74 2HB ALA 74 14.760 17.925 5.894 206 HB3 ALA 74 3HB ALA 74 15.409 19.314 5.021 207 H ASP 75 H ASP 75 11.174 18.591 3.329 208 HA ASP 75 HA ASP 75 10.560 18.281 1.087 209 HB2 ASP 75 2HB ASP 75 13.033 19.996 0.690 210 HB3 ASP 75 1HB ASP 75 11.859 19.624 -0.571 211 H CYS 76 H CYS 76 11.998 16.184 2.247 212 HA CYS 76 HA CYS 76 13.795 15.281 0.035 213 HB2 CYS 76 2HB CYS 76 15.065 15.173 2.007 214 HB3 CYS 76 1HB CYS 76 13.683 14.680 2.978 215 H ARG 77 H ARG 77 12.967 13.707 -1.256 216 HA ARG 77 HA ARG 77 10.848 11.920 -0.130 217 HB2 ARG 77 2HB ARG 77 10.796 12.909 -2.988 218 HB3 ARG 77 1HB ARG 77 9.491 12.170 -2.065 219 HG2 ARG 77 2HG ARG 77 10.687 14.857 -1.331 220 HG3 ARG 77 1HG ARG 77 9.313 14.691 -2.416 221 HD2 ARG 77 2HD ARG 77 9.355 13.529 0.378 222 HD3 ARG 77 1HD ARG 77 8.710 15.123 0.002 223 HE ARG 77 HE ARG 77 7.606 12.880 -1.567 224 HH11 ARG 77 1HH1 ARG 77 5.369 12.642 -1.371 225 HH12 ARG 77 2HH1 ARG 77 4.523 13.516 -0.137 226 HH21 ARG 77 1HH2 ARG 77 7.368 15.055 1.105 227 HH22 ARG 77 2HH2 ARG 77 5.654 14.880 1.261 228 H GLY 78 H GLY 78 10.959 9.743 -0.947 229 HA2 GLY 78 2HA GLY 78 12.842 9.132 -3.106 230 HA3 GLY 78 1HA GLY 78 13.393 8.603 -1.517 231 H THR 79 H THR 79 12.805 6.823 -3.669 232 HA THR 79 HA THR 79 10.515 5.339 -2.478 233 HB THR 79 HB THR 79 11.148 5.253 -5.427 234 HG1 THR 79 1HG THR 79 10.615 7.409 -4.730 235 HG21 THR 79 1HG2 THR 79 8.909 4.367 -5.592 236 HG22 THR 79 2HG2 THR 79 8.593 4.726 -3.896 237 HG23 THR 79 3HG2 THR 79 9.755 3.473 -4.329 238 H SER 80 H SER 80 10.806 3.054 -2.403 239 HA SER 80 HA SER 80 13.554 2.121 -3.155 240 HB2 SER 80 2HB SER 80 13.494 0.644 -1.213 241 HB3 SER 80 1HB SER 80 13.198 2.301 -0.695 242 HG SER 80 HG SER 80 10.953 1.808 -0.753 243 H GLN 81 H GLN 81 13.713 -0.058 -3.923 244 HA GLN 81 HA GLN 81 11.125 -1.197 -4.883 245 HB2 GLN 81 2HB GLN 81 12.675 -0.367 -6.669 246 HB3 GLN 81 1HB GLN 81 13.870 -1.530 -6.108 247 HG2 GLN 81 2HG GLN 81 12.736 -2.572 -7.937 248 HG3 GLN 81 1HG GLN 81 12.117 -3.335 -6.472 249 HE21 GLN 81 1HE2 GLN 81 9.885 -3.264 -6.163 250 HE22 GLN 81 2HE2 GLN 81 8.827 -2.280 -7.045 251 H TYR 82 H TYR 82 10.655 -3.288 -4.247 252 HA TYR 82 HA TYR 82 12.875 -5.009 -3.331 253 HB2 TYR 82 2HB TYR 82 10.651 -3.988 -1.591 254 HB3 TYR 82 1HB TYR 82 11.361 -5.570 -1.271 255 HD1 TYR 82 1HD TYR 82 11.595 -2.177 -0.482 256 HD2 TYR 82 2HD TYR 82 14.064 -5.558 -1.435 257 HE1 TYR 82 1HE TYR 82 13.520 -1.087 0.640 258 HE2 TYR 82 2HE TYR 82 15.989 -4.470 -0.314 259 HH TYR 82 HH TYR 82 16.063 -1.229 0.474 260 HA PRO 83 HA PRO 83 10.651 -8.349 -5.235 261 HB2 PRO 83 2HB PRO 83 10.842 -9.857 -2.681 262 HB3 PRO 83 1HB PRO 83 11.391 -10.310 -4.304 263 HG2 PRO 83 2HG PRO 83 13.064 -9.534 -2.338 264 HG3 PRO 83 1HG PRO 83 13.394 -9.284 -4.057 265 HD2 PRO 83 2HD PRO 83 12.680 -7.295 -1.991 266 HD3 PRO 83 1HD PRO 83 13.494 -7.074 -3.554 267 H CYS 84 H CYS 84 9.089 -10.291 -3.660 268 HA CYS 84 HA CYS 84 6.561 -8.902 -3.642 269 HB2 CYS 84 2HB CYS 84 5.974 -11.067 -3.918 270 HB3 CYS 84 1HB CYS 84 7.519 -11.635 -3.281 271 H VAL 85 H VAL 85 5.378 -8.121 -1.900 272 HA VAL 85 HA VAL 85 6.649 -8.314 0.797 273 HB VAL 85 HB VAL 85 5.586 -5.936 1.093 274 HG11 VAL 85 1HG1 VAL 85 7.713 -4.938 0.186 275 HG12 VAL 85 2HG1 VAL 85 8.093 -6.516 -0.506 276 HG13 VAL 85 3HG1 VAL 85 7.965 -6.328 1.242 277 HG21 VAL 85 1HG2 VAL 85 5.994 -6.086 -1.913 278 HG22 VAL 85 2HG2 VAL 85 5.598 -4.630 -0.998 279 HG23 VAL 85 3HG2 VAL 85 4.434 -5.950 -1.101 280 H GLN 86 H GLN 86 5.019 -7.789 2.560 281 HA GLN 86 HA GLN 86 2.782 -9.497 2.389 282 HB2 GLN 86 2HB GLN 86 3.057 -7.053 4.159 283 HB3 GLN 86 1HB GLN 86 2.001 -8.437 4.435 284 HG2 GLN 86 2HG GLN 86 5.029 -8.518 4.315 285 HG3 GLN 86 1HG GLN 86 4.052 -8.650 5.777 286 HE21 GLN 86 1HE2 GLN 86 5.822 -10.598 3.906 287 HE22 GLN 86 2HE2 GLN 86 4.883 -12.012 3.920 288 H VAL 87 H VAL 87 0.504 -8.108 3.153 289 HA VAL 87 HA VAL 87 -0.025 -6.420 0.736 290 HB VAL 87 HB VAL 87 -1.837 -8.397 2.127 291 HG11 VAL 87 1HG1 VAL 87 -2.348 -6.158 0.209 292 HG12 VAL 87 2HG1 VAL 87 -3.356 -6.758 1.520 293 HG13 VAL 87 3HG1 VAL 87 -3.263 -7.651 0.004 294 HG21 VAL 87 1HG2 VAL 87 0.043 -8.952 0.297 295 HG22 VAL 87 2HG2 VAL 87 -1.225 -8.399 -0.797 296 HG23 VAL 87 3HG2 VAL 87 -1.526 -9.758 0.285 297 H TYR 88 H TYR 88 -1.284 -4.610 0.949 298 HA TYR 88 HA TYR 88 -2.895 -3.956 3.169 299 HB2 TYR 88 2HB TYR 88 -0.712 -3.820 4.346 300 HB3 TYR 88 1HB TYR 88 -0.214 -2.567 3.230 301 HD1 TYR 88 1HD TYR 88 0.088 -1.583 5.707 302 HD2 TYR 88 2HD TYR 88 -3.721 -2.094 3.760 303 HE1 TYR 88 1HE TYR 88 -0.921 0.106 7.199 304 HE2 TYR 88 2HE TYR 88 -4.702 -0.417 5.245 305 HH TYR 88 HH TYR 88 -2.725 1.408 7.547 306 H VAL 89 H VAL 89 -1.521 -1.060 2.815 307 HA VAL 89 HA VAL 89 -2.730 -0.533 0.142 308 HB VAL 89 HB VAL 89 -4.357 0.044 1.941 309 HG11 VAL 89 1HG1 VAL 89 -2.493 2.273 2.725 310 HG12 VAL 89 2HG1 VAL 89 -2.356 0.695 3.502 311 HG13 VAL 89 3HG1 VAL 89 -3.862 1.606 3.616 312 HG21 VAL 89 1HG2 VAL 89 -5.062 1.760 0.644 313 HG22 VAL 89 2HG2 VAL 89 -3.563 1.558 -0.263 314 HG23 VAL 89 3HG2 VAL 89 -3.649 2.735 1.047 315 H ASN 90 H ASN 90 -1.563 0.819 -1.118 316 HA ASN 90 HA ASN 90 0.949 1.891 -0.004 317 HB2 ASN 90 2HB ASN 90 -0.118 1.753 -2.836 318 HB3 ASN 90 1HB ASN 90 1.468 2.373 -2.391 319 HD21 ASN 90 1HD2 ASN 90 0.743 -0.096 -0.240 320 HD22 ASN 90 2HD2 ASN 90 1.513 -1.380 -1.038 321 H ASN 91 H ASN 91 0.795 3.907 0.876 322 HA ASN 91 HA ASN 91 -1.287 5.740 -0.145 323 HB2 ASN 91 2HB ASN 91 0.615 5.930 2.208 324 HB3 ASN 91 1HB ASN 91 -0.570 7.169 1.790 325 HD21 ASN 91 1HD2 ASN 91 -0.633 5.663 4.281 326 HD22 ASN 91 2HD2 ASN 91 -2.056 4.739 4.280 327 H SER 92 H SER 92 -0.288 6.185 -2.194 328 HA SER 92 HA SER 92 2.359 7.477 -2.173 329 HB2 SER 92 2HB SER 92 1.016 7.648 -4.707 330 HB3 SER 92 1HB SER 92 2.461 6.735 -4.289 331 HG SER 92 HG SER 92 1.062 5.105 -3.461 332 H GLU 93 H GLU 93 -0.280 8.576 -1.019 333 HA GLU 93 HA GLU 93 -0.965 10.901 -2.598 334 HB2 GLU 93 2HB GLU 93 -1.248 10.604 0.406 335 HB3 GLU 93 1HB GLU 93 -2.253 11.561 -0.687 336 HG2 GLU 93 2HG GLU 93 -2.965 9.448 -1.813 337 HG3 GLU 93 1HG GLU 93 -2.046 8.539 -0.607 338 H SER 94 H SER 94 1.667 10.016 -0.688 339 HA SER 94 HA SER 94 2.960 12.609 -1.009 340 HB2 SER 94 2HB SER 94 3.116 13.264 1.226 341 HB3 SER 94 1HB SER 94 1.484 12.602 1.191 342 HG SER 94 HG SER 94 2.170 11.258 2.642 343 H ASN 95 H ASN 95 3.336 9.869 -1.845 344 HA ASN 95 HA ASN 95 5.064 8.319 -2.080 345 HB2 ASN 95 2HB ASN 95 6.739 10.321 -0.538 346 HB3 ASN 95 1HB ASN 95 7.316 9.056 -1.620 347 HD21 ASN 95 1HD2 ASN 95 5.520 9.356 -3.787 348 HD22 ASN 95 2HD2 ASN 95 5.754 10.882 -4.495 349 H SER 96 H SER 96 3.287 7.871 0.051 350 HA SER 96 HA SER 96 5.138 6.843 2.180 351 HB2 SER 96 2HB SER 96 3.066 6.849 3.638 352 HB3 SER 96 1HB SER 96 3.646 8.447 3.169 353 HG SER 96 HG SER 96 1.285 7.823 2.906 354 H ARG 97 H ARG 97 4.833 4.678 2.862 355 HA ARG 97 HA ARG 97 2.885 3.081 1.274 356 HB2 ARG 97 2HB ARG 97 4.986 2.685 0.206 357 HB3 ARG 97 1HB ARG 97 5.816 2.518 1.750 358 HG2 ARG 97 2HG ARG 97 5.387 0.322 0.639 359 HG3 ARG 97 1HG ARG 97 4.618 0.441 2.217 360 HD2 ARG 97 2HD ARG 97 2.478 0.839 1.248 361 HD3 ARG 97 1HD ARG 97 3.170 1.102 -0.355 362 HE ARG 97 HE ARG 97 2.525 -1.468 0.815 363 HH11 ARG 97 1HH1 ARG 97 3.100 -3.295 -0.385 364 HH12 ARG 97 2HH1 ARG 97 4.253 -3.143 -1.669 365 HH21 ARG 97 1HH2 ARG 97 4.722 0.261 -1.204 366 HH22 ARG 97 2HH2 ARG 97 5.170 -1.131 -2.133 367 H ALA 98 H ALA 98 1.570 1.963 2.590 368 HA ALA 98 HA ALA 98 2.488 1.386 5.364 369 HB1 ALA 98 1HB ALA 98 -0.348 0.933 4.607 370 HB2 ALA 98 2HB ALA 98 0.194 2.612 4.588 371 HB3 ALA 98 3HB ALA 98 0.322 1.659 6.067 372 H LEU 99 H LEU 99 2.951 -0.717 5.848 373 HA LEU 99 HA LEU 99 1.952 -2.829 3.973 374 HB2 LEU 99 2HB LEU 99 4.412 -2.472 3.896 375 HB3 LEU 99 1HB LEU 99 4.499 -2.826 5.621 376 HG LEU 99 HG LEU 99 3.487 -5.066 5.169 377 HD11 LEU 99 1HD1 LEU 99 3.445 -3.913 2.419 378 HD12 LEU 99 2HD1 LEU 99 2.319 -5.033 3.186 379 HD13 LEU 99 3HD1 LEU 99 3.860 -5.621 2.561 380 HD21 LEU 99 1HD2 LEU 99 6.051 -4.410 5.074 381 HD22 LEU 99 2HD2 LEU 99 5.874 -4.823 3.368 382 HD23 LEU 99 3HD2 LEU 99 5.529 -6.029 4.609 383 H LEU 100 H LEU 100 0.785 -4.460 4.850 384 HA LEU 100 HA LEU 100 0.771 -4.742 7.829 385 HB2 LEU 100 2HB LEU 100 -1.318 -3.667 6.895 386 HB3 LEU 100 1HB LEU 100 -1.598 -5.147 5.979 387 HG LEU 100 HG LEU 100 -1.505 -6.417 8.161 388 HD11 LEU 100 1HD1 LEU 100 -0.838 -3.744 9.107 389 HD12 LEU 100 2HD1 LEU 100 -0.715 -5.289 9.947 390 HD13 LEU 100 3HD1 LEU 100 -2.235 -4.398 9.960 391 HD21 LEU 100 1HD2 LEU 100 -3.596 -4.402 7.430 392 HD22 LEU 100 2HD2 LEU 100 -3.774 -5.274 8.952 393 HD23 LEU 100 3HD2 LEU 100 -3.690 -6.163 7.431 394 H HIS 101 H HIS 101 0.715 -6.893 8.587 395 HA HIS 101 HA HIS 101 1.463 -8.912 6.562 396 HB2 HIS 101 2HB HIS 101 1.241 -9.305 9.551 397 HB3 HIS 101 1HB HIS 101 2.178 -10.262 8.403 398 HD1 HIS 101 1HD HIS 101 3.219 -7.577 6.888 399 HD2 HIS 101 2HD HIS 101 3.624 -8.496 10.936 400 HE1 HIS 101 1HE HIS 101 5.194 -6.234 7.733 401 HE2 HIS 101 2HE HIS 101 5.446 -6.781 10.197 402 H SER 102 H SER 102 -0.117 -10.127 5.651 403 HA SER 102 HA SER 102 -2.822 -10.151 6.608 404 HB2 SER 102 2HB SER 102 -3.224 -11.812 4.889 405 HB3 SER 102 1HB SER 102 -2.104 -10.620 4.237 406 HG SER 102 HG SER 102 -1.531 -13.196 5.279 407 H ASP 103 H ASP 103 -0.066 -12.313 7.047 408 HA ASP 103 HA ASP 103 -1.081 -13.349 9.522 409 HB2 ASP 103 2HB ASP 103 -2.554 -14.487 7.673 410 HB3 ASP 103 1HB ASP 103 -1.111 -15.455 7.377 411 H GLU 104 H GLU 104 0.469 -14.778 10.507 412 HA GLU 104 HA GLU 104 3.175 -14.402 9.596 413 HB2 GLU 104 2HB GLU 104 1.997 -16.278 11.670 414 HB3 GLU 104 1HB GLU 104 3.721 -16.015 11.434 415 HG2 GLU 104 2HG GLU 104 1.715 -13.845 12.109 416 HG3 GLU 104 1HG GLU 104 2.810 -14.603 13.266 417 H HIS 105 H HIS 105 0.832 -17.043 9.329 418 HA HIS 105 HA HIS 105 2.563 -19.080 8.404 419 HB2 HIS 105 2HB HIS 105 -0.304 -18.505 7.601 420 HB3 HIS 105 1HB HIS 105 0.547 -20.018 7.284 421 HD1 HIS 105 1HD HIS 105 1.589 -21.165 9.588 422 HD2 HIS 105 2HD HIS 105 -1.592 -18.506 10.046 423 HE1 HIS 105 1HE HIS 105 0.609 -21.608 11.883 424 HE2 HIS 105 2HE HIS 105 -1.328 -19.995 12.172 425 H GLN 106 H GLN 106 0.993 -16.432 6.635 426 HA GLN 106 HA GLN 106 1.774 -17.242 4.014 427 HB2 GLN 106 2HB GLN 106 0.153 -15.386 4.559 428 HB3 GLN 106 1HB GLN 106 1.535 -14.391 5.018 429 HG2 GLN 106 2HG GLN 106 2.492 -14.746 2.736 430 HG3 GLN 106 1HG GLN 106 1.021 -15.611 2.290 431 HE21 GLN 106 1HE2 GLN 106 -0.460 -14.291 1.240 432 HE22 GLN 106 2HE2 GLN 106 -0.651 -12.625 1.508 433 H LEU 107 H LEU 107 3.424 -15.316 6.482 434 HA LEU 107 HA LEU 107 5.712 -14.618 4.917 435 HB2 LEU 107 2HB LEU 107 5.147 -13.576 7.112 436 HB3 LEU 107 1HB LEU 107 5.549 -15.095 7.910 437 HG LEU 107 HG LEU 107 7.850 -14.939 6.912 438 HD11 LEU 107 1HD1 LEU 107 6.581 -12.630 5.627 439 HD12 LEU 107 2HD1 LEU 107 8.052 -13.493 5.181 440 HD13 LEU 107 3HD1 LEU 107 8.109 -12.226 6.406 441 HD21 LEU 107 1HD2 LEU 107 6.697 -13.498 9.083 442 HD22 LEU 107 2HD2 LEU 107 7.897 -12.447 8.331 443 HD23 LEU 107 3HD2 LEU 107 8.366 -14.044 8.912 444 H LEU 108 H LEU 108 5.014 -17.395 7.029 445 HA LEU 108 HA LEU 108 7.573 -18.666 6.700 446 HB2 LEU 108 2HB LEU 108 4.872 -19.949 7.241 447 HB3 LEU 108 1HB LEU 108 6.450 -20.681 7.538 448 HG LEU 108 HG LEU 108 5.347 -18.198 8.884 449 HD11 LEU 108 1HD1 LEU 108 5.962 -20.991 9.894 450 HD12 LEU 108 2HD1 LEU 108 4.364 -20.262 9.742 451 HD13 LEU 108 3HD1 LEU 108 5.512 -19.631 10.923 452 HD21 LEU 108 1HD2 LEU 108 7.642 -17.774 8.809 453 HD22 LEU 108 2HD2 LEU 108 8.060 -19.486 8.829 454 HD23 LEU 108 3HD2 LEU 108 7.513 -18.693 10.308 455 H THR 109 H THR 109 4.627 -18.555 4.830 456 HA THR 109 HA THR 109 5.271 -20.730 3.044 457 HB THR 109 HB THR 109 3.406 -18.365 2.692 458 HG1 THR 109 1HG THR 109 1.854 -19.840 3.437 459 HG21 THR 109 1HG2 THR 109 3.933 -19.472 0.586 460 HG22 THR 109 2HG2 THR 109 2.282 -19.850 1.071 461 HG23 THR 109 3HG2 THR 109 3.562 -21.042 1.296 462 H ASN 110 H ASN 110 5.731 -17.216 2.984 463 HA ASN 110 HA ASN 110 7.559 -17.577 0.651 464 HB2 ASN 110 2HB ASN 110 6.751 -15.487 -0.303 465 HB3 ASN 110 1HB ASN 110 5.382 -16.572 -0.060 466 HD21 ASN 110 1HD2 ASN 110 4.774 -13.874 -0.197 467 HD22 ASN 110 2HD2 ASN 110 4.390 -13.272 1.344 468 HA PRO 111 HA PRO 111 9.438 -15.282 4.280 469 HB2 PRO 111 2HB PRO 111 11.662 -16.883 4.487 470 HB3 PRO 111 1HB PRO 111 10.163 -17.149 5.391 471 HG2 PRO 111 2HG PRO 111 11.199 -18.536 2.992 472 HG3 PRO 111 1HG PRO 111 10.227 -19.161 4.333 473 HD2 PRO 111 2HD PRO 111 9.212 -18.544 1.839 474 HD3 PRO 111 1HD PRO 111 8.245 -18.589 3.324 475 H LYS 112 H LYS 112 10.483 -16.268 1.138 476 HA LYS 112 HA LYS 112 12.910 -14.615 1.165 477 HB2 LYS 112 2HB LYS 112 11.482 -16.052 -1.095 478 HB3 LYS 112 1HB LYS 112 13.044 -15.246 -1.239 479 HG2 LYS 112 2HG LYS 112 13.936 -16.737 0.553 480 HG3 LYS 112 1HG LYS 112 12.393 -17.591 0.567 481 HD2 LYS 112 2HD LYS 112 12.701 -18.097 -1.862 482 HD3 LYS 112 1HD LYS 112 14.299 -17.353 -1.780 483 HE2 LYS 112 2HE LYS 112 15.170 -19.048 -0.440 484 HE3 LYS 112 1HE LYS 112 13.586 -19.508 0.184 485 HZ1 LYS 112 1HZ LYS 112 14.168 -19.817 -2.682 486 HZ2 LYS 112 2HZ LYS 112 13.075 -20.678 -1.707 487 HZ3 LYS 112 3HZ LYS 112 14.744 -20.976 -1.586 488 H CYS 113 H CYS 113 9.725 -13.896 1.127 489 HA CYS 113 HA CYS 113 9.523 -12.023 -1.046 490 HB2 CYS 113 2HB CYS 113 7.945 -12.658 1.403 491 HB3 CYS 113 1HB CYS 113 7.660 -11.099 0.638 492 H SER 114 H SER 114 11.945 -11.711 0.619 493 HA SER 114 HA SER 114 13.124 -10.043 1.803 494 HB2 SER 114 2HB SER 114 11.731 -8.830 -0.520 495 HB3 SER 114 1HB SER 114 12.366 -7.695 0.669 496 HG SER 114 HG SER 114 14.254 -8.089 -0.135 497 H TYR 115 H TYR 115 11.534 -10.667 3.641 498 HA TYR 115 HA TYR 115 9.660 -8.463 4.294 499 HB2 TYR 115 2HB TYR 115 8.826 -9.932 6.035 500 HB3 TYR 115 1HB TYR 115 8.958 -10.868 4.545 501 HD1 TYR 115 1HD TYR 115 10.930 -12.365 4.183 502 HD2 TYR 115 2HD TYR 115 10.163 -10.460 7.955 503 HE1 TYR 115 1HE TYR 115 12.471 -13.952 5.295 504 HE2 TYR 115 2HE TYR 115 11.706 -12.049 9.070 505 HH TYR 115 HH TYR 115 13.945 -13.686 7.724 506 H ILE 116 H ILE 116 12.836 -8.749 4.534 507 HA ILE 116 HA ILE 116 13.254 -8.285 7.375 508 HB ILE 116 HB ILE 116 15.318 -7.338 5.461 509 HG12 ILE 116 2HG1 ILE 116 14.495 -9.253 4.202 510 HG13 ILE 116 1HG1 ILE 116 15.993 -9.724 5.004 511 HG21 ILE 116 1HG2 ILE 116 15.525 -7.574 7.975 512 HG22 ILE 116 2HG2 ILE 116 16.775 -8.392 7.039 513 HG23 ILE 116 3HG2 ILE 116 15.450 -9.320 7.740 514 HD11 ILE 116 1HD1 ILE 116 14.783 -11.494 5.755 515 HD12 ILE 116 2HD1 ILE 116 13.243 -10.695 5.444 516 HD13 ILE 116 3HD1 ILE 116 14.138 -10.342 6.923 517 HA PRO 117 HA PRO 117 13.190 -3.735 6.119 518 HB2 PRO 117 2HB PRO 117 13.398 -3.017 3.560 519 HB3 PRO 117 1HB PRO 117 14.766 -3.801 4.378 520 HG2 PRO 117 2HG PRO 117 12.944 -4.880 2.327 521 HG3 PRO 117 1HG PRO 117 14.591 -5.377 2.749 522 HD2 PRO 117 2HD PRO 117 12.061 -6.524 3.669 523 HD3 PRO 117 1HD PRO 117 13.712 -7.130 3.928 524 HA PRO 118 HA PRO 118 8.692 -4.285 4.521 525 HB2 PRO 118 2HB PRO 118 7.430 -4.016 6.944 526 HB3 PRO 118 1HB PRO 118 7.908 -5.579 6.254 527 HG2 PRO 118 2HG PRO 118 9.268 -3.931 8.329 528 HG3 PRO 118 1HG PRO 118 9.046 -5.688 8.246 529 HD2 PRO 118 2HD PRO 118 11.396 -4.504 7.582 530 HD3 PRO 118 1HD PRO 118 10.817 -5.985 6.788 531 H CYS 119 H CYS 119 7.321 -2.506 4.157 532 HA CYS 119 HA CYS 119 8.270 0.080 5.285 533 HB2 CYS 119 2HB CYS 119 6.567 -0.553 2.854 534 HB3 CYS 119 1HB CYS 119 6.936 1.082 3.403 535 H LYS 120 H LYS 120 7.106 0.563 7.113 536 HA LYS 120 HA LYS 120 4.138 0.342 6.923 537 HB2 LYS 120 2HB LYS 120 5.192 -1.576 8.229 538 HB3 LYS 120 1HB LYS 120 5.691 -0.372 9.419 539 HG2 LYS 120 2HG LYS 120 3.354 0.303 9.741 540 HG3 LYS 120 1HG LYS 120 2.839 -0.858 8.516 541 HD2 LYS 120 2HD LYS 120 3.759 -2.702 9.884 542 HD3 LYS 120 1HD LYS 120 4.236 -1.541 11.121 543 HE2 LYS 120 2HE LYS 120 2.019 -2.718 11.536 544 HE3 LYS 120 1HE LYS 120 1.954 -0.955 11.576 545 HZ1 LYS 120 1HZ LYS 120 1.296 -2.628 9.212 546 HZ2 LYS 120 2HZ LYS 120 1.159 -0.938 9.320 547 HZ3 LYS 120 3HZ LYS 120 0.155 -1.937 10.258 548 H ARG 121 H ARG 121 3.056 2.095 7.798 549 HA ARG 121 HA ARG 121 4.479 4.527 8.267 550 HB2 ARG 121 2HB ARG 121 2.059 4.308 7.578 551 HB3 ARG 121 1HB ARG 121 1.691 3.856 9.237 552 HG2 ARG 121 2HG ARG 121 2.707 5.997 10.013 553 HG3 ARG 121 1HG ARG 121 2.943 6.464 8.329 554 HD2 ARG 121 2HD ARG 121 0.260 5.789 9.569 555 HD3 ARG 121 1HD ARG 121 0.857 7.426 9.300 556 HE ARG 121 HE ARG 121 1.030 6.186 6.808 557 HH11 ARG 121 1HH1 ARG 121 -0.648 6.335 5.303 558 HH12 ARG 121 2HH1 ARG 121 -2.262 6.639 5.852 559 HH21 ARG 121 1HH2 ARG 121 -1.379 6.776 9.202 560 HH22 ARG 121 2HH2 ARG 121 -2.676 6.890 8.061 561 H GLU 122 H GLU 122 3.015 2.192 10.491 562 HA GLU 122 HA GLU 122 4.617 3.417 12.684 563 HB2 GLU 122 2HB GLU 122 2.817 3.256 14.205 564 HB3 GLU 122 1HB GLU 122 2.081 3.890 12.734 565 HG2 GLU 122 2HG GLU 122 1.495 1.514 12.106 566 HG3 GLU 122 1HG GLU 122 2.043 1.028 13.710 567 H ASN 123 H ASN 123 5.870 1.975 13.750 568 HA ASN 123 HA ASN 123 6.203 -0.696 12.874 569 HB2 ASN 123 2HB ASN 123 6.819 0.364 15.643 570 HB3 ASN 123 1HB ASN 123 7.599 -0.992 14.827 571 HD21 ASN 123 1HD2 ASN 123 7.157 2.551 14.648 572 HD22 ASN 123 2HD2 ASN 123 8.570 2.845 13.751 573 H GLN 124 H GLN 124 4.113 0.670 15.354 574 HA GLN 124 HA GLN 124 3.395 -1.741 16.684 575 HB2 GLN 124 2HB GLN 124 1.745 0.755 16.181 576 HB3 GLN 124 1HB GLN 124 1.317 -0.517 17.327 577 HG2 GLN 124 2HG GLN 124 3.401 -0.128 18.568 578 HG3 GLN 124 1HG GLN 124 3.875 1.112 17.407 579 HE21 GLN 124 1HE2 GLN 124 3.540 1.745 20.179 580 HE22 GLN 124 2HE2 GLN 124 2.194 2.766 20.337 581 H LYS 125 H LYS 125 1.900 -3.330 16.214 582 HA LYS 125 HA LYS 125 0.249 -3.021 13.762 583 HB2 LYS 125 2HB LYS 125 2.321 -4.280 13.180 584 HB3 LYS 125 1HB LYS 125 1.912 -5.470 14.416 585 HG2 LYS 125 2HG LYS 125 -0.194 -5.982 13.256 586 HG3 LYS 125 1HG LYS 125 0.169 -4.761 12.038 587 HD2 LYS 125 2HD LYS 125 0.801 -6.925 11.147 588 HD3 LYS 125 1HD LYS 125 2.272 -6.016 11.486 589 HE2 LYS 125 2HE LYS 125 2.941 -7.483 13.078 590 HE3 LYS 125 1HE LYS 125 1.328 -7.587 13.781 591 HZ1 LYS 125 1HZ LYS 125 0.997 -9.495 12.742 592 HZ2 LYS 125 2HZ LYS 125 2.595 -9.451 12.166 593 HZ3 LYS 125 3HZ LYS 125 1.336 -8.792 11.236 594 H ASN 126 H ASN 126 -1.826 -3.704 14.109 595 HA ASN 126 HA ASN 126 -2.355 -5.245 16.616 596 HB2 ASN 126 2HB ASN 126 -4.168 -3.450 14.974 597 HB3 ASN 126 1HB ASN 126 -4.675 -4.349 16.405 598 HD21 ASN 126 1HD2 ASN 126 -4.772 -1.481 16.334 599 HD22 ASN 126 2HD2 ASN 126 -3.630 -0.884 17.438 600 H LEU 127 H LEU 127 -3.142 -7.297 16.406 601 HA LEU 127 HA LEU 127 -3.316 -8.590 13.870 602 HB2 LEU 127 2HB LEU 127 -4.489 -9.369 16.557 603 HB3 LEU 127 1HB LEU 127 -4.450 -10.428 15.148 604 HG LEU 127 HG LEU 127 -1.945 -10.102 15.076 605 HD11 LEU 127 1HD1 LEU 127 -1.441 -8.187 16.294 606 HD12 LEU 127 2HD1 LEU 127 -1.112 -9.431 17.498 607 HD13 LEU 127 3HD1 LEU 127 -2.632 -8.540 17.545 608 HD21 LEU 127 1HD2 LEU 127 -3.198 -12.045 16.183 609 HD22 LEU 127 2HD2 LEU 127 -2.891 -11.233 17.718 610 HD23 LEU 127 3HD2 LEU 127 -1.541 -11.781 16.726 611 H GLU 128 H GLU 128 -5.775 -7.102 15.928 612 HA GLU 128 HA GLU 128 -8.074 -8.005 14.525 613 HB2 GLU 128 2HB GLU 128 -8.107 -6.807 16.725 614 HB3 GLU 128 1HB GLU 128 -7.706 -5.314 15.875 615 HG2 GLU 128 2HG GLU 128 -9.757 -5.597 14.485 616 HG3 GLU 128 1HG GLU 128 -10.176 -7.019 15.442 617 H SER 129 H SER 129 -5.777 -5.444 13.829 618 HA SER 129 HA SER 129 -7.267 -3.981 11.912 619 HB2 SER 129 2HB SER 129 -5.140 -3.161 11.108 620 HB3 SER 129 1HB SER 129 -5.027 -3.331 12.859 621 HG SER 129 HG SER 129 -3.371 -4.543 12.412 622 H VAL 130 H VAL 130 -5.511 -7.031 11.622 623 HA VAL 130 HA VAL 130 -5.432 -7.182 8.785 624 HB VAL 130 HB VAL 130 -5.652 -9.356 10.880 625 HG11 VAL 130 1HG1 VAL 130 -5.771 -9.454 7.931 626 HG12 VAL 130 2HG1 VAL 130 -6.274 -10.658 9.116 627 HG13 VAL 130 3HG1 VAL 130 -4.578 -10.533 8.649 628 HG21 VAL 130 1HG2 VAL 130 -3.591 -7.896 10.792 629 HG22 VAL 130 2HG2 VAL 130 -3.327 -8.468 9.146 630 HG23 VAL 130 3HG2 VAL 130 -3.273 -9.605 10.493 631 H MET 131 H MET 131 -7.993 -8.205 11.072 632 HA MET 131 HA MET 131 -9.717 -9.328 9.103 633 HB2 MET 131 2HB MET 131 -10.203 -8.055 11.793 634 HB3 MET 131 1HB MET 131 -11.547 -8.597 10.798 635 HG2 MET 131 2HG MET 131 -9.226 -10.336 11.683 636 HG3 MET 131 1HG MET 131 -10.830 -10.340 12.417 637 HE1 MET 131 1HE MET 131 -12.683 -10.028 9.430 638 HE2 MET 131 2HE MET 131 -12.878 -10.429 11.135 639 HE3 MET 131 3HE MET 131 -13.209 -11.648 9.909 640 H ASN 132 H ASN 132 -9.318 -6.012 10.271 641 HA ASN 132 HA ASN 132 -11.494 -4.877 8.816 642 HB2 ASN 132 2HB ASN 132 -10.083 -3.755 10.630 643 HB3 ASN 132 1HB ASN 132 -8.865 -3.485 9.381 644 HD21 ASN 132 1HD2 ASN 132 -9.440 -1.103 9.932 645 HD22 ASN 132 2HD2 ASN 132 -10.736 -0.408 9.085 646 H TRP 133 H TRP 133 -8.103 -5.481 7.933 647 HA TRP 133 HA TRP 133 -8.255 -4.223 5.354 648 HB2 TRP 133 2HB TRP 133 -6.064 -4.568 6.073 649 HB3 TRP 133 1HB TRP 133 -6.406 -6.195 6.658 650 HD1 TRP 133 HD TRP 133 -5.808 -4.250 3.404 651 HE1 TRP 133 1HE TRP 133 -5.114 -5.917 1.569 652 HE3 TRP 133 3HE TRP 133 -6.460 -8.638 5.917 653 HZ2 TRP 133 2HZ TRP 133 -4.861 -8.744 1.216 654 HZ3 TRP 133 3HZ TRP 133 -5.983 -10.804 4.813 655 HH2 TRP 133 HH TRP 133 -5.185 -10.863 2.466 656 H GLN 134 H GLN 134 -8.485 -7.672 6.292 657 HA GLN 134 HA GLN 134 -9.146 -8.518 3.603 658 HB2 GLN 134 2HB GLN 134 -8.184 -10.029 5.350 659 HB3 GLN 134 1HB GLN 134 -9.717 -9.944 6.214 660 HG2 GLN 134 2HG GLN 134 -10.472 -10.572 3.612 661 HG3 GLN 134 1HG GLN 134 -9.002 -11.516 3.857 662 HE21 GLN 134 1HE2 GLN 134 -11.657 -10.587 6.120 663 HE22 GLN 134 2HE2 GLN 134 -11.993 -12.180 6.608 664 H GLN 135 H GLN 135 -11.096 -8.000 6.544 665 HA GLN 135 HA GLN 135 -13.592 -8.686 5.343 666 HB2 GLN 135 2HB GLN 135 -13.170 -8.507 7.803 667 HB3 GLN 135 1HB GLN 135 -13.132 -6.754 7.632 668 HG2 GLN 135 2HG GLN 135 -15.437 -6.881 6.620 669 HG3 GLN 135 1HG GLN 135 -15.460 -8.596 7.034 670 HE21 GLN 135 1HE2 GLN 135 -16.598 -8.920 8.944 671 HE22 GLN 135 2HE2 GLN 135 -16.568 -7.884 10.286 672 H TYR 136 H TYR 136 -11.896 -5.571 5.605 673 HA TYR 136 HA TYR 136 -14.071 -4.027 4.509 674 HB2 TYR 136 2HB TYR 136 -12.263 -2.960 5.781 675 HB3 TYR 136 1HB TYR 136 -11.102 -3.434 4.538 676 HD1 TYR 136 1HD TYR 136 -13.710 -1.069 5.460 677 HD2 TYR 136 2HD TYR 136 -11.300 -2.545 2.226 678 HE1 TYR 136 1HE TYR 136 -14.288 0.937 4.115 679 HE2 TYR 136 2HE TYR 136 -11.875 -0.543 0.881 680 HH TYR 136 HH TYR 136 -12.684 2.039 1.682 681 H TRP 137 H TRP 137 -11.012 -5.142 2.996 682 HA TRP 137 HA TRP 137 -11.862 -4.248 0.390 683 HB2 TRP 137 2HB TRP 137 -9.604 -6.057 1.263 684 HB3 TRP 137 1HB TRP 137 -9.845 -5.515 -0.396 685 HD1 TRP 137 HD TRP 137 -8.006 -4.595 2.561 686 HE1 TRP 137 1HE TRP 137 -7.288 -2.123 2.535 687 HE3 TRP 137 3HE TRP 137 -10.985 -2.871 -1.183 688 HZ2 TRP 137 2HZ TRP 137 -7.903 0.275 1.105 689 HZ3 TRP 137 3HZ TRP 137 -10.907 -0.490 -1.866 690 HH2 TRP 137 HH TRP 137 -9.369 1.086 -0.725 691 H LYS 138 H LYS 138 -11.927 -7.402 2.026 692 HA LYS 138 HA LYS 138 -12.588 -8.953 -0.264 693 HB2 LYS 138 2HB LYS 138 -12.026 -9.944 1.941 694 HB3 LYS 138 1HB LYS 138 -13.567 -9.363 2.576 695 HG2 LYS 138 2HG LYS 138 -14.753 -10.695 0.842 696 HG3 LYS 138 1HG LYS 138 -13.199 -11.317 0.285 697 HD2 LYS 138 2HD LYS 138 -12.789 -12.208 2.591 698 HD3 LYS 138 1HD LYS 138 -14.422 -11.704 3.031 699 HE2 LYS 138 2HE LYS 138 -15.163 -13.678 2.241 700 HE3 LYS 138 1HE LYS 138 -14.710 -13.133 0.625 701 HZ1 LYS 138 1HZ LYS 138 -13.008 -14.623 2.547 702 HZ2 LYS 138 2HZ LYS 138 -12.447 -13.969 1.083 703 HZ3 LYS 138 3HZ LYS 138 -13.623 -15.195 1.074 704 H ASP 139 H ASP 139 -14.662 -7.115 1.955 705 HA ASP 139 HA ASP 139 -17.148 -7.903 0.769 706 HB2 ASP 139 2HB ASP 139 -16.378 -5.390 2.281 707 HB3 ASP 139 1HB ASP 139 -18.034 -5.821 1.852 708 H GLU 140 H GLU 140 -14.949 -5.177 0.106 709 HA GLU 140 HA GLU 140 -16.699 -4.219 -2.052 710 HB2 GLU 140 2HB GLU 140 -13.974 -3.284 -1.115 711 HB3 GLU 140 1HB GLU 140 -14.944 -2.482 -2.351 712 HG2 GLU 140 2HG GLU 140 -16.775 -2.192 -0.693 713 HG3 GLU 140 1HG GLU 140 -15.749 -2.926 0.539 714 H ILE 141 H ILE 141 -13.321 -5.363 -1.836 715 HA ILE 141 HA ILE 141 -13.649 -6.491 -4.565 716 HB ILE 141 HB ILE 141 -11.119 -5.786 -4.803 717 HG12 ILE 141 2HG1 ILE 141 -11.879 -3.332 -3.355 718 HG13 ILE 141 1HG1 ILE 141 -11.608 -4.722 -2.309 719 HG21 ILE 141 1HG2 ILE 141 -13.445 -3.857 -5.052 720 HG22 ILE 141 2HG2 ILE 141 -12.924 -5.023 -6.268 721 HG23 ILE 141 3HG2 ILE 141 -11.882 -3.663 -5.848 722 HD11 ILE 141 1HD1 ILE 141 -9.382 -4.980 -3.006 723 HD12 ILE 141 2HD1 ILE 141 -9.569 -3.227 -2.942 724 HD13 ILE 141 3HD1 ILE 141 -9.645 -4.065 -4.490 725 H GLY 142 H GLY 142 -11.083 -6.351 -2.056 726 HA2 GLY 142 2HA GLY 142 -10.449 -8.293 -0.731 727 HA3 GLY 142 1HA GLY 142 -11.139 -9.325 -1.985 728 H SER 143 H SER 143 -9.605 -7.065 -3.739 729 HA SER 143 HA SER 143 -6.858 -7.352 -3.498 730 HB2 SER 143 2HB SER 143 -6.678 -9.645 -3.593 731 HB3 SER 143 1HB SER 143 -8.166 -9.829 -4.517 732 HG SER 143 HG SER 143 -7.099 -9.419 -6.344 733 H GLN 144 H GLN 144 -7.602 -5.263 -4.539 734 HA GLN 144 HA GLN 144 -7.187 -5.457 -7.443 735 HB2 GLN 144 2HB GLN 144 -9.775 -5.491 -6.628 736 HB3 GLN 144 1HB GLN 144 -9.510 -3.752 -6.743 737 HG2 GLN 144 2HG GLN 144 -8.693 -4.013 -9.046 738 HG3 GLN 144 1HG GLN 144 -8.919 -5.760 -8.937 739 HE21 GLN 144 1HE2 GLN 144 -10.778 -2.684 -8.658 740 HE22 GLN 144 2HE2 GLN 144 -12.237 -3.343 -9.218 741 HA PRO 145 HA PRO 145 -4.940 -1.941 -5.427 742 HB2 PRO 145 2HB PRO 145 -3.458 -2.151 -7.994 743 HB3 PRO 145 1HB PRO 145 -2.839 -2.077 -6.336 744 HG2 PRO 145 2HG PRO 145 -2.845 -4.339 -7.783 745 HG3 PRO 145 1HG PRO 145 -3.015 -4.326 -6.025 746 HD2 PRO 145 2HD PRO 145 -5.076 -4.851 -8.103 747 HD3 PRO 145 1HD PRO 145 -4.993 -5.425 -6.424 748 H PHE 146 H PHE 146 -5.103 0.312 -5.938 749 HA PHE 146 HA PHE 146 -6.206 0.997 -8.588 750 HB2 PHE 146 2HB PHE 146 -7.882 2.502 -7.511 751 HB3 PHE 146 1HB PHE 146 -8.186 0.793 -7.218 752 HD1 PHE 146 1HD PHE 146 -8.050 3.947 -5.743 753 HD2 PHE 146 2HD PHE 146 -6.923 -0.133 -4.985 754 HE1 PHE 146 1HE PHE 146 -8.044 4.398 -3.309 755 HE2 PHE 146 2HE PHE 146 -6.904 0.332 -2.556 756 HZ PHE 146 HZ PHE 146 -7.467 2.592 -1.713 757 H THR 147 H THR 147 -5.850 3.185 -9.205 758 HA THR 147 HA THR 147 -3.775 4.559 -7.561 759 HB THR 147 HB THR 147 -2.873 5.465 -9.612 760 HG1 THR 147 1HG THR 147 -5.159 4.252 -10.725 761 HG21 THR 147 1HG2 THR 147 -1.719 3.538 -9.628 762 HG22 THR 147 2HG2 THR 147 -2.857 2.975 -10.853 763 HG23 THR 147 3HG2 THR 147 -3.139 2.606 -9.151 764 H CYS 148 H CYS 148 -3.902 6.886 -7.585 765 HA CYS 148 HA CYS 148 -6.510 7.988 -8.421 766 HB2 CYS 148 2HB CYS 148 -5.546 8.966 -5.809 767 HB3 CYS 148 1HB CYS 148 -7.173 8.506 -6.301 768 H TYR 149 H TYR 149 -6.460 10.346 -8.584 769 HA TYR 149 HA TYR 149 -3.742 11.556 -8.504 770 HB2 TYR 149 2HB TYR 149 -5.546 11.508 -10.940 771 HB3 TYR 149 1HB TYR 149 -4.172 12.597 -10.765 772 HD1 TYR 149 1HD TYR 149 -5.188 9.039 -11.051 773 HD2 TYR 149 2HD TYR 149 -1.911 11.808 -10.939 774 HE1 TYR 149 1HE TYR 149 -3.654 7.250 -11.814 775 HE2 TYR 149 2HE TYR 149 -0.373 10.020 -11.702 776 HH TYR 149 HH TYR 149 -1.550 6.937 -12.811 777 H PHE 150 H PHE 150 -3.864 13.650 -7.699 778 HA PHE 150 HA PHE 150 -6.464 15.025 -7.912 779 HB2 PHE 150 2HB PHE 150 -7.034 14.832 -5.739 780 HB3 PHE 150 1HB PHE 150 -5.777 13.606 -5.618 781 HD1 PHE 150 1HD PHE 150 -6.822 16.914 -4.656 782 HD2 PHE 150 2HD PHE 150 -3.407 14.338 -5.027 783 HE1 PHE 150 1HE PHE 150 -5.562 18.379 -3.102 784 HE2 PHE 150 2HE PHE 150 -2.137 15.794 -3.478 785 HZ PHE 150 HZ PHE 150 -3.216 17.809 -2.503 786 H ASN 151 H ASN 151 -6.352 17.264 -7.781 787 HA ASN 151 HA ASN 151 -3.676 18.460 -7.277 788 HB2 ASN 151 2HB ASN 151 -3.545 19.550 -9.352 789 HB3 ASN 151 1HB ASN 151 -4.122 17.939 -9.777 790 HD21 ASN 151 1HD2 ASN 151 -6.161 17.780 -10.795 791 HD22 ASN 151 2HD2 ASN 151 -7.199 19.099 -11.038 792 H GLN 152 H GLN 152 -3.903 20.175 -5.998 793 HA GLN 152 HA GLN 152 -6.545 21.434 -5.622 794 HB2 GLN 152 2HB GLN 152 -5.179 20.844 -3.633 795 HB3 GLN 152 1HB GLN 152 -3.894 21.901 -4.212 796 HG2 GLN 152 2HG GLN 152 -5.304 23.850 -3.992 797 HG3 GLN 152 1HG GLN 152 -6.711 22.853 -3.631 798 HE21 GLN 152 1HE2 GLN 152 -6.123 24.734 -1.721 799 HE22 GLN 152 2HE2 GLN 152 -5.400 24.020 -0.362 800 H HIS 153 H HIS 153 -3.850 21.791 -7.575 801 HA HIS 153 HA HIS 153 -3.235 24.498 -7.674 802 HB2 HIS 153 2HB HIS 153 -3.618 22.548 -9.958 803 HB3 HIS 153 1HB HIS 153 -2.872 24.133 -10.134 804 HD1 HIS 153 1HD HIS 153 -0.413 23.716 -10.325 805 HD2 HIS 153 2HD HIS 153 -2.145 21.410 -7.310 806 HE1 HIS 153 1HE HIS 153 1.487 22.503 -9.166 807 HE2 HIS 153 2HE HIS 153 0.441 21.095 -7.332 808 H GLN 154 H GLN 154 -6.167 22.910 -8.872 809 HA GLN 154 HA GLN 154 -7.158 25.215 -10.296 810 HB2 GLN 154 2HB GLN 154 -8.602 22.843 -9.072 811 HB3 GLN 154 1HB GLN 154 -9.354 24.028 -10.137 812 HG2 GLN 154 2HG GLN 154 -7.782 23.453 -11.931 813 HG3 GLN 154 1HG GLN 154 -6.972 22.302 -10.868 814 HE21 GLN 154 1HE2 GLN 154 -8.148 21.413 -13.302 815 HE22 GLN 154 2HE2 GLN 154 -9.496 20.445 -12.938 816 H ARG 155 H ARG 155 -8.455 23.792 -7.293 817 HA ARG 155 HA ARG 155 -8.249 26.244 -5.806 818 HB2 ARG 155 2HB ARG 155 -10.460 26.185 -7.541 819 HB3 ARG 155 1HB ARG 155 -11.114 25.789 -5.951 820 HG2 ARG 155 2HG ARG 155 -11.180 28.154 -6.042 821 HG3 ARG 155 1HG ARG 155 -9.764 27.781 -5.064 822 HD2 ARG 155 2HD ARG 155 -8.270 28.292 -6.825 823 HD3 ARG 155 1HD ARG 155 -9.540 28.196 -8.046 824 HE ARG 155 HE ARG 155 -9.924 30.305 -6.039 825 HH11 ARG 155 1HH1 ARG 155 -9.907 32.404 -6.878 826 HH12 ARG 155 2HH1 ARG 155 -9.348 32.671 -8.495 827 HH21 ARG 155 1HH2 ARG 155 -8.663 29.324 -9.095 828 HH22 ARG 155 2HH2 ARG 155 -8.644 30.928 -9.751 829 HA PRO 156 HA PRO 156 -10.253 22.873 -3.199 830 HB2 PRO 156 2HB PRO 156 -11.870 21.023 -4.294 831 HB3 PRO 156 1HB PRO 156 -12.389 22.707 -4.107 832 HG2 PRO 156 2HG PRO 156 -11.703 21.235 -6.544 833 HG3 PRO 156 1HG PRO 156 -12.644 22.721 -6.352 834 HD2 PRO 156 2HD PRO 156 -9.821 22.434 -7.057 835 HD3 PRO 156 1HD PRO 156 -10.824 23.894 -7.074 836 H ASP 157 H ASP 157 -10.630 20.247 -5.404 837 HA ASP 157 HA ASP 157 -7.950 19.244 -5.425 838 HB2 ASP 157 2HB ASP 157 -8.854 17.292 -3.725 839 HB3 ASP 157 1HB ASP 157 -7.829 18.640 -3.233 840 H ASP 158 H ASP 158 -8.914 18.902 -7.615 841 HA ASP 158 HA ASP 158 -11.128 17.179 -8.109 842 HB2 ASP 158 2HB ASP 158 -9.868 18.533 -9.852 843 HB3 ASP 158 1HB ASP 158 -8.594 17.316 -9.777 844 H VAL 159 H VAL 159 -11.137 14.821 -8.461 845 HA VAL 159 HA VAL 159 -8.688 13.451 -7.419 846 HB VAL 159 HB VAL 159 -10.080 11.974 -6.062 847 HG11 VAL 159 1HG1 VAL 159 -10.950 14.817 -5.507 848 HG12 VAL 159 2HG1 VAL 159 -9.295 14.271 -5.231 849 HG13 VAL 159 3HG1 VAL 159 -10.629 13.531 -4.342 850 HG21 VAL 159 1HG2 VAL 159 -12.525 12.565 -5.813 851 HG22 VAL 159 2HG2 VAL 159 -12.100 11.911 -7.397 852 HG23 VAL 159 3HG2 VAL 159 -12.342 13.646 -7.195 853 H LEU 160 H LEU 160 -8.321 11.360 -8.196 854 HA LEU 160 HA LEU 160 -10.096 10.445 -10.428 855 HB2 LEU 160 2HB LEU 160 -7.800 11.383 -11.125 856 HB3 LEU 160 1HB LEU 160 -7.111 9.986 -10.308 857 HG LEU 160 HG LEU 160 -8.536 8.499 -11.725 858 HD11 LEU 160 1HD1 LEU 160 -9.195 10.027 -13.907 859 HD12 LEU 160 2HD1 LEU 160 -9.541 11.139 -12.580 860 HD13 LEU 160 3HD1 LEU 160 -10.328 9.561 -12.638 861 HD21 LEU 160 1HD2 LEU 160 -6.538 8.467 -12.800 862 HD22 LEU 160 2HD2 LEU 160 -6.332 10.211 -12.642 863 HD23 LEU 160 3HD2 LEU 160 -7.300 9.555 -13.961 864 H LEU 161 H LEU 161 -10.362 8.119 -10.525 865 HA LEU 161 HA LEU 161 -9.105 6.599 -8.291 866 HB2 LEU 161 2HB LEU 161 -11.414 7.393 -7.647 867 HB3 LEU 161 1HB LEU 161 -12.048 6.394 -8.957 868 HG LEU 161 HG LEU 161 -10.472 4.569 -7.755 869 HD11 LEU 161 1HD1 LEU 161 -9.736 6.133 -6.004 870 HD12 LEU 161 2HD1 LEU 161 -10.687 4.823 -5.306 871 HD13 LEU 161 3HD1 LEU 161 -11.412 6.413 -5.538 872 HD21 LEU 161 1HD2 LEU 161 -12.766 4.112 -8.187 873 HD22 LEU 161 2HD2 LEU 161 -13.306 5.403 -7.113 874 HD23 LEU 161 3HD2 LEU 161 -12.588 3.939 -6.442 875 H HIS 162 H HIS 162 -7.957 6.050 -10.539 876 HA HIS 162 HA HIS 162 -9.379 4.227 -12.296 877 HB2 HIS 162 2HB HIS 162 -6.427 4.773 -11.878 878 HB3 HIS 162 1HB HIS 162 -7.039 3.651 -13.092 879 HD1 HIS 162 1HD HIS 162 -5.571 5.933 -14.275 880 HD2 HIS 162 2HD HIS 162 -9.616 6.257 -13.302 881 HE1 HIS 162 1HE HIS 162 -6.498 7.834 -15.671 882 HE2 HIS 162 2HE HIS 162 -8.957 8.038 -15.088 883 H ARG 163 H ARG 163 -8.926 1.880 -12.441 884 HA ARG 163 HA ARG 163 -8.232 0.725 -9.762 885 HB2 ARG 163 2HB ARG 163 -10.147 -0.301 -11.876 886 HB3 ARG 163 1HB ARG 163 -9.741 -1.153 -10.385 887 HG2 ARG 163 2HG ARG 163 -10.556 0.812 -9.081 888 HG3 ARG 163 1HG ARG 163 -11.052 1.573 -10.594 889 HD2 ARG 163 2HD ARG 163 -12.473 -0.464 -11.054 890 HD3 ARG 163 1HD ARG 163 -12.097 -1.018 -9.422 891 HE ARG 163 HE ARG 163 -13.521 0.681 -8.560 892 HH11 ARG 163 1HH1 ARG 163 -15.109 2.262 -8.854 893 HH12 ARG 163 2HH1 ARG 163 -15.363 2.932 -10.431 894 HH21 ARG 163 1HH2 ARG 163 -12.899 1.011 -11.933 895 HH22 ARG 163 2HH2 ARG 163 -14.112 2.222 -12.175 896 H THR 164 H THR 164 -7.189 -1.396 -9.797 897 HA THR 164 HA THR 164 -5.456 -1.737 -12.202 898 HB THR 164 HB THR 164 -5.033 -2.926 -9.454 899 HG1 THR 164 1HG THR 164 -3.931 -0.558 -10.558 900 HG21 THR 164 1HG2 THR 164 -3.199 -3.854 -10.364 901 HG22 THR 164 2HG2 THR 164 -2.696 -2.311 -11.053 902 HG23 THR 164 3HG2 THR 164 -3.808 -3.353 -11.941 903 H HIS 165 H HIS 165 -5.326 -3.759 -13.216 904 HA HIS 165 HA HIS 165 -7.425 -5.721 -12.385 905 HB2 HIS 165 2HB HIS 165 -6.090 -5.319 -15.080 906 HB3 HIS 165 1HB HIS 165 -7.338 -6.514 -14.726 907 HD1 HIS 165 1HD HIS 165 -9.660 -5.393 -13.717 908 HD2 HIS 165 2HD HIS 165 -7.132 -2.890 -15.897 909 HE1 HIS 165 1HE HIS 165 -11.053 -3.392 -14.408 910 HE2 HIS 165 2HE HIS 165 -9.524 -1.862 -15.734 911 H ASP 166 H ASP 166 -6.806 -7.818 -11.923 912 HA ASP 166 HA ASP 166 -4.026 -8.343 -11.370 913 HB2 ASP 166 2HB ASP 166 -4.779 -10.603 -10.793 914 HB3 ASP 166 1HB ASP 166 -5.894 -9.412 -10.124 Start of MODEL 19 1 H1 GLN 45 1HT GLN 45 4.425 19.827 -6.761 2 H2 GLN 45 2HT GLN 45 5.809 19.886 -7.744 3 H3 GLN 45 3HT GLN 45 5.843 20.558 -6.183 4 HA GLN 45 HA GLN 45 5.769 17.705 -6.956 5 HB2 GLN 45 2HB GLN 45 7.547 19.375 -5.150 6 HB3 GLN 45 1HB GLN 45 7.706 17.634 -5.389 7 HG2 GLN 45 2HG GLN 45 8.091 17.978 -7.790 8 HG3 GLN 45 1HG GLN 45 7.894 19.719 -7.582 9 HE21 GLN 45 1HE2 GLN 45 10.339 18.660 -8.594 10 HE22 GLN 45 2HE2 GLN 45 11.557 18.902 -7.437 11 H ASP 46 H ASP 46 6.515 16.963 -4.250 12 HA ASP 46 HA ASP 46 3.990 16.413 -3.124 13 HB2 ASP 46 2HB ASP 46 6.725 16.594 -1.841 14 HB3 ASP 46 1HB ASP 46 5.299 16.001 -0.992 15 H LEU 47 H LEU 47 6.209 19.105 -2.503 16 HA LEU 47 HA LEU 47 4.829 20.273 -0.315 17 HB2 LEU 47 2HB LEU 47 6.292 21.711 -2.553 18 HB3 LEU 47 1HB LEU 47 5.949 22.357 -0.947 19 HG LEU 47 HG LEU 47 7.678 19.942 -1.559 20 HD11 LEU 47 1HD1 LEU 47 8.636 22.222 -2.077 21 HD12 LEU 47 2HD1 LEU 47 9.527 21.322 -0.852 22 HD13 LEU 47 3HD1 LEU 47 8.438 22.624 -0.371 23 HD21 LEU 47 1HD2 LEU 47 8.191 20.452 1.005 24 HD22 LEU 47 2HD2 LEU 47 6.836 19.424 0.539 25 HD23 LEU 47 3HD2 LEU 47 6.557 21.115 0.959 26 H GLN 48 H GLN 48 4.256 20.426 -3.790 27 HA GLN 48 HA GLN 48 1.905 22.195 -3.319 28 HB2 GLN 48 2HB GLN 48 3.572 22.833 -5.081 29 HB3 GLN 48 1HB GLN 48 3.184 21.341 -5.934 30 HG2 GLN 48 2HG GLN 48 0.692 22.269 -5.655 31 HG3 GLN 48 1HG GLN 48 1.544 23.813 -5.594 32 HE21 GLN 48 1HE2 GLN 48 0.990 20.942 -7.622 33 HE22 GLN 48 2HE2 GLN 48 1.510 21.657 -9.070 34 H ALA 49 H ALA 49 -0.141 21.348 -3.532 35 HA ALA 49 HA ALA 49 -0.572 18.534 -3.629 36 HB1 ALA 49 1HB ALA 49 -2.258 19.935 -2.654 37 HB2 ALA 49 2HB ALA 49 -2.974 19.201 -4.089 38 HB3 ALA 49 3HB ALA 49 -2.418 20.875 -4.137 39 H THR 50 H THR 50 -1.087 17.156 -5.332 40 HA THR 50 HA THR 50 -1.813 18.009 -7.965 41 HB THR 50 HB THR 50 1.059 17.080 -7.700 42 HG1 THR 50 1HG THR 50 0.041 19.645 -8.344 43 HG21 THR 50 1HG2 THR 50 -0.324 18.278 -10.101 44 HG22 THR 50 2HG2 THR 50 -0.323 16.540 -9.800 45 HG23 THR 50 3HG2 THR 50 1.199 17.392 -10.049 46 H GLU 51 H GLU 51 0.438 15.489 -6.825 47 HA GLU 51 HA GLU 51 -1.482 13.472 -7.887 48 HB2 GLU 51 2HB GLU 51 1.495 13.207 -7.444 49 HB3 GLU 51 1HB GLU 51 0.445 12.033 -8.237 50 HG2 GLU 51 2HG GLU 51 -0.116 13.773 -9.954 51 HG3 GLU 51 1HG GLU 51 1.070 14.837 -9.200 52 H ALA 52 H ALA 52 -2.144 11.812 -6.627 53 HA ALA 52 HA ALA 52 -0.829 11.187 -4.068 54 HB1 ALA 52 1HB ALA 52 -3.433 12.600 -4.304 55 HB2 ALA 52 2HB ALA 52 -2.298 12.566 -2.954 56 HB3 ALA 52 3HB ALA 52 -3.411 11.219 -3.207 57 H ASN 53 H ASN 53 -0.596 8.961 -4.508 58 HA ASN 53 HA ASN 53 -2.905 7.677 -5.861 59 HB2 ASN 53 2HB ASN 53 -0.058 6.738 -5.565 60 HB3 ASN 53 1HB ASN 53 -1.344 5.762 -6.266 61 HD21 ASN 53 1HD2 ASN 53 -2.750 7.904 -7.637 62 HD22 ASN 53 2HD2 ASN 53 -1.753 8.448 -8.898 63 H CYS 54 H CYS 54 -4.062 6.040 -5.013 64 HA CYS 54 HA CYS 54 -3.316 5.125 -2.269 65 HB2 CYS 54 2HB CYS 54 -6.183 5.256 -2.720 66 HB3 CYS 54 1HB CYS 54 -5.241 5.977 -1.421 67 H THR 55 H THR 55 -2.676 3.045 -2.956 68 HA THR 55 HA THR 55 -4.778 1.544 -4.445 69 HB THR 55 HB THR 55 -3.311 1.116 -6.090 70 HG1 THR 55 1HG THR 55 -1.343 0.040 -5.529 71 HG21 THR 55 1HG2 THR 55 -2.445 3.404 -5.438 72 HG22 THR 55 2HG2 THR 55 -1.250 2.372 -6.214 73 HG23 THR 55 3HG2 THR 55 -1.221 2.591 -4.467 74 H VAL 56 H VAL 56 -5.010 -0.632 -4.037 75 HA VAL 56 HA VAL 56 -3.858 -1.548 -1.456 76 HB VAL 56 HB VAL 56 -6.311 -2.434 -3.000 77 HG11 VAL 56 1HG1 VAL 56 -5.904 -4.477 -2.099 78 HG12 VAL 56 2HG1 VAL 56 -6.325 -3.736 -0.555 79 HG13 VAL 56 3HG1 VAL 56 -4.637 -3.851 -1.045 80 HG21 VAL 56 1HG2 VAL 56 -7.480 -1.206 -1.499 81 HG22 VAL 56 2HG2 VAL 56 -5.940 -0.432 -1.115 82 HG23 VAL 56 3HG2 VAL 56 -6.509 -1.793 -0.148 83 H LEU 57 H LEU 57 -2.253 -2.975 -1.628 84 HA LEU 57 HA LEU 57 -1.280 -3.939 -4.110 85 HB2 LEU 57 2HB LEU 57 -0.065 -3.819 -1.848 86 HB3 LEU 57 1HB LEU 57 -0.872 -5.338 -1.467 87 HG LEU 57 HG LEU 57 0.073 -6.243 -3.659 88 HD11 LEU 57 1HD1 LEU 57 2.364 -4.545 -3.734 89 HD12 LEU 57 2HD1 LEU 57 0.938 -3.518 -3.846 90 HD13 LEU 57 3HD1 LEU 57 1.177 -4.822 -5.007 91 HD21 LEU 57 1HD2 LEU 57 1.550 -5.593 -1.164 92 HD22 LEU 57 2HD2 LEU 57 2.522 -6.151 -2.526 93 HD23 LEU 57 3HD2 LEU 57 1.220 -7.162 -1.900 94 H SER 58 H SER 58 -1.309 -6.154 -4.926 95 HA SER 58 HA SER 58 -3.920 -7.449 -4.424 96 HB2 SER 58 2HB SER 58 -3.518 -8.662 -6.474 97 HB3 SER 58 1HB SER 58 -3.076 -6.985 -6.781 98 HG SER 58 HG SER 58 -1.308 -9.089 -6.049 99 H VAL 59 H VAL 59 -3.909 -9.815 -3.947 100 HA VAL 59 HA VAL 59 -1.550 -10.473 -2.282 101 HB VAL 59 HB VAL 59 -4.069 -12.118 -2.526 102 HG11 VAL 59 1HG1 VAL 59 -2.005 -11.659 -0.351 103 HG12 VAL 59 2HG1 VAL 59 -2.249 -13.139 -1.279 104 HG13 VAL 59 3HG1 VAL 59 -3.477 -12.604 -0.131 105 HG21 VAL 59 1HG2 VAL 59 -4.988 -10.756 -0.665 106 HG22 VAL 59 2HG2 VAL 59 -4.736 -9.774 -2.109 107 HG23 VAL 59 3HG2 VAL 59 -3.594 -9.682 -0.770 108 H GLN 60 H GLN 60 0.043 -11.589 -3.234 109 HA GLN 60 HA GLN 60 -0.648 -13.852 -5.027 110 HB2 GLN 60 2HB GLN 60 1.433 -11.747 -5.688 111 HB3 GLN 60 1HB GLN 60 1.039 -13.164 -6.661 112 HG2 GLN 60 2HG GLN 60 -0.882 -10.919 -5.978 113 HG3 GLN 60 1HG GLN 60 -0.079 -11.138 -7.534 114 HE21 GLN 60 1HE2 GLN 60 -3.050 -11.446 -6.450 115 HE22 GLN 60 2HE2 GLN 60 -3.542 -12.904 -7.165 116 H GLN 61 H GLN 61 1.111 -15.423 -5.186 117 HA GLN 61 HA GLN 61 2.621 -15.630 -2.692 118 HB2 GLN 61 2HB GLN 61 2.755 -17.389 -5.153 119 HB3 GLN 61 1HB GLN 61 3.321 -17.803 -3.539 120 HG2 GLN 61 2HG GLN 61 0.456 -17.264 -4.367 121 HG3 GLN 61 1HG GLN 61 1.142 -18.825 -3.910 122 HE21 GLN 61 1HE2 GLN 61 -0.614 -16.248 -2.685 123 HE22 GLN 61 2HE2 GLN 61 -0.258 -16.448 -1.042 124 H ILE 62 H ILE 62 5.046 -16.419 -3.029 125 HA ILE 62 HA ILE 62 6.658 -14.274 -3.703 126 HB ILE 62 HB ILE 62 7.321 -17.214 -4.070 127 HG12 ILE 62 2HG1 ILE 62 7.838 -15.352 -1.732 128 HG13 ILE 62 1HG1 ILE 62 6.495 -16.494 -1.802 129 HG21 ILE 62 1HG2 ILE 62 9.676 -16.271 -3.533 130 HG22 ILE 62 2HG2 ILE 62 9.006 -14.710 -4.001 131 HG23 ILE 62 3HG2 ILE 62 9.055 -16.035 -5.165 132 HD11 ILE 62 1HD1 ILE 62 8.343 -18.265 -2.310 133 HD12 ILE 62 2HD1 ILE 62 8.138 -17.709 -0.648 134 HD13 ILE 62 3HD1 ILE 62 9.445 -17.063 -1.640 135 H GLY 63 H GLY 63 8.279 -14.214 -5.615 136 HA2 GLY 63 2HA GLY 63 8.703 -14.523 -7.976 137 HA3 GLY 63 1HA GLY 63 7.053 -15.124 -8.162 138 H GLU 64 H GLU 64 6.917 -12.505 -6.154 139 HA GLU 64 HA GLU 64 6.446 -10.619 -8.416 140 HB2 GLU 64 2HB GLU 64 4.901 -10.868 -5.821 141 HB3 GLU 64 1HB GLU 64 4.658 -9.596 -7.018 142 HG2 GLU 64 2HG GLU 64 4.336 -12.566 -7.527 143 HG3 GLU 64 1HG GLU 64 3.021 -11.417 -7.299 144 H VAL 65 H VAL 65 7.172 -8.507 -8.111 145 HA VAL 65 HA VAL 65 8.695 -8.002 -5.589 146 HB VAL 65 HB VAL 65 10.174 -8.462 -7.567 147 HG11 VAL 65 1HG1 VAL 65 10.075 -7.204 -9.505 148 HG12 VAL 65 2HG1 VAL 65 9.396 -5.799 -8.683 149 HG13 VAL 65 3HG1 VAL 65 8.370 -7.185 -9.054 150 HG21 VAL 65 1HG2 VAL 65 11.466 -6.260 -7.335 151 HG22 VAL 65 2HG2 VAL 65 11.121 -7.118 -5.834 152 HG23 VAL 65 3HG2 VAL 65 10.153 -5.716 -6.293 153 H PHE 66 H PHE 66 8.329 -6.023 -4.649 154 HA PHE 66 HA PHE 66 6.646 -4.082 -6.170 155 HB2 PHE 66 2HB PHE 66 6.470 -4.774 -3.224 156 HB3 PHE 66 1HB PHE 66 5.513 -3.539 -4.044 157 HD1 PHE 66 1HD PHE 66 3.982 -4.229 -5.945 158 HD2 PHE 66 2HD PHE 66 5.852 -7.061 -3.316 159 HE1 PHE 66 1HE PHE 66 2.349 -5.955 -6.644 160 HE2 PHE 66 2HE PHE 66 4.218 -8.789 -4.014 161 HZ PHE 66 HZ PHE 66 2.465 -8.238 -5.678 162 H GLU 67 H GLU 67 6.957 -1.837 -5.527 163 HA GLU 67 HA GLU 67 9.674 -1.378 -4.375 164 HB2 GLU 67 2HB GLU 67 9.488 0.847 -5.602 165 HB3 GLU 67 1HB GLU 67 9.608 -0.581 -6.632 166 HG2 GLU 67 2HG GLU 67 7.123 -0.610 -6.825 167 HG3 GLU 67 1HG GLU 67 7.060 0.883 -5.889 168 H CYS 68 H CYS 68 9.924 0.395 -2.910 169 HA CYS 68 HA CYS 68 7.386 1.140 -1.520 170 HB2 CYS 68 2HB CYS 68 9.345 -0.121 -0.333 171 HB3 CYS 68 1HB CYS 68 10.145 1.451 -0.345 172 H THR 69 H THR 69 7.310 3.421 -0.706 173 HA THR 69 HA THR 69 8.879 5.233 -2.496 174 HB THR 69 HB THR 69 6.996 6.527 -2.847 175 HG1 THR 69 1HG THR 69 5.439 5.556 -0.798 176 HG21 THR 69 1HG2 THR 69 5.491 4.036 -2.100 177 HG22 THR 69 2HG2 THR 69 6.650 3.999 -3.430 178 HG23 THR 69 3HG2 THR 69 5.266 5.091 -3.496 179 H PHE 70 H PHE 70 9.606 7.211 -1.615 180 HA PHE 70 HA PHE 70 9.171 7.751 1.244 181 HB2 PHE 70 2HB PHE 70 11.557 7.813 1.789 182 HB3 PHE 70 1HB PHE 70 11.109 6.197 1.243 183 HD1 PHE 70 1HD PHE 70 11.774 5.390 -0.990 184 HD2 PHE 70 2HD PHE 70 12.971 9.256 0.450 185 HE1 PHE 70 1HE PHE 70 13.478 5.532 -2.786 186 HE2 PHE 70 2HE PHE 70 14.673 9.398 -1.349 187 HZ PHE 70 HZ PHE 70 14.927 7.536 -2.966 188 H THR 71 H THR 71 10.156 9.886 1.832 189 HA THR 71 HA THR 71 10.607 11.613 -0.553 190 HB THR 71 HB THR 71 8.939 12.390 1.853 191 HG1 THR 71 1HG THR 71 8.321 11.214 -0.601 192 HG21 THR 71 1HG2 THR 71 10.192 13.856 -0.242 193 HG22 THR 71 2HG2 THR 71 9.112 14.463 1.013 194 HG23 THR 71 3HG2 THR 71 8.452 13.899 -0.523 195 H CYS 72 H CYS 72 12.075 13.313 -0.220 196 HA CYS 72 HA CYS 72 13.375 13.403 2.468 197 HB2 CYS 72 2HB CYS 72 15.127 12.405 1.389 198 HB3 CYS 72 1HB CYS 72 14.567 12.908 -0.201 199 H GLY 73 H GLY 73 14.530 15.507 2.818 200 HA2 GLY 73 2HA GLY 73 12.827 17.702 1.880 201 HA3 GLY 73 1HA GLY 73 14.090 17.823 3.104 202 H ALA 74 H ALA 74 13.385 19.266 0.467 203 HA ALA 74 HA ALA 74 14.914 20.724 -0.704 204 HB1 ALA 74 1HB ALA 74 16.903 18.464 -0.837 205 HB2 ALA 74 2HB ALA 74 16.873 19.591 0.523 206 HB3 ALA 74 3HB ALA 74 17.172 20.181 -1.108 207 H ASP 75 H ASP 75 12.818 19.081 -1.602 208 HA ASP 75 HA ASP 75 11.932 18.199 -3.570 209 HB2 ASP 75 2HB ASP 75 14.346 19.627 -4.728 210 HB3 ASP 75 1HB ASP 75 13.022 18.963 -5.684 211 H CYS 76 H CYS 76 13.585 16.467 -2.030 212 HA CYS 76 HA CYS 76 14.911 14.852 -4.184 213 HB2 CYS 76 2HB CYS 76 15.818 13.721 -1.911 214 HB3 CYS 76 1HB CYS 76 16.628 15.099 -2.658 215 H ARG 77 H ARG 77 13.423 13.362 -4.834 216 HA ARG 77 HA ARG 77 11.982 11.839 -2.707 217 HB2 ARG 77 2HB ARG 77 10.832 12.977 -5.277 218 HB3 ARG 77 1HB ARG 77 9.989 11.820 -4.245 219 HG2 ARG 77 2HG ARG 77 9.810 13.350 -2.461 220 HG3 ARG 77 1HG ARG 77 11.089 14.380 -3.093 221 HD2 ARG 77 2HD ARG 77 8.996 15.494 -3.500 222 HD3 ARG 77 1HD ARG 77 9.604 14.909 -5.049 223 HE ARG 77 HE ARG 77 7.743 13.094 -3.660 224 HH11 ARG 77 1HH1 ARG 77 5.867 12.630 -4.832 225 HH12 ARG 77 2HH1 ARG 77 5.480 13.573 -6.232 226 HH21 ARG 77 1HH2 ARG 77 8.281 15.599 -5.972 227 HH22 ARG 77 2HH2 ARG 77 6.846 15.252 -6.877 228 H GLY 78 H GLY 78 11.687 9.597 -3.219 229 HA2 GLY 78 2HA GLY 78 12.313 8.576 -5.867 230 HA3 GLY 78 1HA GLY 78 13.641 8.310 -4.738 231 H THR 79 H THR 79 12.643 6.060 -5.676 232 HA THR 79 HA THR 79 10.937 5.014 -3.465 233 HB THR 79 HB THR 79 9.853 3.501 -5.072 234 HG1 THR 79 1HG THR 79 10.636 4.744 -7.323 235 HG21 THR 79 1HG2 THR 79 9.613 6.154 -6.415 236 HG22 THR 79 2HG2 THR 79 9.232 6.072 -4.694 237 HG23 THR 79 3HG2 THR 79 8.350 5.064 -5.841 238 H SER 80 H SER 80 11.278 2.669 -3.078 239 HA SER 80 HA SER 80 14.051 1.828 -3.841 240 HB2 SER 80 2HB SER 80 14.182 0.672 -1.705 241 HB3 SER 80 1HB SER 80 13.721 2.345 -1.411 242 HG SER 80 HG SER 80 11.472 1.386 -1.611 243 H GLN 81 H GLN 81 14.335 -0.530 -4.075 244 HA GLN 81 HA GLN 81 11.817 -1.854 -4.983 245 HB2 GLN 81 2HB GLN 81 13.540 -1.388 -6.752 246 HB3 GLN 81 1HB GLN 81 14.645 -2.443 -5.878 247 HG2 GLN 81 2HG GLN 81 13.623 -3.798 -7.565 248 HG3 GLN 81 1HG GLN 81 12.867 -4.250 -6.036 249 HE21 GLN 81 1HE2 GLN 81 10.622 -3.933 -5.833 250 HE22 GLN 81 2HE2 GLN 81 9.667 -3.180 -7.011 251 H TYR 82 H TYR 82 11.215 -3.635 -3.838 252 HA TYR 82 HA TYR 82 13.321 -5.179 -2.420 253 HB2 TYR 82 2HB TYR 82 10.885 -3.876 -1.223 254 HB3 TYR 82 1HB TYR 82 11.575 -5.317 -0.482 255 HD1 TYR 82 1HD TYR 82 14.302 -5.202 -0.364 256 HD2 TYR 82 2HD TYR 82 11.626 -1.841 -0.389 257 HE1 TYR 82 1HE TYR 82 16.047 -3.805 0.707 258 HE2 TYR 82 2HE TYR 82 13.371 -0.445 0.684 259 HH TYR 82 HH TYR 82 16.369 -1.838 1.866 260 HA PRO 83 HA PRO 83 11.321 -8.864 -3.883 261 HB2 PRO 83 2HB PRO 83 11.022 -9.751 -1.053 262 HB3 PRO 83 1HB PRO 83 11.765 -10.590 -2.427 263 HG2 PRO 83 2HG PRO 83 13.214 -9.439 -0.485 264 HG3 PRO 83 1HG PRO 83 13.765 -9.537 -2.164 265 HD2 PRO 83 2HD PRO 83 12.834 -7.176 -0.639 266 HD3 PRO 83 1HD PRO 83 13.890 -7.265 -2.065 267 H CYS 84 H CYS 84 9.413 -10.431 -2.323 268 HA CYS 84 HA CYS 84 6.994 -9.003 -3.007 269 HB2 CYS 84 2HB CYS 84 6.354 -11.165 -3.083 270 HB3 CYS 84 1HB CYS 84 7.732 -11.674 -2.107 271 H VAL 85 H VAL 85 5.422 -8.135 -1.597 272 HA VAL 85 HA VAL 85 6.270 -7.782 1.249 273 HB VAL 85 HB VAL 85 6.659 -5.708 -0.097 274 HG11 VAL 85 1HG1 VAL 85 4.589 -6.288 -1.575 275 HG12 VAL 85 2HG1 VAL 85 4.909 -4.596 -1.201 276 HG13 VAL 85 3HG1 VAL 85 3.665 -5.474 -0.314 277 HG21 VAL 85 1HG2 VAL 85 4.350 -5.426 1.850 278 HG22 VAL 85 2HG2 VAL 85 5.578 -4.219 1.477 279 HG23 VAL 85 3HG2 VAL 85 6.020 -5.687 2.348 280 H GLN 86 H GLN 86 4.512 -7.694 2.761 281 HA GLN 86 HA GLN 86 2.319 -9.371 2.269 282 HB2 GLN 86 2HB GLN 86 2.291 -7.040 4.203 283 HB3 GLN 86 1HB GLN 86 1.383 -8.548 4.321 284 HG2 GLN 86 2HG GLN 86 4.398 -8.274 4.446 285 HG3 GLN 86 1HG GLN 86 3.331 -8.649 5.797 286 HE21 GLN 86 1HE2 GLN 86 5.479 -10.205 3.963 287 HE22 GLN 86 2HE2 GLN 86 4.724 -11.714 3.776 288 H VAL 87 H VAL 87 -0.072 -8.143 2.841 289 HA VAL 87 HA VAL 87 -0.390 -6.232 0.554 290 HB VAL 87 HB VAL 87 -1.357 -8.464 0.103 291 HG11 VAL 87 1HG1 VAL 87 -2.874 -9.499 1.507 292 HG12 VAL 87 2HG1 VAL 87 -3.473 -7.972 2.155 293 HG13 VAL 87 3HG1 VAL 87 -1.928 -8.621 2.708 294 HG21 VAL 87 1HG2 VAL 87 -2.615 -5.935 -0.108 295 HG22 VAL 87 2HG2 VAL 87 -3.873 -7.075 0.373 296 HG23 VAL 87 3HG2 VAL 87 -2.927 -7.369 -1.087 297 H TYR 88 H TYR 88 -1.711 -4.469 0.825 298 HA TYR 88 HA TYR 88 -3.593 -4.073 2.910 299 HB2 TYR 88 2HB TYR 88 -1.465 -4.072 4.276 300 HB3 TYR 88 1HB TYR 88 -1.011 -2.610 3.423 301 HD1 TYR 88 1HD TYR 88 -1.443 -0.641 4.557 302 HD2 TYR 88 2HD TYR 88 -4.106 -3.969 5.086 303 HE1 TYR 88 1HE TYR 88 -2.823 0.707 6.114 304 HE2 TYR 88 2HE TYR 88 -5.485 -2.620 6.638 305 HH TYR 88 HH TYR 88 -5.146 0.747 6.946 306 H VAL 89 H VAL 89 -2.202 -1.137 2.992 307 HA VAL 89 HA VAL 89 -3.238 -0.375 0.299 308 HB VAL 89 HB VAL 89 -4.905 0.083 2.145 309 HG11 VAL 89 1HG1 VAL 89 -4.405 1.463 3.896 310 HG12 VAL 89 2HG1 VAL 89 -3.336 2.476 2.925 311 HG13 VAL 89 3HG1 VAL 89 -2.757 0.941 3.564 312 HG21 VAL 89 1HG2 VAL 89 -3.761 2.076 0.242 313 HG22 VAL 89 2HG2 VAL 89 -4.942 2.662 1.413 314 HG23 VAL 89 3HG2 VAL 89 -5.377 1.371 0.293 315 H ASN 90 H ASN 90 -2.003 1.037 -0.804 316 HA ASN 90 HA ASN 90 0.476 1.966 0.495 317 HB2 ASN 90 2HB ASN 90 -0.449 2.067 -2.390 318 HB3 ASN 90 1HB ASN 90 1.137 2.570 -1.819 319 HD21 ASN 90 1HD2 ASN 90 0.188 -0.012 0.097 320 HD22 ASN 90 2HD2 ASN 90 0.937 -1.269 -0.762 321 H ASN 91 H ASN 91 0.377 3.940 1.461 322 HA ASN 91 HA ASN 91 -1.643 5.878 0.512 323 HB2 ASN 91 2HB ASN 91 0.246 5.910 2.886 324 HB3 ASN 91 1HB ASN 91 -0.902 7.197 2.515 325 HD21 ASN 91 1HD2 ASN 91 -1.101 5.707 4.950 326 HD22 ASN 91 2HD2 ASN 91 -2.517 4.771 4.894 327 H SER 92 H SER 92 -0.625 6.409 -1.507 328 HA SER 92 HA SER 92 2.073 7.584 -1.410 329 HB2 SER 92 2HB SER 92 0.735 7.992 -3.918 330 HB3 SER 92 1HB SER 92 2.151 7.005 -3.573 331 HG SER 92 HG SER 92 0.533 5.453 -2.705 332 H GLU 93 H GLU 93 -0.494 8.744 -0.166 333 HA GLU 93 HA GLU 93 -1.080 11.185 -1.599 334 HB2 GLU 93 2HB GLU 93 -1.291 10.732 1.394 335 HB3 GLU 93 1HB GLU 93 -2.245 11.838 0.405 336 HG2 GLU 93 2HG GLU 93 -3.166 9.873 -0.830 337 HG3 GLU 93 1HG GLU 93 -2.288 8.812 0.275 338 H SER 94 H SER 94 1.522 10.017 0.163 339 HA SER 94 HA SER 94 3.011 12.514 -0.062 340 HB2 SER 94 2HB SER 94 2.015 11.485 2.574 341 HB3 SER 94 1HB SER 94 3.637 12.170 2.505 342 HG SER 94 HG SER 94 2.746 14.062 2.409 343 H ASN 95 H ASN 95 3.070 9.796 -1.073 344 HA ASN 95 HA ASN 95 4.615 8.107 -1.506 345 HB2 ASN 95 2HB ASN 95 6.548 9.922 -0.036 346 HB3 ASN 95 1HB ASN 95 6.974 8.592 -1.110 347 HD21 ASN 95 1HD2 ASN 95 7.275 11.712 -1.290 348 HD22 ASN 95 2HD2 ASN 95 6.703 12.057 -2.850 349 H SER 96 H SER 96 2.968 7.616 0.666 350 HA SER 96 HA SER 96 4.848 6.427 2.680 351 HB2 SER 96 2HB SER 96 1.992 7.373 2.938 352 HB3 SER 96 1HB SER 96 2.746 6.326 4.133 353 HG SER 96 HG SER 96 3.953 7.932 4.782 354 H ARG 97 H ARG 97 4.600 4.237 3.198 355 HA ARG 97 HA ARG 97 2.646 2.708 1.539 356 HB2 ARG 97 2HB ARG 97 4.898 2.455 0.604 357 HB3 ARG 97 1HB ARG 97 5.526 2.009 2.187 358 HG2 ARG 97 2HG ARG 97 5.222 -0.031 0.952 359 HG3 ARG 97 1HG ARG 97 3.935 0.025 2.150 360 HD2 ARG 97 2HD ARG 97 2.331 0.722 0.513 361 HD3 ARG 97 1HD ARG 97 3.582 1.005 -0.691 362 HE ARG 97 HE ARG 97 3.508 -1.298 -1.180 363 HH11 ARG 97 1HH1 ARG 97 2.852 -3.428 -0.807 364 HH12 ARG 97 2HH1 ARG 97 2.077 -3.833 0.688 365 HH21 ARG 97 1HH2 ARG 97 2.235 -0.606 1.948 366 HH22 ARG 97 2HH2 ARG 97 1.727 -2.235 2.248 367 H ALA 98 H ALA 98 1.241 1.678 2.862 368 HA ALA 98 HA ALA 98 2.170 0.870 5.578 369 HB1 ALA 98 1HB ALA 98 -0.334 0.694 6.039 370 HB2 ALA 98 2HB ALA 98 -0.582 1.475 4.477 371 HB3 ALA 98 3HB ALA 98 0.277 2.324 5.763 372 H LEU 99 H LEU 99 2.386 -1.296 5.948 373 HA LEU 99 HA LEU 99 1.107 -3.153 3.983 374 HB2 LEU 99 2HB LEU 99 3.054 -4.716 4.756 375 HB3 LEU 99 1HB LEU 99 3.375 -3.448 3.580 376 HG LEU 99 HG LEU 99 4.094 -1.963 5.504 377 HD11 LEU 99 1HD1 LEU 99 3.390 -2.749 7.526 378 HD12 LEU 99 2HD1 LEU 99 4.877 -3.692 7.451 379 HD13 LEU 99 3HD1 LEU 99 3.348 -4.423 6.974 380 HD21 LEU 99 1HD2 LEU 99 5.458 -4.108 4.210 381 HD22 LEU 99 2HD2 LEU 99 6.017 -4.045 5.880 382 HD23 LEU 99 3HD2 LEU 99 6.143 -2.616 4.854 383 H LEU 100 H LEU 100 -0.001 -4.897 4.751 384 HA LEU 100 HA LEU 100 -0.134 -5.257 7.716 385 HB2 LEU 100 2HB LEU 100 -2.174 -4.119 6.805 386 HB3 LEU 100 1HB LEU 100 -2.443 -5.512 5.761 387 HG LEU 100 HG LEU 100 -2.465 -6.955 7.833 388 HD11 LEU 100 1HD1 LEU 100 -3.112 -5.459 9.915 389 HD12 LEU 100 2HD1 LEU 100 -2.165 -4.236 9.070 390 HD13 LEU 100 3HD1 LEU 100 -1.418 -5.764 9.535 391 HD21 LEU 100 1HD2 LEU 100 -4.519 -6.000 6.651 392 HD22 LEU 100 2HD2 LEU 100 -4.557 -4.770 7.914 393 HD23 LEU 100 3HD2 LEU 100 -4.754 -6.470 8.335 394 H HIS 101 H HIS 101 -0.190 -7.437 8.383 395 HA HIS 101 HA HIS 101 0.557 -9.372 6.280 396 HB2 HIS 101 2HB HIS 101 0.277 -10.031 9.205 397 HB3 HIS 101 1HB HIS 101 1.377 -10.727 8.014 398 HD1 HIS 101 1HD HIS 101 2.207 -7.801 6.896 399 HD2 HIS 101 2HD HIS 101 2.452 -9.127 10.843 400 HE1 HIS 101 1HE HIS 101 3.944 -6.348 8.032 401 HE2 HIS 101 2HE HIS 101 4.103 -7.149 10.435 402 H SER 102 H SER 102 -1.002 -10.554 5.314 403 HA SER 102 HA SER 102 -3.731 -10.598 6.137 404 HB2 SER 102 2HB SER 102 -2.280 -12.659 4.450 405 HB3 SER 102 1HB SER 102 -4.017 -12.378 4.488 406 HG SER 102 HG SER 102 -2.832 -10.056 4.048 407 H ASP 103 H ASP 103 -1.037 -12.806 6.755 408 HA ASP 103 HA ASP 103 -2.193 -13.728 9.215 409 HB2 ASP 103 2HB ASP 103 -3.579 -14.931 7.395 410 HB3 ASP 103 1HB ASP 103 -2.111 -15.858 7.079 411 H GLU 104 H GLU 104 -0.745 -15.288 10.285 412 HA GLU 104 HA GLU 104 2.013 -14.771 9.732 413 HB2 GLU 104 2HB GLU 104 0.702 -16.928 11.414 414 HB3 GLU 104 1HB GLU 104 2.424 -16.564 11.424 415 HG2 GLU 104 2HG GLU 104 1.910 -14.229 12.100 416 HG3 GLU 104 1HG GLU 104 0.197 -14.647 12.158 417 H HIS 105 H HIS 105 -0.146 -17.436 8.848 418 HA HIS 105 HA HIS 105 1.785 -19.287 7.937 419 HB2 HIS 105 2HB HIS 105 -0.978 -18.678 6.847 420 HB3 HIS 105 1HB HIS 105 -0.016 -20.081 6.376 421 HD1 HIS 105 1HD HIS 105 0.661 -21.743 8.398 422 HD2 HIS 105 2HD HIS 105 -2.378 -19.012 9.235 423 HE1 HIS 105 1HE HIS 105 -0.508 -22.585 10.484 424 HE2 HIS 105 2HE HIS 105 -2.359 -20.930 11.001 425 H GLN 106 H GLN 106 0.378 -16.472 6.298 426 HA GLN 106 HA GLN 106 1.603 -16.925 3.753 427 HB2 GLN 106 2HB GLN 106 -0.215 -15.244 4.218 428 HB3 GLN 106 1HB GLN 106 0.992 -14.240 5.024 429 HG2 GLN 106 2HG GLN 106 2.338 -14.250 2.913 430 HG3 GLN 106 1HG GLN 106 1.024 -15.122 2.123 431 HE21 GLN 106 1HE2 GLN 106 -0.304 -13.730 0.966 432 HE22 GLN 106 2HE2 GLN 106 -0.675 -12.135 1.411 433 H LEU 107 H LEU 107 2.695 -15.200 6.651 434 HA LEU 107 HA LEU 107 5.165 -14.246 5.541 435 HB2 LEU 107 2HB LEU 107 4.153 -13.404 7.670 436 HB3 LEU 107 1HB LEU 107 4.552 -14.943 8.429 437 HG LEU 107 HG LEU 107 6.956 -14.553 7.826 438 HD11 LEU 107 1HD1 LEU 107 7.176 -13.012 6.149 439 HD12 LEU 107 2HD1 LEU 107 7.216 -11.871 7.492 440 HD13 LEU 107 3HD1 LEU 107 5.713 -12.145 6.612 441 HD21 LEU 107 1HD2 LEU 107 6.558 -12.160 9.374 442 HD22 LEU 107 2HD2 LEU 107 7.105 -13.743 9.923 443 HD23 LEU 107 3HD2 LEU 107 5.381 -13.375 9.876 444 H LEU 108 H LEU 108 4.318 -17.169 7.390 445 HA LEU 108 HA LEU 108 6.951 -18.292 7.432 446 HB2 LEU 108 2HB LEU 108 4.974 -19.063 8.821 447 HB3 LEU 108 1HB LEU 108 4.324 -19.806 7.361 448 HG LEU 108 HG LEU 108 6.477 -21.089 7.137 449 HD11 LEU 108 1HD1 LEU 108 7.418 -21.097 9.757 450 HD12 LEU 108 2HD1 LEU 108 7.128 -19.388 9.427 451 HD13 LEU 108 3HD1 LEU 108 8.201 -20.317 8.382 452 HD21 LEU 108 1HD2 LEU 108 4.329 -21.905 8.297 453 HD22 LEU 108 2HD2 LEU 108 5.167 -21.587 9.815 454 HD23 LEU 108 3HD2 LEU 108 5.815 -22.773 8.682 455 H THR 109 H THR 109 4.346 -18.274 5.091 456 HA THR 109 HA THR 109 5.435 -20.283 3.339 457 HB THR 109 HB THR 109 3.537 -17.991 2.741 458 HG1 THR 109 1HG THR 109 3.287 -20.276 4.183 459 HG21 THR 109 1HG2 THR 109 3.099 -20.426 1.278 460 HG22 THR 109 2HG2 THR 109 4.765 -19.891 1.064 461 HG23 THR 109 3HG2 THR 109 3.433 -18.809 0.665 462 H ASN 110 H ASN 110 5.708 -16.756 3.553 463 HA ASN 110 HA ASN 110 7.939 -16.906 1.575 464 HB2 ASN 110 2HB ASN 110 6.038 -14.570 1.705 465 HB3 ASN 110 1HB ASN 110 7.164 -14.997 0.416 466 HD21 ASN 110 1HD2 ASN 110 4.136 -14.667 0.338 467 HD22 ASN 110 2HD2 ASN 110 3.561 -16.131 -0.301 468 HA PRO 111 HA PRO 111 9.037 -14.791 5.667 469 HB2 PRO 111 2HB PRO 111 11.522 -16.340 5.222 470 HB3 PRO 111 1HB PRO 111 10.544 -16.178 6.691 471 HG2 PRO 111 2HG PRO 111 10.586 -18.425 5.230 472 HG3 PRO 111 1HG PRO 111 9.146 -17.884 6.108 473 HD2 PRO 111 2HD PRO 111 9.710 -17.784 3.177 474 HD3 PRO 111 1HD PRO 111 8.168 -17.988 4.031 475 H LYS 112 H LYS 112 10.526 -15.137 2.527 476 HA LYS 112 HA LYS 112 12.565 -13.097 3.022 477 HB2 LYS 112 2HB LYS 112 11.644 -14.276 0.387 478 HB3 LYS 112 1HB LYS 112 13.143 -13.395 0.678 479 HG2 LYS 112 2HG LYS 112 12.402 -16.007 2.031 480 HG3 LYS 112 1HG LYS 112 13.461 -15.878 0.628 481 HD2 LYS 112 2HD LYS 112 14.854 -14.239 2.043 482 HD3 LYS 112 1HD LYS 112 13.935 -14.840 3.424 483 HE2 LYS 112 2HE LYS 112 15.537 -16.444 3.528 484 HE3 LYS 112 1HE LYS 112 14.646 -17.180 2.194 485 HZ1 LYS 112 1HZ LYS 112 16.085 -15.593 0.767 486 HZ2 LYS 112 2HZ LYS 112 16.757 -17.043 1.342 487 HZ3 LYS 112 3HZ LYS 112 17.108 -15.573 2.119 488 H CYS 113 H CYS 113 9.266 -12.957 2.491 489 HA CYS 113 HA CYS 113 9.090 -10.794 0.618 490 HB2 CYS 113 2HB CYS 113 7.243 -11.801 2.781 491 HB3 CYS 113 1HB CYS 113 6.836 -10.393 1.801 492 H SER 114 H SER 114 9.625 -10.876 4.115 493 HA SER 114 HA SER 114 10.289 -7.984 3.970 494 HB2 SER 114 2HB SER 114 8.266 -9.223 5.843 495 HB3 SER 114 1HB SER 114 9.038 -7.675 6.175 496 HG SER 114 HG SER 114 8.259 -7.546 3.694 497 H TYR 115 H TYR 115 12.108 -10.120 4.147 498 HA TYR 115 HA TYR 115 12.812 -10.544 6.954 499 HB2 TYR 115 2HB TYR 115 14.576 -11.902 6.154 500 HB3 TYR 115 1HB TYR 115 13.281 -12.146 4.984 501 HD1 TYR 115 1HD TYR 115 13.348 -10.974 2.780 502 HD2 TYR 115 2HD TYR 115 16.625 -10.806 5.550 503 HE1 TYR 115 1HE TYR 115 14.842 -10.192 0.962 504 HE2 TYR 115 2HE TYR 115 18.119 -10.019 3.733 505 HH TYR 115 HH TYR 115 17.271 -10.186 0.456 506 H ILE 116 H ILE 116 13.166 -7.998 4.815 507 HA ILE 116 HA ILE 116 15.555 -6.965 6.301 508 HB ILE 116 HB ILE 116 15.470 -5.437 4.045 509 HG12 ILE 116 2HG1 ILE 116 14.621 -8.230 3.222 510 HG13 ILE 116 1HG1 ILE 116 13.559 -6.825 3.201 511 HG21 ILE 116 1HG2 ILE 116 16.865 -8.007 4.745 512 HG22 ILE 116 2HG2 ILE 116 17.530 -6.378 4.629 513 HG23 ILE 116 3HG2 ILE 116 17.142 -7.278 3.165 514 HD11 ILE 116 1HD1 ILE 116 15.206 -5.692 1.676 515 HD12 ILE 116 2HD1 ILE 116 14.449 -7.119 0.971 516 HD13 ILE 116 3HD1 ILE 116 16.096 -7.211 1.592 517 HA PRO 117 HA PRO 117 13.549 -3.472 8.046 518 HB2 PRO 117 2HB PRO 117 14.965 -1.851 5.959 519 HB3 PRO 117 1HB PRO 117 14.810 -1.553 7.700 520 HG2 PRO 117 2HG PRO 117 17.023 -2.623 6.578 521 HG3 PRO 117 1HG PRO 117 16.502 -2.977 8.231 522 HD2 PRO 117 2HD PRO 117 16.558 -4.765 5.921 523 HD3 PRO 117 1HD PRO 117 16.267 -5.162 7.627 524 HA PRO 118 HA PRO 118 10.409 -3.170 4.687 525 HB2 PRO 118 2HB PRO 118 8.233 -3.639 6.238 526 HB3 PRO 118 1HB PRO 118 9.261 -4.945 5.621 527 HG2 PRO 118 2HG PRO 118 9.106 -3.782 8.338 528 HG3 PRO 118 1HG PRO 118 9.464 -5.440 7.832 529 HD2 PRO 118 2HD PRO 118 11.359 -3.524 8.619 530 HD3 PRO 118 1HD PRO 118 11.711 -5.036 7.755 531 H CYS 119 H CYS 119 8.983 -1.411 4.188 532 HA CYS 119 HA CYS 119 9.148 0.846 6.113 533 HB2 CYS 119 2HB CYS 119 8.139 2.027 3.950 534 HB3 CYS 119 1HB CYS 119 9.866 1.706 4.090 535 H LYS 120 H LYS 120 7.418 0.926 7.451 536 HA LYS 120 HA LYS 120 4.703 0.686 6.240 537 HB2 LYS 120 2HB LYS 120 3.920 -0.601 8.152 538 HB3 LYS 120 1HB LYS 120 5.313 -1.429 7.452 539 HG2 LYS 120 2HG LYS 120 6.771 -0.288 9.144 540 HG3 LYS 120 1HG LYS 120 5.315 0.366 9.897 541 HD2 LYS 120 2HD LYS 120 4.480 -2.027 10.097 542 HD3 LYS 120 1HD LYS 120 6.100 -2.543 9.625 543 HE2 LYS 120 2HE LYS 120 5.438 -0.786 12.007 544 HE3 LYS 120 1HE LYS 120 5.877 -2.493 12.082 545 HZ1 LYS 120 1HZ LYS 120 7.602 -0.388 10.898 546 HZ2 LYS 120 2HZ LYS 120 8.017 -2.008 11.197 547 HZ3 LYS 120 3HZ LYS 120 7.749 -0.944 12.494 548 H ARG 121 H ARG 121 3.173 2.139 7.150 549 HA ARG 121 HA ARG 121 4.219 4.508 8.351 550 HB2 ARG 121 2HB ARG 121 1.373 3.469 8.225 551 HB3 ARG 121 1HB ARG 121 1.825 5.097 8.723 552 HG2 ARG 121 2HG ARG 121 2.973 5.388 6.505 553 HG3 ARG 121 1HG ARG 121 2.304 3.831 6.016 554 HD2 ARG 121 2HD ARG 121 0.721 6.285 6.838 555 HD3 ARG 121 1HD ARG 121 0.853 5.624 5.210 556 HE ARG 121 HE ARG 121 -0.608 3.838 5.846 557 HH11 ARG 121 1HH1 ARG 121 -2.218 3.052 7.214 558 HH12 ARG 121 2HH1 ARG 121 -2.374 3.700 8.812 559 HH21 ARG 121 1HH2 ARG 121 0.263 5.919 8.466 560 HH22 ARG 121 2HH2 ARG 121 -0.973 5.320 9.518 561 H GLU 122 H GLU 122 2.590 1.669 9.736 562 HA GLU 122 HA GLU 122 3.806 2.248 12.330 563 HB2 GLU 122 2HB GLU 122 1.750 3.688 12.307 564 HB3 GLU 122 1HB GLU 122 0.782 2.228 12.109 565 HG2 GLU 122 2HG GLU 122 1.775 1.331 14.216 566 HG3 GLU 122 1HG GLU 122 2.623 2.860 14.432 567 H ASN 123 H ASN 123 3.662 0.417 13.756 568 HA ASN 123 HA ASN 123 3.661 -2.131 12.523 569 HB2 ASN 123 2HB ASN 123 2.978 -1.573 15.423 570 HB3 ASN 123 1HB ASN 123 3.685 -3.047 14.761 571 HD21 ASN 123 1HD2 ASN 123 4.353 0.399 15.387 572 HD22 ASN 123 2HD2 ASN 123 6.044 0.252 15.334 573 H GLN 124 H GLN 124 1.066 -0.247 13.940 574 HA GLN 124 HA GLN 124 -1.250 -0.596 14.007 575 HB2 GLN 124 2HB GLN 124 -0.520 -2.286 11.599 576 HB3 GLN 124 1HB GLN 124 -2.176 -1.913 12.072 577 HG2 GLN 124 2HG GLN 124 -1.731 0.484 11.846 578 HG3 GLN 124 1HG GLN 124 -0.046 0.152 11.449 579 HE21 GLN 124 1HE2 GLN 124 -1.720 1.548 9.606 580 HE22 GLN 124 2HE2 GLN 124 -1.982 0.557 8.254 581 H LYS 125 H LYS 125 -2.895 -2.683 13.771 582 HA LYS 125 HA LYS 125 -1.858 -4.560 15.817 583 HB2 LYS 125 2HB LYS 125 -4.663 -4.051 14.788 584 HB3 LYS 125 1HB LYS 125 -4.258 -5.226 16.040 585 HG2 LYS 125 2HG LYS 125 -3.249 -3.380 17.387 586 HG3 LYS 125 1HG LYS 125 -3.801 -2.232 16.165 587 HD2 LYS 125 2HD LYS 125 -6.139 -3.011 16.536 588 HD3 LYS 125 1HD LYS 125 -5.555 -4.063 17.827 589 HE2 LYS 125 2HE LYS 125 -5.683 -2.339 19.264 590 HE3 LYS 125 1HE LYS 125 -4.480 -1.476 18.307 591 HZ1 LYS 125 1HZ LYS 125 -7.382 -1.220 18.313 592 HZ2 LYS 125 2HZ LYS 125 -6.609 -1.072 16.808 593 HZ3 LYS 125 3HZ LYS 125 -6.189 -0.036 18.088 594 H ASN 126 H ASN 126 -1.841 -6.803 15.497 595 HA ASN 126 HA ASN 126 -2.399 -7.728 12.706 596 HB2 ASN 126 2HB ASN 126 -0.443 -9.080 12.733 597 HB3 ASN 126 1HB ASN 126 0.074 -7.519 13.371 598 HD21 ASN 126 1HD2 ASN 126 1.550 -9.836 14.045 599 HD22 ASN 126 2HD2 ASN 126 1.312 -10.190 15.689 600 H LEU 127 H LEU 127 -3.919 -7.832 15.378 601 HA LEU 127 HA LEU 127 -4.085 -10.787 15.680 602 HB2 LEU 127 2HB LEU 127 -5.256 -8.598 17.422 603 HB3 LEU 127 1HB LEU 127 -5.275 -10.328 17.775 604 HG LEU 127 HG LEU 127 -2.806 -8.587 17.498 605 HD11 LEU 127 1HD1 LEU 127 -4.540 -9.051 19.681 606 HD12 LEU 127 2HD1 LEU 127 -2.945 -8.298 19.727 607 HD13 LEU 127 3HD1 LEU 127 -3.108 -10.036 19.981 608 HD21 LEU 127 1HD2 LEU 127 -3.249 -11.545 17.674 609 HD22 LEU 127 2HD2 LEU 127 -1.856 -10.860 18.509 610 HD23 LEU 127 3HD2 LEU 127 -2.030 -10.650 16.768 611 H GLU 128 H GLU 128 -6.855 -9.302 16.823 612 HA GLU 128 HA GLU 128 -8.577 -10.612 14.975 613 HB2 GLU 128 2HB GLU 128 -9.120 -8.264 16.814 614 HB3 GLU 128 1HB GLU 128 -10.367 -9.190 15.978 615 HG2 GLU 128 2HG GLU 128 -9.563 -11.253 17.106 616 HG3 GLU 128 1HG GLU 128 -8.377 -10.288 17.985 617 H SER 129 H SER 129 -7.101 -7.431 14.930 618 HA SER 129 HA SER 129 -8.777 -6.156 13.036 619 HB2 SER 129 2HB SER 129 -5.768 -5.882 13.279 620 HB3 SER 129 1HB SER 129 -6.869 -4.713 12.553 621 HG SER 129 HG SER 129 -6.539 -5.449 15.251 622 H VAL 130 H VAL 130 -6.175 -8.502 12.593 623 HA VAL 130 HA VAL 130 -5.887 -8.239 9.771 624 HB VAL 130 HB VAL 130 -5.515 -10.615 11.607 625 HG11 VAL 130 1HG1 VAL 130 -4.962 -10.297 8.647 626 HG12 VAL 130 2HG1 VAL 130 -5.935 -11.542 9.433 627 HG13 VAL 130 3HG1 VAL 130 -4.183 -11.530 9.641 628 HG21 VAL 130 1HG2 VAL 130 -4.040 -8.284 11.225 629 HG22 VAL 130 2HG2 VAL 130 -3.210 -9.472 10.221 630 HG23 VAL 130 3HG2 VAL 130 -3.440 -9.779 11.941 631 H MET 131 H MET 131 -8.127 -10.237 11.705 632 HA MET 131 HA MET 131 -9.292 -11.658 9.539 633 HB2 MET 131 2HB MET 131 -9.716 -12.059 12.011 634 HB3 MET 131 1HB MET 131 -10.797 -10.663 11.972 635 HG2 MET 131 2HG MET 131 -11.595 -12.159 9.770 636 HG3 MET 131 1HG MET 131 -11.245 -13.382 10.992 637 HE1 MET 131 1HE MET 131 -13.224 -10.413 9.836 638 HE2 MET 131 2HE MET 131 -14.790 -10.714 10.584 639 HE3 MET 131 3HE MET 131 -14.089 -11.922 9.512 640 H ASN 132 H ASN 132 -10.024 -8.458 10.880 641 HA ASN 132 HA ASN 132 -12.333 -7.907 9.312 642 HB2 ASN 132 2HB ASN 132 -11.490 -6.514 11.235 643 HB3 ASN 132 1HB ASN 132 -10.223 -5.906 10.170 644 HD21 ASN 132 1HD2 ASN 132 -13.810 -6.169 10.370 645 HD22 ASN 132 2HD2 ASN 132 -14.110 -4.751 9.487 646 H TRP 133 H TRP 133 -8.872 -7.507 8.612 647 HA TRP 133 HA TRP 133 -9.148 -6.123 6.142 648 HB2 TRP 133 2HB TRP 133 -6.948 -6.214 6.947 649 HB3 TRP 133 1HB TRP 133 -7.042 -7.943 7.282 650 HD1 TRP 133 HD TRP 133 -6.490 -5.455 4.446 651 HE1 TRP 133 1HE TRP 133 -5.598 -6.722 2.387 652 HE3 TRP 133 3HE TRP 133 -7.012 -10.264 6.078 653 HZ2 TRP 133 2HZ TRP 133 -5.162 -9.421 1.543 654 HZ3 TRP 133 3HZ TRP 133 -6.352 -12.162 4.628 655 HH2 TRP 133 HH TRP 133 -5.429 -11.747 2.366 656 H GLN 134 H GLN 134 -8.973 -9.630 6.797 657 HA GLN 134 HA GLN 134 -9.192 -10.448 4.074 658 HB2 GLN 134 2HB GLN 134 -8.566 -11.936 6.000 659 HB3 GLN 134 1HB GLN 134 -10.254 -11.910 6.508 660 HG2 GLN 134 2HG GLN 134 -10.501 -12.556 3.856 661 HG3 GLN 134 1HG GLN 134 -8.987 -13.359 4.275 662 HE21 GLN 134 1HE2 GLN 134 -12.364 -12.999 5.459 663 HE22 GLN 134 2HE2 GLN 134 -12.443 -14.545 6.154 664 H GLN 135 H GLN 135 -11.701 -9.910 6.563 665 HA GLN 135 HA GLN 135 -13.894 -10.618 4.840 666 HB2 GLN 135 2HB GLN 135 -13.976 -10.484 7.363 667 HB3 GLN 135 1HB GLN 135 -13.966 -8.727 7.205 668 HG2 GLN 135 2HG GLN 135 -16.021 -8.828 5.851 669 HG3 GLN 135 1HG GLN 135 -16.031 -10.588 5.992 670 HE21 GLN 135 1HE2 GLN 135 -18.278 -9.365 6.977 671 HE22 GLN 135 2HE2 GLN 135 -18.265 -9.336 8.674 672 H TYR 136 H TYR 136 -12.509 -7.473 5.777 673 HA TYR 136 HA TYR 136 -14.264 -5.920 4.100 674 HB2 TYR 136 2HB TYR 136 -13.111 -4.837 5.925 675 HB3 TYR 136 1HB TYR 136 -11.540 -5.313 5.276 676 HD1 TYR 136 1HD TYR 136 -10.750 -4.384 3.105 677 HD2 TYR 136 2HD TYR 136 -14.286 -2.925 5.059 678 HE1 TYR 136 1HE TYR 136 -10.684 -2.345 1.703 679 HE2 TYR 136 2HE TYR 136 -14.221 -0.883 3.653 680 HH TYR 136 HH TYR 136 -13.272 -0.241 1.390 681 H TRP 137 H TRP 137 -11.001 -7.212 3.647 682 HA TRP 137 HA TRP 137 -10.495 -6.024 1.107 683 HB2 TRP 137 2HB TRP 137 -8.752 -7.041 2.537 684 HB3 TRP 137 1HB TRP 137 -9.468 -8.629 2.278 685 HD1 TRP 137 HD TRP 137 -7.120 -6.152 0.764 686 HE1 TRP 137 1HE TRP 137 -6.236 -7.055 -1.487 687 HE3 TRP 137 3HE TRP 137 -10.229 -10.122 0.157 688 HZ2 TRP 137 2HZ TRP 137 -6.785 -9.207 -3.304 689 HZ3 TRP 137 3HZ TRP 137 -10.038 -11.597 -1.830 690 HH2 TRP 137 HH TRP 137 -8.320 -11.144 -3.560 691 H LYS 138 H LYS 138 -11.929 -9.157 2.001 692 HA LYS 138 HA LYS 138 -12.309 -9.990 -0.756 693 HB2 LYS 138 2HB LYS 138 -12.166 -11.581 1.166 694 HB3 LYS 138 1HB LYS 138 -13.725 -10.982 1.734 695 HG2 LYS 138 2HG LYS 138 -14.743 -11.639 -0.435 696 HG3 LYS 138 1HG LYS 138 -13.189 -12.300 -0.945 697 HD2 LYS 138 2HD LYS 138 -13.237 -13.811 1.055 698 HD3 LYS 138 1HD LYS 138 -14.863 -13.222 1.408 699 HE2 LYS 138 2HE LYS 138 -15.706 -14.721 -0.040 700 HE3 LYS 138 1HE LYS 138 -14.805 -13.948 -1.344 701 HZ1 LYS 138 1HZ LYS 138 -13.167 -15.595 0.341 702 HZ2 LYS 138 2HZ LYS 138 -13.300 -15.569 -1.353 703 HZ3 LYS 138 3HZ LYS 138 -14.404 -16.468 -0.424 704 H ASP 139 H ASP 139 -14.269 -8.281 1.621 705 HA ASP 139 HA ASP 139 -16.798 -8.505 0.397 706 HB2 ASP 139 2HB ASP 139 -15.588 -6.285 2.047 707 HB3 ASP 139 1HB ASP 139 -17.275 -6.287 1.537 708 H GLU 140 H GLU 140 -14.199 -6.154 -0.349 709 HA GLU 140 HA GLU 140 -15.808 -5.416 -2.754 710 HB2 GLU 140 2HB GLU 140 -14.235 -3.510 -1.008 711 HB3 GLU 140 1HB GLU 140 -15.103 -3.080 -2.483 712 HG2 GLU 140 2HG GLU 140 -17.216 -3.886 -1.431 713 HG3 GLU 140 1HG GLU 140 -16.324 -4.188 0.062 714 H ILE 141 H ILE 141 -12.571 -4.683 -1.433 715 HA ILE 141 HA ILE 141 -11.185 -4.235 -3.752 716 HB ILE 141 HB ILE 141 -10.207 -5.964 -1.464 717 HG12 ILE 141 2HG1 ILE 141 -9.942 -2.982 -1.961 718 HG13 ILE 141 1HG1 ILE 141 -11.082 -3.708 -0.828 719 HG21 ILE 141 1HG2 ILE 141 -8.306 -6.153 -2.656 720 HG22 ILE 141 2HG2 ILE 141 -8.150 -4.397 -2.626 721 HG23 ILE 141 3HG2 ILE 141 -8.995 -5.184 -3.959 722 HD11 ILE 141 1HD1 ILE 141 -9.480 -4.018 0.731 723 HD12 ILE 141 2HD1 ILE 141 -8.461 -2.967 -0.253 724 HD13 ILE 141 3HD1 ILE 141 -8.373 -4.715 -0.450 725 H GLY 142 H GLY 142 -10.363 -7.419 -2.533 726 HA2 GLY 142 2HA GLY 142 -10.590 -9.542 -3.586 727 HA3 GLY 142 1HA GLY 142 -11.541 -8.777 -4.859 728 H SER 143 H SER 143 -8.535 -7.327 -3.955 729 HA SER 143 HA SER 143 -6.394 -7.386 -4.970 730 HB2 SER 143 2HB SER 143 -7.293 -9.199 -7.166 731 HB3 SER 143 1HB SER 143 -5.759 -9.155 -6.303 732 HG SER 143 HG SER 143 -6.559 -10.437 -4.822 733 H GLN 144 H GLN 144 -7.031 -5.177 -5.528 734 HA GLN 144 HA GLN 144 -6.980 -4.726 -8.395 735 HB2 GLN 144 2HB GLN 144 -9.151 -3.452 -8.449 736 HB3 GLN 144 1HB GLN 144 -9.349 -5.194 -8.242 737 HG2 GLN 144 2HG GLN 144 -10.214 -4.967 -6.156 738 HG3 GLN 144 1HG GLN 144 -9.047 -3.721 -5.712 739 HE21 GLN 144 1HE2 GLN 144 -9.497 -1.582 -7.228 740 HE22 GLN 144 2HE2 GLN 144 -11.119 -1.084 -7.211 741 HA PRO 145 HA PRO 145 -5.093 -1.516 -5.521 742 HB2 PRO 145 2HB PRO 145 -3.275 -1.340 -7.852 743 HB3 PRO 145 1HB PRO 145 -2.889 -1.486 -6.133 744 HG2 PRO 145 2HG PRO 145 -2.633 -3.512 -7.924 745 HG3 PRO 145 1HG PRO 145 -2.890 -3.743 -6.193 746 HD2 PRO 145 2HD PRO 145 -4.756 -4.210 -8.423 747 HD3 PRO 145 1HD PRO 145 -4.806 -4.838 -6.766 748 H PHE 146 H PHE 146 -5.137 0.829 -5.889 749 HA PHE 146 HA PHE 146 -6.094 1.668 -8.554 750 HB2 PHE 146 2HB PHE 146 -7.858 3.082 -7.522 751 HB3 PHE 146 1HB PHE 146 -8.146 1.359 -7.315 752 HD1 PHE 146 1HD PHE 146 -8.169 4.454 -5.718 753 HD2 PHE 146 2HD PHE 146 -7.006 0.371 -5.046 754 HE1 PHE 146 1HE PHE 146 -8.333 4.810 -3.274 755 HE2 PHE 146 2HE PHE 146 -7.159 0.740 -2.605 756 HZ PHE 146 HZ PHE 146 -7.824 2.952 -1.714 757 H THR 147 H THR 147 -5.740 3.874 -9.044 758 HA THR 147 HA THR 147 -3.754 5.189 -7.250 759 HB THR 147 HB THR 147 -2.801 6.207 -9.241 760 HG1 THR 147 1HG THR 147 -3.903 6.297 -11.010 761 HG21 THR 147 1HG2 THR 147 -3.209 3.233 -9.247 762 HG22 THR 147 2HG2 THR 147 -1.756 4.156 -8.857 763 HG23 THR 147 3HG2 THR 147 -2.279 4.002 -10.535 764 H CYS 148 H CYS 148 -3.882 7.518 -7.181 765 HA CYS 148 HA CYS 148 -6.438 8.677 -8.095 766 HB2 CYS 148 2HB CYS 148 -5.661 9.510 -5.377 767 HB3 CYS 148 1HB CYS 148 -7.243 9.051 -5.997 768 H TYR 149 H TYR 149 -6.353 11.059 -8.098 769 HA TYR 149 HA TYR 149 -3.641 12.239 -7.765 770 HB2 TYR 149 2HB TYR 149 -5.257 12.456 -10.324 771 HB3 TYR 149 1HB TYR 149 -3.768 13.330 -9.982 772 HD1 TYR 149 1HD TYR 149 -5.224 10.125 -10.959 773 HD2 TYR 149 2HD TYR 149 -1.627 12.100 -9.697 774 HE1 TYR 149 1HE TYR 149 -3.887 8.191 -11.746 775 HE2 TYR 149 2HE TYR 149 -0.287 10.167 -10.485 776 HH TYR 149 HH TYR 149 -0.657 8.290 -12.286 777 H PHE 150 H PHE 150 -3.826 14.290 -6.873 778 HA PHE 150 HA PHE 150 -6.411 15.677 -7.219 779 HB2 PHE 150 2HB PHE 150 -7.107 15.422 -5.090 780 HB3 PHE 150 1HB PHE 150 -5.858 14.191 -4.929 781 HD1 PHE 150 1HD PHE 150 -6.987 17.424 -3.883 782 HD2 PHE 150 2HD PHE 150 -3.499 14.953 -4.247 783 HE1 PHE 150 1HE PHE 150 -5.819 18.856 -2.236 784 HE2 PHE 150 2HE PHE 150 -2.312 16.380 -2.605 785 HZ PHE 150 HZ PHE 150 -3.472 18.331 -1.590 786 H ASN 151 H ASN 151 -6.325 17.935 -6.886 787 HA ASN 151 HA ASN 151 -3.658 19.082 -6.273 788 HB2 ASN 151 2HB ASN 151 -3.583 20.372 -8.301 789 HB3 ASN 151 1HB ASN 151 -3.825 18.688 -8.747 790 HD21 ASN 151 1HD2 ASN 151 -4.612 20.968 -10.406 791 HD22 ASN 151 2HD2 ASN 151 -6.302 20.911 -10.558 792 H GLN 152 H GLN 152 -4.172 20.409 -4.619 793 HA GLN 152 HA GLN 152 -6.688 21.959 -4.657 794 HB2 GLN 152 2HB GLN 152 -6.244 21.040 -2.514 795 HB3 GLN 152 1HB GLN 152 -4.545 21.503 -2.575 796 HG2 GLN 152 2HG GLN 152 -5.093 23.833 -2.336 797 HG3 GLN 152 1HG GLN 152 -6.810 23.515 -2.573 798 HE21 GLN 152 1HE2 GLN 152 -6.177 24.841 -0.246 799 HE22 GLN 152 2HE2 GLN 152 -6.292 23.802 1.093 800 H HIS 153 H HIS 153 -3.380 22.326 -5.515 801 HA HIS 153 HA HIS 153 -2.853 25.000 -4.882 802 HB2 HIS 153 2HB HIS 153 -1.250 25.004 -6.649 803 HB3 HIS 153 1HB HIS 153 -1.288 23.362 -6.022 804 HD1 HIS 153 1HD HIS 153 -2.986 25.359 -8.807 805 HD2 HIS 153 2HD HIS 153 -1.642 21.494 -8.000 806 HE1 HIS 153 1HE HIS 153 -3.334 24.020 -10.933 807 HE2 HIS 153 2HE HIS 153 -2.518 21.666 -10.453 808 H GLN 154 H GLN 154 -5.131 23.719 -7.195 809 HA GLN 154 HA GLN 154 -5.451 26.156 -8.720 810 HB2 GLN 154 2HB GLN 154 -7.392 23.878 -8.192 811 HB3 GLN 154 1HB GLN 154 -7.620 25.142 -9.398 812 HG2 GLN 154 2HG GLN 154 -5.547 24.444 -10.534 813 HG3 GLN 154 1HG GLN 154 -5.316 23.179 -9.327 814 HE21 GLN 154 1HE2 GLN 154 -5.603 22.492 -12.076 815 HE22 GLN 154 2HE2 GLN 154 -7.086 21.692 -12.286 816 H ARG 155 H ARG 155 -7.760 24.669 -6.450 817 HA ARG 155 HA ARG 155 -7.901 27.085 -4.848 818 HB2 ARG 155 2HB ARG 155 -10.631 26.540 -5.792 819 HB3 ARG 155 1HB ARG 155 -9.800 28.067 -5.556 820 HG2 ARG 155 2HG ARG 155 -8.775 27.978 -7.704 821 HG3 ARG 155 1HG ARG 155 -9.214 26.291 -7.942 822 HD2 ARG 155 2HD ARG 155 -11.087 28.663 -7.833 823 HD3 ARG 155 1HD ARG 155 -10.742 27.640 -9.227 824 HE ARG 155 HE ARG 155 -12.492 26.945 -6.965 825 HH11 ARG 155 1HH1 ARG 155 -13.677 25.047 -7.267 826 HH12 ARG 155 2HH1 ARG 155 -13.267 23.981 -8.569 827 HH21 ARG 155 1HH2 ARG 155 -10.655 25.954 -9.712 828 HH22 ARG 155 2HH2 ARG 155 -11.556 24.494 -9.953 829 HA PRO 156 HA PRO 156 -10.306 23.628 -2.767 830 HB2 PRO 156 2HB PRO 156 -11.807 21.910 -4.158 831 HB3 PRO 156 1HB PRO 156 -12.241 23.628 -4.089 832 HG2 PRO 156 2HG PRO 156 -11.163 22.070 -6.333 833 HG3 PRO 156 1HG PRO 156 -12.048 23.603 -6.346 834 HD2 PRO 156 2HD PRO 156 -9.145 23.169 -6.425 835 HD3 PRO 156 1HD PRO 156 -10.051 24.664 -6.701 836 H ASP 157 H ASP 157 -10.475 21.075 -5.042 837 HA ASP 157 HA ASP 157 -7.895 19.899 -4.785 838 HB2 ASP 157 2HB ASP 157 -9.033 18.036 -3.143 839 HB3 ASP 157 1HB ASP 157 -8.013 19.356 -2.567 840 H ASP 158 H ASP 158 -8.701 19.574 -7.048 841 HA ASP 158 HA ASP 158 -10.994 17.952 -7.631 842 HB2 ASP 158 2HB ASP 158 -8.392 18.228 -9.177 843 HB3 ASP 158 1HB ASP 158 -9.863 17.489 -9.806 844 H VAL 159 H VAL 159 -11.021 15.594 -8.127 845 HA VAL 159 HA VAL 159 -8.673 14.135 -6.994 846 HB VAL 159 HB VAL 159 -11.558 13.518 -6.316 847 HG11 VAL 159 1HG1 VAL 159 -8.892 12.312 -5.580 848 HG12 VAL 159 2HG1 VAL 159 -10.335 11.500 -6.192 849 HG13 VAL 159 3HG1 VAL 159 -10.301 12.115 -4.539 850 HG21 VAL 159 1HG2 VAL 159 -10.802 14.260 -4.005 851 HG22 VAL 159 2HG2 VAL 159 -10.953 15.558 -5.188 852 HG23 VAL 159 3HG2 VAL 159 -9.361 14.923 -4.774 853 H LEU 160 H LEU 160 -8.270 12.128 -7.879 854 HA LEU 160 HA LEU 160 -10.053 11.225 -10.107 855 HB2 LEU 160 2HB LEU 160 -7.023 11.110 -9.976 856 HB3 LEU 160 1HB LEU 160 -7.997 10.416 -11.265 857 HG LEU 160 HG LEU 160 -7.801 13.356 -10.527 858 HD11 LEU 160 1HD1 LEU 160 -7.284 12.680 -13.285 859 HD12 LEU 160 2HD1 LEU 160 -6.253 11.711 -12.236 860 HD13 LEU 160 3HD1 LEU 160 -6.217 13.470 -12.126 861 HD21 LEU 160 1HD2 LEU 160 -9.683 11.815 -12.283 862 HD22 LEU 160 2HD2 LEU 160 -9.175 13.422 -12.799 863 HD23 LEU 160 3HD2 LEU 160 -10.005 13.213 -11.258 864 H LEU 161 H LEU 161 -10.250 8.896 -10.275 865 HA LEU 161 HA LEU 161 -8.950 7.350 -8.085 866 HB2 LEU 161 2HB LEU 161 -11.252 8.118 -7.382 867 HB3 LEU 161 1HB LEU 161 -11.903 7.137 -8.695 868 HG LEU 161 HG LEU 161 -10.311 5.295 -7.564 869 HD11 LEU 161 1HD1 LEU 161 -9.611 7.018 -5.830 870 HD12 LEU 161 2HD1 LEU 161 -10.228 5.501 -5.178 871 HD13 LEU 161 3HD1 LEU 161 -11.257 6.934 -5.202 872 HD21 LEU 161 1HD2 LEU 161 -12.363 4.613 -6.227 873 HD22 LEU 161 2HD2 LEU 161 -12.646 4.911 -7.941 874 HD23 LEU 161 3HD2 LEU 161 -13.104 6.127 -6.748 875 H HIS 162 H HIS 162 -7.846 6.850 -10.369 876 HA HIS 162 HA HIS 162 -9.293 5.049 -12.127 877 HB2 HIS 162 2HB HIS 162 -6.313 5.504 -11.749 878 HB3 HIS 162 1HB HIS 162 -7.022 4.536 -13.043 879 HD1 HIS 162 1HD HIS 162 -5.411 7.062 -13.764 880 HD2 HIS 162 2HD HIS 162 -9.543 7.059 -13.188 881 HE1 HIS 162 1HE HIS 162 -6.309 9.083 -15.001 882 HE2 HIS 162 2HE HIS 162 -8.823 9.092 -14.656 883 H ARG 163 H ARG 163 -9.133 2.725 -12.170 884 HA ARG 163 HA ARG 163 -8.113 1.544 -9.610 885 HB2 ARG 163 2HB ARG 163 -10.425 0.669 -11.361 886 HB3 ARG 163 1HB ARG 163 -9.848 -0.213 -9.947 887 HG2 ARG 163 2HG ARG 163 -10.268 1.819 -8.556 888 HG3 ARG 163 1HG ARG 163 -10.951 2.610 -9.977 889 HD2 ARG 163 2HD ARG 163 -12.591 0.709 -10.158 890 HD3 ARG 163 1HD ARG 163 -11.983 0.109 -8.615 891 HE ARG 163 HE ARG 163 -12.855 2.904 -8.542 892 HH11 ARG 163 1HH1 ARG 163 -14.643 3.304 -7.220 893 HH12 ARG 163 2HH1 ARG 163 -15.596 1.975 -6.647 894 HH21 ARG 163 1HH2 ARG 163 -13.674 -0.432 -8.239 895 HH22 ARG 163 2HH2 ARG 163 -15.047 -0.140 -7.225 896 H THR 164 H THR 164 -7.226 -0.611 -9.726 897 HA THR 164 HA THR 164 -5.608 -1.060 -12.112 898 HB THR 164 HB THR 164 -5.933 -2.621 -9.546 899 HG1 THR 164 1HG THR 164 -3.527 -1.746 -9.823 900 HG21 THR 164 1HG2 THR 164 -4.646 -3.306 -12.093 901 HG22 THR 164 2HG2 THR 164 -5.059 -4.342 -10.728 902 HG23 THR 164 3HG2 THR 164 -3.561 -3.413 -10.707 903 H HIS 165 H HIS 165 -5.898 -2.659 -13.657 904 HA HIS 165 HA HIS 165 -8.423 -4.253 -13.440 905 HB2 HIS 165 2HB HIS 165 -6.974 -3.224 -15.899 906 HB3 HIS 165 1HB HIS 165 -8.396 -4.266 -15.934 907 HD1 HIS 165 1HD HIS 165 -7.310 -0.754 -15.210 908 HD2 HIS 165 2HD HIS 165 -10.835 -2.984 -15.155 909 HE1 HIS 165 1HE HIS 165 -9.208 0.909 -14.969 910 HE2 HIS 165 2HE HIS 165 -11.357 -0.438 -14.936 911 H ASP 166 H ASP 166 -8.258 -6.467 -13.708 912 HA ASP 166 HA ASP 166 -5.595 -7.640 -13.586 913 HB2 ASP 166 2HB ASP 166 -8.352 -8.881 -13.795 914 HB3 ASP 166 1HB ASP 166 -6.866 -9.806 -13.585 Start of MODEL 20 1 H1 GLN 45 1HT GLN 45 5.854 16.625 -5.903 2 H2 GLN 45 2HT GLN 45 5.721 17.177 -4.302 3 H3 GLN 45 3HT GLN 45 4.951 18.019 -5.562 4 HA GLN 45 HA GLN 45 3.242 16.560 -5.720 5 HB2 GLN 45 2HB GLN 45 5.174 14.483 -4.647 6 HB3 GLN 45 1HB GLN 45 3.490 14.159 -5.060 7 HG2 GLN 45 2HG GLN 45 3.901 14.843 -7.379 8 HG3 GLN 45 1HG GLN 45 5.574 15.236 -6.983 9 HE21 GLN 45 1HE2 GLN 45 4.987 13.273 -8.965 10 HE22 GLN 45 2HE2 GLN 45 5.458 11.751 -8.379 11 H ASP 46 H ASP 46 5.231 17.116 -2.961 12 HA ASP 46 HA ASP 46 3.099 16.345 -1.067 13 HB2 ASP 46 2HB ASP 46 5.871 17.504 -0.646 14 HB3 ASP 46 1HB ASP 46 4.759 17.083 0.660 15 H LEU 47 H LEU 47 5.154 19.235 -1.015 16 HA LEU 47 HA LEU 47 3.091 20.920 0.018 17 HB2 LEU 47 2HB LEU 47 5.561 21.721 -1.554 18 HB3 LEU 47 1HB LEU 47 4.617 22.768 -0.493 19 HG LEU 47 HG LEU 47 6.118 20.275 0.359 20 HD11 LEU 47 1HD1 LEU 47 7.797 21.641 1.119 21 HD12 LEU 47 2HD1 LEU 47 6.699 22.981 1.453 22 HD13 LEU 47 3HD1 LEU 47 7.228 22.664 -0.199 23 HD21 LEU 47 1HD2 LEU 47 4.158 22.094 1.707 24 HD22 LEU 47 2HD2 LEU 47 5.501 21.464 2.661 25 HD23 LEU 47 3HD2 LEU 47 4.374 20.352 1.885 26 H GLN 48 H GLN 48 4.057 20.041 -3.235 27 HA GLN 48 HA GLN 48 2.258 22.054 -4.428 28 HB2 GLN 48 2HB GLN 48 4.441 21.599 -5.495 29 HB3 GLN 48 1HB GLN 48 3.969 19.916 -5.733 30 HG2 GLN 48 2HG GLN 48 3.587 21.212 -7.788 31 HG3 GLN 48 1HG GLN 48 2.052 20.659 -7.115 32 HE21 GLN 48 1HE2 GLN 48 0.663 22.256 -6.083 33 HE22 GLN 48 2HE2 GLN 48 0.906 23.920 -6.315 34 H ALA 49 H ALA 49 0.184 21.600 -4.927 35 HA ALA 49 HA ALA 49 -0.858 18.888 -4.528 36 HB1 ALA 49 1HB ALA 49 -3.047 19.985 -5.083 37 HB2 ALA 49 2HB ALA 49 -2.171 21.489 -5.361 38 HB3 ALA 49 3HB ALA 49 -2.193 20.769 -3.754 39 H THR 50 H THR 50 -1.098 17.420 -6.164 40 HA THR 50 HA THR 50 -1.881 18.116 -8.837 41 HB THR 50 HB THR 50 1.009 17.249 -8.546 42 HG1 THR 50 1HG THR 50 0.092 19.738 -9.492 43 HG21 THR 50 1HG2 THR 50 -0.031 18.422 -11.053 44 HG22 THR 50 2HG2 THR 50 -0.679 16.834 -10.645 45 HG23 THR 50 3HG2 THR 50 1.062 17.059 -10.815 46 H GLU 51 H GLU 51 0.455 15.686 -7.680 47 HA GLU 51 HA GLU 51 -1.478 13.598 -8.563 48 HB2 GLU 51 2HB GLU 51 1.522 13.427 -8.231 49 HB3 GLU 51 1HB GLU 51 0.476 12.158 -8.868 50 HG2 GLU 51 2HG GLU 51 -0.225 13.707 -10.697 51 HG3 GLU 51 1HG GLU 51 0.923 14.897 -10.088 52 H ALA 52 H ALA 52 -2.104 12.024 -7.198 53 HA ALA 52 HA ALA 52 -0.702 11.510 -4.663 54 HB1 ALA 52 1HB ALA 52 -2.135 13.018 -3.631 55 HB2 ALA 52 2HB ALA 52 -3.186 11.599 -3.642 56 HB3 ALA 52 3HB ALA 52 -3.372 12.843 -4.877 57 H ASN 53 H ASN 53 -0.484 9.276 -5.004 58 HA ASN 53 HA ASN 53 -2.809 7.918 -6.252 59 HB2 ASN 53 2HB ASN 53 0.046 7.012 -5.910 60 HB3 ASN 53 1HB ASN 53 -1.235 5.997 -6.570 61 HD21 ASN 53 1HD2 ASN 53 -2.642 8.082 -8.034 62 HD22 ASN 53 2HD2 ASN 53 -1.644 8.564 -9.319 63 H CYS 54 H CYS 54 -3.956 6.334 -5.291 64 HA CYS 54 HA CYS 54 -3.153 5.547 -2.524 65 HB2 CYS 54 2HB CYS 54 -6.033 5.660 -2.949 66 HB3 CYS 54 1HB CYS 54 -5.079 6.404 -1.672 67 H THR 55 H THR 55 -2.515 3.452 -3.123 68 HA THR 55 HA THR 55 -4.598 1.883 -4.574 69 HB THR 55 HB THR 55 -3.091 1.341 -6.149 70 HG1 THR 55 1HG THR 55 -1.333 0.796 -3.989 71 HG21 THR 55 1HG2 THR 55 -2.343 3.709 -5.643 72 HG22 THR 55 2HG2 THR 55 -1.095 2.683 -6.346 73 HG23 THR 55 3HG2 THR 55 -1.088 3.019 -4.616 74 H VAL 56 H VAL 56 -4.787 -0.304 -4.131 75 HA VAL 56 HA VAL 56 -3.729 -1.112 -1.471 76 HB VAL 56 HB VAL 56 -6.109 -2.064 -3.088 77 HG11 VAL 56 1HG1 VAL 56 -5.647 -4.103 -2.198 78 HG12 VAL 56 2HG1 VAL 56 -6.211 -3.395 -0.684 79 HG13 VAL 56 3HG1 VAL 56 -4.488 -3.439 -1.047 80 HG21 VAL 56 1HG2 VAL 56 -7.314 -0.789 -1.666 81 HG22 VAL 56 2HG2 VAL 56 -5.789 -0.098 -1.107 82 HG23 VAL 56 3HG2 VAL 56 -6.492 -1.479 -0.268 83 H LEU 57 H LEU 57 -1.990 -2.409 -1.627 84 HA LEU 57 HA LEU 57 -0.938 -3.400 -4.033 85 HB2 LEU 57 2HB LEU 57 0.139 -3.275 -1.686 86 HB3 LEU 57 1HB LEU 57 -0.593 -4.855 -1.418 87 HG LEU 57 HG LEU 57 0.515 -5.600 -3.591 88 HD11 LEU 57 1HD1 LEU 57 2.695 -3.762 -3.481 89 HD12 LEU 57 2HD1 LEU 57 1.212 -2.819 -3.624 90 HD13 LEU 57 3HD1 LEU 57 1.589 -4.055 -4.824 91 HD21 LEU 57 1HD2 LEU 57 2.906 -5.280 -2.274 92 HD22 LEU 57 2HD2 LEU 57 1.729 -6.543 -1.920 93 HD23 LEU 57 3HD2 LEU 57 1.740 -5.057 -0.970 94 H SER 58 H SER 58 -0.829 -5.658 -4.800 95 HA SER 58 HA SER 58 -3.469 -6.963 -4.515 96 HB2 SER 58 2HB SER 58 -2.892 -8.181 -6.517 97 HB3 SER 58 1HB SER 58 -2.442 -6.499 -6.792 98 HG SER 58 HG SER 58 -0.305 -7.076 -6.190 99 H VAL 59 H VAL 59 -3.530 -9.285 -4.008 100 HA VAL 59 HA VAL 59 -1.302 -9.999 -2.191 101 HB VAL 59 HB VAL 59 -3.946 -11.421 -2.598 102 HG11 VAL 59 1HG1 VAL 59 -1.971 -11.440 -0.296 103 HG12 VAL 59 2HG1 VAL 59 -2.121 -12.718 -1.503 104 HG13 VAL 59 3HG1 VAL 59 -3.457 -12.382 -0.402 105 HG21 VAL 59 1HG2 VAL 59 -4.786 -10.142 -0.728 106 HG22 VAL 59 2HG2 VAL 59 -4.140 -8.992 -1.898 107 HG23 VAL 59 3HG2 VAL 59 -3.208 -9.401 -0.458 108 H GLN 60 H GLN 60 0.242 -11.378 -2.846 109 HA GLN 60 HA GLN 60 -0.431 -13.499 -4.807 110 HB2 GLN 60 2HB GLN 60 1.909 -11.587 -5.086 111 HB3 GLN 60 1HB GLN 60 1.600 -12.983 -6.120 112 HG2 GLN 60 2HG GLN 60 -0.556 -12.010 -6.807 113 HG3 GLN 60 1HG GLN 60 -0.265 -10.618 -5.765 114 HE21 GLN 60 1HE2 GLN 60 -0.597 -9.824 -8.284 115 HE22 GLN 60 2HE2 GLN 60 0.871 -9.512 -9.078 116 H GLN 61 H GLN 61 1.127 -15.281 -4.739 117 HA GLN 61 HA GLN 61 1.974 -15.992 -2.136 118 HB2 GLN 61 2HB GLN 61 3.157 -16.971 -4.745 119 HB3 GLN 61 1HB GLN 61 3.202 -17.811 -3.199 120 HG2 GLN 61 2HG GLN 61 0.729 -17.143 -4.820 121 HG3 GLN 61 1HG GLN 61 1.421 -18.747 -4.577 122 HE21 GLN 61 1HE2 GLN 61 -0.948 -16.677 -3.413 123 HE22 GLN 61 2HE2 GLN 61 -1.137 -17.341 -1.867 124 H ILE 62 H ILE 62 4.710 -16.460 -4.032 125 HA ILE 62 HA ILE 62 6.061 -14.034 -2.934 126 HB ILE 62 HB ILE 62 6.388 -16.343 -1.659 127 HG12 ILE 62 2HG1 ILE 62 8.779 -14.653 -2.460 128 HG13 ILE 62 1HG1 ILE 62 7.589 -14.161 -1.255 129 HG21 ILE 62 1HG2 ILE 62 8.058 -17.753 -2.558 130 HG22 ILE 62 2HG2 ILE 62 8.573 -16.537 -3.727 131 HG23 ILE 62 3HG2 ILE 62 7.036 -17.374 -3.946 132 HD11 ILE 62 1HD1 ILE 62 8.459 -16.845 -0.690 133 HD12 ILE 62 2HD1 ILE 62 8.603 -15.404 0.316 134 HD13 ILE 62 3HD1 ILE 62 9.866 -15.795 -0.851 135 H GLY 63 H GLY 63 8.282 -13.775 -4.022 136 HA2 GLY 63 2HA GLY 63 9.701 -14.091 -5.950 137 HA3 GLY 63 1HA GLY 63 8.395 -14.986 -6.730 138 H GLU 64 H GLU 64 7.044 -12.321 -5.307 139 HA GLU 64 HA GLU 64 7.030 -10.877 -7.903 140 HB2 GLU 64 2HB GLU 64 4.843 -11.507 -6.860 141 HB3 GLU 64 1HB GLU 64 5.248 -10.483 -5.481 142 HG2 GLU 64 2HG GLU 64 3.870 -9.174 -6.967 143 HG3 GLU 64 1HG GLU 64 5.517 -8.562 -7.096 144 H VAL 65 H VAL 65 7.727 -8.724 -8.025 145 HA VAL 65 HA VAL 65 9.203 -7.748 -5.630 146 HB VAL 65 HB VAL 65 10.461 -6.346 -7.209 147 HG11 VAL 65 1HG1 VAL 65 11.485 -8.448 -6.932 148 HG12 VAL 65 2HG1 VAL 65 11.339 -8.304 -8.684 149 HG13 VAL 65 3HG1 VAL 65 10.191 -9.293 -7.782 150 HG21 VAL 65 1HG2 VAL 65 9.212 -5.733 -9.022 151 HG22 VAL 65 2HG2 VAL 65 8.265 -7.220 -8.995 152 HG23 VAL 65 3HG2 VAL 65 9.869 -7.209 -9.729 153 H PHE 66 H PHE 66 8.595 -5.856 -4.666 154 HA PHE 66 HA PHE 66 6.455 -4.255 -5.998 155 HB2 PHE 66 2HB PHE 66 6.800 -4.901 -3.061 156 HB3 PHE 66 1HB PHE 66 5.608 -3.768 -3.702 157 HD1 PHE 66 1HD PHE 66 3.835 -4.585 -5.277 158 HD2 PHE 66 2HD PHE 66 6.457 -7.269 -3.188 159 HE1 PHE 66 1HE PHE 66 2.289 -6.462 -5.750 160 HE2 PHE 66 2HE PHE 66 4.909 -9.146 -3.659 161 HZ PHE 66 HZ PHE 66 2.824 -8.745 -4.941 162 H GLU 67 H GLU 67 6.472 -1.958 -5.440 163 HA GLU 67 HA GLU 67 9.224 -1.021 -4.762 164 HB2 GLU 67 2HB GLU 67 8.756 0.951 -6.063 165 HB3 GLU 67 1HB GLU 67 8.266 -0.441 -7.029 166 HG2 GLU 67 2HG GLU 67 5.921 -0.124 -6.180 167 HG3 GLU 67 1HG GLU 67 6.455 1.365 -5.402 168 H CYS 68 H CYS 68 9.510 0.435 -3.104 169 HA CYS 68 HA CYS 68 7.091 1.093 -1.480 170 HB2 CYS 68 2HB CYS 68 9.718 0.095 -0.805 171 HB3 CYS 68 1HB CYS 68 9.458 1.654 -0.019 172 H THR 69 H THR 69 7.072 3.308 -0.537 173 HA THR 69 HA THR 69 8.614 5.228 -2.233 174 HB THR 69 HB THR 69 6.736 6.682 -2.270 175 HG1 THR 69 1HG THR 69 4.964 6.348 -0.943 176 HG21 THR 69 1HG2 THR 69 5.138 4.200 -2.402 177 HG22 THR 69 2HG2 THR 69 6.612 4.194 -3.371 178 HG23 THR 69 3HG2 THR 69 5.392 5.443 -3.626 179 H PHE 70 H PHE 70 9.379 7.124 -1.221 180 HA PHE 70 HA PHE 70 8.977 7.445 1.678 181 HB2 PHE 70 2HB PHE 70 11.372 7.478 2.185 182 HB3 PHE 70 1HB PHE 70 10.917 5.908 1.523 183 HD1 PHE 70 1HD PHE 70 11.535 5.285 -0.783 184 HD2 PHE 70 2HD PHE 70 12.776 9.014 0.948 185 HE1 PHE 70 1HE PHE 70 13.214 5.562 -2.588 186 HE2 PHE 70 2HE PHE 70 14.454 9.292 -0.857 187 HZ PHE 70 HZ PHE 70 14.674 7.565 -2.624 188 H THR 71 H THR 71 10.014 9.529 2.418 189 HA THR 71 HA THR 71 10.310 11.458 0.162 190 HB THR 71 HB THR 71 9.012 12.337 2.709 191 HG1 THR 71 1HG THR 71 8.043 10.305 1.834 192 HG21 THR 71 1HG2 THR 71 8.059 13.038 -0.023 193 HG22 THR 71 2HG2 THR 71 9.653 13.631 0.447 194 HG23 THR 71 3HG2 THR 71 8.234 14.061 1.403 195 H CYS 72 H CYS 72 11.889 13.014 0.473 196 HA CYS 72 HA CYS 72 13.328 12.985 3.092 197 HB2 CYS 72 2HB CYS 72 15.291 12.453 2.101 198 HB3 CYS 72 1HB CYS 72 14.333 11.979 0.699 199 H GLY 73 H GLY 73 14.749 15.040 3.269 200 HA2 GLY 73 2HA GLY 73 13.031 17.324 2.599 201 HA3 GLY 73 1HA GLY 73 14.493 17.382 3.586 202 H ALA 74 H ALA 74 14.401 19.395 1.877 203 HA ALA 74 HA ALA 74 15.776 20.401 0.239 204 HB1 ALA 74 1HB ALA 74 16.909 17.806 -0.672 205 HB2 ALA 74 2HB ALA 74 17.289 18.293 0.980 206 HB3 ALA 74 3HB ALA 74 17.721 19.341 -0.372 207 H ASP 75 H ASP 75 13.129 18.974 -0.150 208 HA ASP 75 HA ASP 75 11.662 18.508 -1.913 209 HB2 ASP 75 2HB ASP 75 13.746 20.110 -3.427 210 HB3 ASP 75 1HB ASP 75 12.162 19.673 -4.063 211 H CYS 76 H CYS 76 13.329 16.388 -1.298 212 HA CYS 76 HA CYS 76 13.887 15.252 -4.009 213 HB2 CYS 76 2HB CYS 76 15.990 14.705 -3.412 214 HB3 CYS 76 1HB CYS 76 15.772 15.721 -1.988 215 H ARG 77 H ARG 77 12.691 13.477 -4.413 216 HA ARG 77 HA ARG 77 11.755 11.816 -2.113 217 HB2 ARG 77 2HB ARG 77 10.114 12.739 -4.495 218 HB3 ARG 77 1HB ARG 77 9.576 11.555 -3.302 219 HG2 ARG 77 2HG ARG 77 8.749 13.347 -2.180 220 HG3 ARG 77 1HG ARG 77 10.424 13.631 -1.706 221 HD2 ARG 77 2HD ARG 77 9.508 15.686 -2.641 222 HD3 ARG 77 1HD ARG 77 10.719 15.040 -3.750 223 HE ARG 77 HE ARG 77 7.965 14.196 -4.324 224 HH11 ARG 77 1HH1 ARG 77 7.172 14.898 -6.320 225 HH12 ARG 77 2HH1 ARG 77 8.028 16.123 -7.196 226 HH21 ARG 77 1HH2 ARG 77 10.523 16.457 -4.811 227 HH22 ARG 77 2HH2 ARG 77 9.926 17.006 -6.341 228 H GLY 78 H GLY 78 11.406 9.538 -2.709 229 HA2 GLY 78 2HA GLY 78 12.033 8.696 -5.437 230 HA3 GLY 78 1HA GLY 78 13.337 8.358 -4.299 231 H THR 79 H THR 79 12.405 6.157 -5.371 232 HA THR 79 HA THR 79 10.606 4.988 -3.302 233 HB THR 79 HB THR 79 9.541 3.615 -4.989 234 HG1 THR 79 1HG THR 79 10.234 3.592 -7.060 235 HG21 THR 79 1HG2 THR 79 9.317 6.396 -4.852 236 HG22 THR 79 2HG2 THR 79 8.154 5.285 -5.576 237 HG23 THR 79 3HG2 THR 79 9.393 6.044 -6.578 238 H SER 80 H SER 80 10.941 2.642 -3.000 239 HA SER 80 HA SER 80 13.705 1.776 -3.765 240 HB2 SER 80 2HB SER 80 12.237 1.203 -1.173 241 HB3 SER 80 1HB SER 80 13.849 0.630 -1.593 242 HG SER 80 HG SER 80 14.326 2.961 -1.885 243 H GLN 81 H GLN 81 13.933 -0.540 -4.108 244 HA GLN 81 HA GLN 81 11.328 -1.884 -4.689 245 HB2 GLN 81 2HB GLN 81 14.029 -2.366 -5.976 246 HB3 GLN 81 1HB GLN 81 12.511 -3.147 -6.421 247 HG2 GLN 81 2HG GLN 81 12.864 -0.144 -6.476 248 HG3 GLN 81 1HG GLN 81 13.207 -1.165 -7.874 249 HE21 GLN 81 1HE2 GLN 81 10.754 -2.719 -6.226 250 HE22 GLN 81 2HE2 GLN 81 9.419 -2.061 -7.041 251 H TYR 82 H TYR 82 10.985 -3.918 -3.840 252 HA TYR 82 HA TYR 82 13.230 -5.354 -2.579 253 HB2 TYR 82 2HB TYR 82 10.929 -4.113 -1.099 254 HB3 TYR 82 1HB TYR 82 11.650 -5.602 -0.491 255 HD1 TYR 82 1HD TYR 82 11.797 -2.122 -0.281 256 HD2 TYR 82 2HD TYR 82 14.361 -5.557 -0.572 257 HE1 TYR 82 1HE TYR 82 13.662 -0.813 0.699 258 HE2 TYR 82 2HE TYR 82 16.226 -4.248 0.408 259 HH TYR 82 HH TYR 82 16.717 -1.505 0.457 260 HA PRO 83 HA PRO 83 11.210 -9.079 -3.916 261 HB2 PRO 83 2HB PRO 83 11.184 -9.941 -1.054 262 HB3 PRO 83 1HB PRO 83 11.766 -10.806 -2.489 263 HG2 PRO 83 2HG PRO 83 13.438 -9.649 -0.765 264 HG3 PRO 83 1HG PRO 83 13.772 -9.715 -2.502 265 HD2 PRO 83 2HD PRO 83 13.000 -7.384 -0.836 266 HD3 PRO 83 1HD PRO 83 13.883 -7.440 -2.375 267 H CYS 84 H CYS 84 9.492 -10.680 -2.126 268 HA CYS 84 HA CYS 84 6.969 -9.436 -2.728 269 HB2 CYS 84 2HB CYS 84 6.302 -11.560 -2.433 270 HB3 CYS 84 1HB CYS 84 7.895 -11.974 -1.800 271 H VAL 85 H VAL 85 5.598 -8.257 -1.437 272 HA VAL 85 HA VAL 85 6.456 -7.745 1.382 273 HB VAL 85 HB VAL 85 6.990 -5.852 -0.211 274 HG11 VAL 85 1HG1 VAL 85 4.725 -6.368 -1.450 275 HG12 VAL 85 2HG1 VAL 85 5.309 -4.707 -1.343 276 HG13 VAL 85 3HG1 VAL 85 4.047 -5.270 -0.247 277 HG21 VAL 85 1HG2 VAL 85 5.630 -5.813 2.322 278 HG22 VAL 85 2HG2 VAL 85 5.126 -4.414 1.372 279 HG23 VAL 85 3HG2 VAL 85 6.837 -4.685 1.706 280 H GLN 86 H GLN 86 4.714 -7.448 2.872 281 HA GLN 86 HA GLN 86 2.389 -8.962 2.457 282 HB2 GLN 86 2HB GLN 86 2.599 -6.574 4.304 283 HB3 GLN 86 1HB GLN 86 1.501 -7.940 4.459 284 HG2 GLN 86 2HG GLN 86 4.526 -8.065 4.602 285 HG3 GLN 86 1HG GLN 86 3.414 -8.244 5.959 286 HE21 GLN 86 1HE2 GLN 86 5.328 -10.122 4.130 287 HE22 GLN 86 2HE2 GLN 86 4.387 -11.530 4.019 288 H VAL 87 H VAL 87 0.117 -7.540 3.013 289 HA VAL 87 HA VAL 87 -0.135 -5.716 0.647 290 HB VAL 87 HB VAL 87 -1.225 -7.925 0.324 291 HG11 VAL 87 1HG1 VAL 87 -1.742 -8.071 2.863 292 HG12 VAL 87 2HG1 VAL 87 -2.952 -8.690 1.740 293 HG13 VAL 87 3HG1 VAL 87 -3.167 -7.104 2.482 294 HG21 VAL 87 1HG2 VAL 87 -3.651 -6.374 0.531 295 HG22 VAL 87 2HG2 VAL 87 -2.744 -6.814 -0.917 296 HG23 VAL 87 3HG2 VAL 87 -2.336 -5.345 -0.032 297 H TYR 88 H TYR 88 -1.476 -3.919 0.839 298 HA TYR 88 HA TYR 88 -3.249 -3.398 2.980 299 HB2 TYR 88 2HB TYR 88 -1.188 -3.311 4.322 300 HB3 TYR 88 1HB TYR 88 -0.562 -2.055 3.284 301 HD1 TYR 88 1HD TYR 88 -4.111 -1.566 3.652 302 HD2 TYR 88 2HD TYR 88 -0.365 -1.042 5.708 303 HE1 TYR 88 1HE TYR 88 -5.144 0.113 5.113 304 HE2 TYR 88 2HE TYR 88 -1.420 0.648 7.170 305 HH TYR 88 HH TYR 88 -3.258 2.061 7.316 306 H VAL 89 H VAL 89 -1.878 -0.471 2.852 307 HA VAL 89 HA VAL 89 -2.944 0.183 0.150 308 HB VAL 89 HB VAL 89 -4.652 0.685 1.901 309 HG11 VAL 89 1HG1 VAL 89 -2.761 1.257 3.590 310 HG12 VAL 89 2HG1 VAL 89 -4.233 2.227 3.632 311 HG13 VAL 89 3HG1 VAL 89 -2.784 2.855 2.846 312 HG21 VAL 89 1HG2 VAL 89 -4.606 2.009 -0.157 313 HG22 VAL 89 2HG2 VAL 89 -3.367 3.066 0.522 314 HG23 VAL 89 3HG2 VAL 89 -4.993 3.059 1.205 315 H ASN 90 H ASN 90 -1.690 1.579 -0.986 316 HA ASN 90 HA ASN 90 0.768 2.560 0.320 317 HB2 ASN 90 2HB ASN 90 -0.138 2.606 -2.576 318 HB3 ASN 90 1HB ASN 90 1.441 3.128 -2.000 319 HD21 ASN 90 1HD2 ASN 90 0.473 0.571 -0.053 320 HD22 ASN 90 2HD2 ASN 90 1.247 -0.694 -0.877 321 H ASN 91 H ASN 91 0.738 4.595 1.168 322 HA ASN 91 HA ASN 91 -1.353 6.477 0.246 323 HB2 ASN 91 2HB ASN 91 0.637 6.632 2.532 324 HB3 ASN 91 1HB ASN 91 -0.575 7.863 2.176 325 HD21 ASN 91 1HD2 ASN 91 -0.604 6.453 4.665 326 HD22 ASN 91 2HD2 ASN 91 -1.985 5.465 4.707 327 H SER 92 H SER 92 -0.409 6.942 -1.827 328 HA SER 92 HA SER 92 2.258 8.197 -1.852 329 HB2 SER 92 2HB SER 92 0.892 8.397 -4.366 330 HB3 SER 92 1HB SER 92 2.321 7.450 -3.966 331 HG SER 92 HG SER 92 0.919 5.829 -3.169 332 H GLU 93 H GLU 93 -0.255 9.380 -0.588 333 HA GLU 93 HA GLU 93 -1.171 11.599 -2.118 334 HB2 GLU 93 2HB GLU 93 -0.718 11.584 0.884 335 HB3 GLU 93 1HB GLU 93 -1.914 12.519 -0.014 336 HG2 GLU 93 2HG GLU 93 -2.974 10.379 -0.747 337 HG3 GLU 93 1HG GLU 93 -1.835 9.505 0.282 338 H SER 94 H SER 94 1.845 10.834 -0.838 339 HA SER 94 HA SER 94 2.995 13.378 -1.707 340 HB2 SER 94 2HB SER 94 2.587 12.715 1.152 341 HB3 SER 94 1HB SER 94 4.213 13.242 0.736 342 HG SER 94 HG SER 94 1.881 14.608 -0.112 343 H ASN 95 H ASN 95 3.512 10.352 0.093 344 HA ASN 95 HA ASN 95 5.176 9.017 -1.629 345 HB2 ASN 95 2HB ASN 95 6.586 11.307 -0.396 346 HB3 ASN 95 1HB ASN 95 7.450 9.776 -0.290 347 HD21 ASN 95 1HD2 ASN 95 7.156 12.426 -2.261 348 HD22 ASN 95 2HD2 ASN 95 7.536 11.711 -3.754 349 H SER 96 H SER 96 3.380 8.447 0.480 350 HA SER 96 HA SER 96 5.171 7.049 2.442 351 HB2 SER 96 2HB SER 96 2.381 8.167 2.781 352 HB3 SER 96 1HB SER 96 3.128 7.074 3.942 353 HG SER 96 HG SER 96 4.359 8.641 4.605 354 H ARG 97 H ARG 97 4.688 4.880 2.936 355 HA ARG 97 HA ARG 97 2.546 3.606 1.306 356 HB2 ARG 97 2HB ARG 97 4.819 3.243 0.285 357 HB3 ARG 97 1HB ARG 97 5.303 2.425 1.768 358 HG2 ARG 97 2HG ARG 97 2.769 1.496 0.505 359 HG3 ARG 97 1HG ARG 97 4.257 1.111 -0.350 360 HD2 ARG 97 2HD ARG 97 4.269 0.602 2.582 361 HD3 ARG 97 1HD ARG 97 3.246 -0.452 1.608 362 HE ARG 97 HE ARG 97 6.109 -0.556 1.703 363 HH11 ARG 97 1HH1 ARG 97 7.155 -1.889 0.204 364 HH12 ARG 97 2HH1 ARG 97 6.312 -2.392 -1.223 365 HH21 ARG 97 1HH2 ARG 97 3.395 -0.700 -0.417 366 HH22 ARG 97 2HH2 ARG 97 4.183 -1.719 -1.574 367 H ALA 98 H ALA 98 1.160 2.604 2.675 368 HA ALA 98 HA ALA 98 2.108 1.871 5.386 369 HB1 ALA 98 1HB ALA 98 -0.165 3.120 4.632 370 HB2 ALA 98 2HB ALA 98 -0.062 2.131 6.086 371 HB3 ALA 98 3HB ALA 98 -0.727 1.451 4.603 372 H LEU 99 H LEU 99 2.479 -0.238 5.924 373 HA LEU 99 HA LEU 99 1.562 -2.344 4.004 374 HB2 LEU 99 2HB LEU 99 4.015 -2.017 4.045 375 HB3 LEU 99 1HB LEU 99 4.014 -2.350 5.774 376 HG LEU 99 HG LEU 99 3.008 -4.580 5.311 377 HD11 LEU 99 1HD1 LEU 99 1.931 -4.540 3.270 378 HD12 LEU 99 2HD1 LEU 99 3.480 -5.190 2.739 379 HD13 LEU 99 3HD1 LEU 99 3.128 -3.475 2.538 380 HD21 LEU 99 1HD2 LEU 99 5.579 -4.071 3.786 381 HD22 LEU 99 2HD2 LEU 99 5.069 -5.594 4.517 382 HD23 LEU 99 3HD2 LEU 99 5.478 -4.218 5.540 383 H LEU 100 H LEU 100 0.310 -3.943 4.817 384 HA LEU 100 HA LEU 100 0.188 -4.286 7.785 385 HB2 LEU 100 2HB LEU 100 -1.827 -3.082 6.776 386 HB3 LEU 100 1HB LEU 100 -2.177 -4.581 5.917 387 HG LEU 100 HG LEU 100 -2.135 -5.767 8.152 388 HD11 LEU 100 1HD1 LEU 100 -2.808 -3.614 9.834 389 HD12 LEU 100 2HD1 LEU 100 -1.349 -3.103 8.989 390 HD13 LEU 100 3HD1 LEU 100 -1.352 -4.604 9.914 391 HD21 LEU 100 1HD2 LEU 100 -4.280 -5.366 7.230 392 HD22 LEU 100 2HD2 LEU 100 -4.155 -3.625 7.485 393 HD23 LEU 100 3HD2 LEU 100 -4.383 -4.705 8.861 394 H HIS 101 H HIS 101 -0.190 -6.464 8.480 395 HA HIS 101 HA HIS 101 0.587 -8.483 6.454 396 HB2 HIS 101 2HB HIS 101 0.272 -8.684 9.464 397 HB3 HIS 101 1HB HIS 101 0.852 -9.981 8.419 398 HD1 HIS 101 1HD HIS 101 1.970 -6.701 7.276 399 HD2 HIS 101 2HD HIS 101 3.369 -9.565 9.966 400 HE1 HIS 101 1HE HIS 101 4.405 -6.154 7.702 401 HE2 HIS 101 2HE HIS 101 5.267 -7.887 9.342 402 H SER 102 H SER 102 -0.987 -9.649 5.462 403 HA SER 102 HA SER 102 -3.752 -9.421 6.088 404 HB2 SER 102 2HB SER 102 -2.384 -11.713 4.653 405 HB3 SER 102 1HB SER 102 -4.086 -11.277 4.540 406 HG SER 102 HG SER 102 -2.930 -10.405 2.802 407 H ASP 103 H ASP 103 -1.304 -11.757 7.095 408 HA ASP 103 HA ASP 103 -2.533 -12.392 9.545 409 HB2 ASP 103 2HB ASP 103 -3.255 -14.810 8.838 410 HB3 ASP 103 1HB ASP 103 -4.368 -13.469 8.582 411 H GLU 104 H GLU 104 -1.523 -14.361 10.545 412 HA GLU 104 HA GLU 104 1.285 -14.424 9.995 413 HB2 GLU 104 2HB GLU 104 -0.462 -16.271 11.644 414 HB3 GLU 104 1HB GLU 104 1.299 -16.300 11.649 415 HG2 GLU 104 2HG GLU 104 -0.392 -13.889 12.367 416 HG3 GLU 104 1HG GLU 104 0.387 -14.958 13.532 417 H HIS 105 H HIS 105 -1.394 -16.475 8.962 418 HA HIS 105 HA HIS 105 0.078 -18.730 8.099 419 HB2 HIS 105 2HB HIS 105 -2.366 -18.710 8.178 420 HB3 HIS 105 1HB HIS 105 -2.415 -17.492 6.904 421 HD1 HIS 105 1HD HIS 105 -1.225 -21.073 7.447 422 HD2 HIS 105 2HD HIS 105 -2.344 -18.522 4.348 423 HE1 HIS 105 1HE HIS 105 -1.277 -22.485 5.342 424 HE2 HIS 105 2HE HIS 105 -1.960 -20.943 3.446 425 H GLN 106 H GLN 106 -0.609 -15.674 6.406 426 HA GLN 106 HA GLN 106 0.595 -16.462 3.926 427 HB2 GLN 106 2HB GLN 106 0.121 -13.744 5.171 428 HB3 GLN 106 1HB GLN 106 0.737 -13.972 3.535 429 HG2 GLN 106 2HG GLN 106 -1.853 -15.178 4.536 430 HG3 GLN 106 1HG GLN 106 -1.759 -13.663 3.635 431 HE21 GLN 106 1HE2 GLN 106 -2.605 -16.730 3.076 432 HE22 GLN 106 2HE2 GLN 106 -1.991 -16.962 1.511 433 H LEU 107 H LEU 107 1.881 -14.873 6.825 434 HA LEU 107 HA LEU 107 4.472 -14.284 5.801 435 HB2 LEU 107 2HB LEU 107 3.622 -13.454 7.993 436 HB3 LEU 107 1HB LEU 107 3.743 -15.093 8.636 437 HG LEU 107 HG LEU 107 6.185 -15.079 8.064 438 HD11 LEU 107 1HD1 LEU 107 5.376 -12.499 6.905 439 HD12 LEU 107 2HD1 LEU 107 6.785 -13.499 6.551 440 HD13 LEU 107 3HD1 LEU 107 6.811 -12.394 7.925 441 HD21 LEU 107 1HD2 LEU 107 4.812 -13.714 10.169 442 HD22 LEU 107 2HD2 LEU 107 6.247 -12.775 9.757 443 HD23 LEU 107 3HD2 LEU 107 6.405 -14.469 10.219 444 H LEU 108 H LEU 108 3.169 -17.212 7.347 445 HA LEU 108 HA LEU 108 5.638 -18.691 7.275 446 HB2 LEU 108 2HB LEU 108 2.783 -19.728 7.195 447 HB3 LEU 108 1HB LEU 108 4.215 -20.675 7.601 448 HG LEU 108 HG LEU 108 3.163 -18.282 9.139 449 HD11 LEU 108 1HD1 LEU 108 3.174 -21.264 9.634 450 HD12 LEU 108 2HD1 LEU 108 1.793 -20.166 9.634 451 HD13 LEU 108 3HD1 LEU 108 2.974 -20.100 10.942 452 HD21 LEU 108 1HD2 LEU 108 5.450 -18.144 9.520 453 HD22 LEU 108 2HD2 LEU 108 5.701 -19.870 9.261 454 HD23 LEU 108 3HD2 LEU 108 4.996 -19.300 10.772 455 H THR 109 H THR 109 3.091 -18.046 4.970 456 HA THR 109 HA THR 109 3.863 -20.048 3.043 457 HB THR 109 HB THR 109 2.312 -17.467 2.687 458 HG1 THR 109 1HG THR 109 1.452 -18.974 4.220 459 HG21 THR 109 1HG2 THR 109 2.280 -18.003 0.522 460 HG22 THR 109 2HG2 THR 109 1.478 -19.518 0.933 461 HG23 THR 109 3HG2 THR 109 3.236 -19.449 0.841 462 H ASN 110 H ASN 110 4.625 -16.615 3.523 463 HA ASN 110 HA ASN 110 6.842 -16.932 1.543 464 HB2 ASN 110 2HB ASN 110 5.290 -14.363 1.871 465 HB3 ASN 110 1HB ASN 110 6.386 -14.818 0.567 466 HD21 ASN 110 1HD2 ASN 110 3.409 -14.084 0.518 467 HD22 ASN 110 2HD2 ASN 110 2.672 -15.380 -0.293 468 HA PRO 111 HA PRO 111 8.278 -15.106 5.591 469 HB2 PRO 111 2HB PRO 111 9.890 -17.117 6.405 470 HB3 PRO 111 1HB PRO 111 8.142 -17.133 6.705 471 HG2 PRO 111 2HG PRO 111 9.727 -18.606 4.672 472 HG3 PRO 111 1HG PRO 111 8.298 -19.119 5.581 473 HD2 PRO 111 2HD PRO 111 8.266 -18.197 2.944 474 HD3 PRO 111 1HD PRO 111 6.860 -18.257 4.024 475 H LYS 112 H LYS 112 9.636 -15.994 2.649 476 HA LYS 112 HA LYS 112 12.364 -15.114 3.425 477 HB2 LYS 112 2HB LYS 112 11.343 -16.393 0.875 478 HB3 LYS 112 1HB LYS 112 13.024 -15.956 1.184 479 HG2 LYS 112 2HG LYS 112 13.000 -17.447 3.189 480 HG3 LYS 112 1HG LYS 112 11.367 -17.949 2.756 481 HD2 LYS 112 2HD LYS 112 12.235 -18.708 0.538 482 HD3 LYS 112 1HD LYS 112 13.867 -18.317 1.082 483 HE2 LYS 112 2HE LYS 112 12.890 -19.850 3.163 484 HE3 LYS 112 1HE LYS 112 12.184 -20.627 1.746 485 HZ1 LYS 112 1HZ LYS 112 14.215 -21.170 0.909 486 HZ2 LYS 112 2HZ LYS 112 14.579 -21.234 2.568 487 HZ3 LYS 112 3HZ LYS 112 15.011 -19.869 1.653 488 H CYS 113 H CYS 113 9.794 -13.414 2.835 489 HA CYS 113 HA CYS 113 11.254 -11.484 1.096 490 HB2 CYS 113 2HB CYS 113 9.164 -11.017 -0.155 491 HB3 CYS 113 1HB CYS 113 9.700 -12.683 -0.369 492 H SER 114 H SER 114 9.367 -12.056 3.881 493 HA SER 114 HA SER 114 8.410 -9.264 4.045 494 HB2 SER 114 2HB SER 114 7.244 -9.961 6.033 495 HB3 SER 114 1HB SER 114 7.027 -11.228 4.829 496 HG SER 114 HG SER 114 9.275 -11.724 6.136 497 H TYR 115 H TYR 115 11.006 -11.250 5.285 498 HA TYR 115 HA TYR 115 11.704 -9.578 7.520 499 HB2 TYR 115 2HB TYR 115 13.358 -11.536 5.906 500 HB3 TYR 115 1HB TYR 115 13.896 -10.782 7.408 501 HD1 TYR 115 1HD TYR 115 11.156 -12.852 5.950 502 HD2 TYR 115 2HD TYR 115 13.267 -11.683 9.499 503 HE1 TYR 115 1HE TYR 115 9.926 -14.574 7.245 504 HE2 TYR 115 2HE TYR 115 12.038 -13.402 10.797 505 HH TYR 115 HH TYR 115 9.324 -14.735 9.971 506 H ILE 116 H ILE 116 12.657 -9.555 4.111 507 HA ILE 116 HA ILE 116 14.848 -7.797 4.280 508 HB ILE 116 HB ILE 116 14.088 -7.018 1.944 509 HG12 ILE 116 2HG1 ILE 116 12.355 -8.632 0.961 510 HG13 ILE 116 1HG1 ILE 116 11.925 -9.036 2.614 511 HG21 ILE 116 1HG2 ILE 116 15.656 -8.939 2.493 512 HG22 ILE 116 2HG2 ILE 116 14.820 -9.068 0.948 513 HG23 ILE 116 3HG2 ILE 116 14.268 -10.013 2.330 514 HD11 ILE 116 1HD1 ILE 116 10.832 -6.971 1.147 515 HD12 ILE 116 2HD1 ILE 116 12.035 -6.137 2.128 516 HD13 ILE 116 3HD1 ILE 116 10.778 -7.102 2.903 517 HA PRO 117 HA PRO 117 13.749 -3.828 5.817 518 HB2 PRO 117 2HB PRO 117 14.237 -2.897 3.008 519 HB3 PRO 117 1HB PRO 117 14.796 -2.194 4.539 520 HG2 PRO 117 2HG PRO 117 16.349 -3.759 2.956 521 HG3 PRO 117 1HG PRO 117 16.549 -3.624 4.710 522 HD2 PRO 117 2HD PRO 117 15.679 -5.935 3.167 523 HD3 PRO 117 1HD PRO 117 16.037 -5.835 4.904 524 HA PRO 118 HA PRO 118 9.579 -3.842 3.890 525 HB2 PRO 118 2HB PRO 118 8.148 -4.338 6.123 526 HB3 PRO 118 1HB PRO 118 9.000 -5.627 5.255 527 HG2 PRO 118 2HG PRO 118 9.656 -4.340 7.821 528 HG3 PRO 118 1HG PRO 118 10.064 -5.955 7.227 529 HD2 PRO 118 2HD PRO 118 11.743 -3.625 7.237 530 HD3 PRO 118 1HD PRO 118 12.124 -5.231 6.582 531 H CYS 119 H CYS 119 8.027 -2.146 3.872 532 HA CYS 119 HA CYS 119 8.677 0.165 5.632 533 HB2 CYS 119 2HB CYS 119 6.741 0.344 3.346 534 HB3 CYS 119 1HB CYS 119 7.852 1.566 3.962 535 H LYS 120 H LYS 120 7.425 0.132 7.466 536 HA LYS 120 HA LYS 120 4.546 -0.641 7.150 537 HB2 LYS 120 2HB LYS 120 6.347 -0.965 9.567 538 HB3 LYS 120 1HB LYS 120 4.637 -1.390 9.505 539 HG2 LYS 120 2HG LYS 120 5.133 -2.982 7.654 540 HG3 LYS 120 1HG LYS 120 6.846 -2.604 7.820 541 HD2 LYS 120 2HD LYS 120 6.716 -3.331 10.215 542 HD3 LYS 120 1HD LYS 120 5.054 -3.843 9.926 543 HE2 LYS 120 2HE LYS 120 5.966 -5.837 9.344 544 HE3 LYS 120 1HE LYS 120 6.394 -5.032 7.835 545 HZ1 LYS 120 1HZ LYS 120 8.403 -5.859 8.567 546 HZ2 LYS 120 2HZ LYS 120 8.069 -5.543 10.203 547 HZ3 LYS 120 3HZ LYS 120 8.449 -4.266 9.151 548 H ARG 121 H ARG 121 3.034 0.777 7.930 549 HA ARG 121 HA ARG 121 3.774 3.491 8.507 550 HB2 ARG 121 2HB ARG 121 1.532 2.694 7.628 551 HB3 ARG 121 1HB ARG 121 1.177 2.119 9.253 552 HG2 ARG 121 2HG ARG 121 1.609 4.437 10.109 553 HG3 ARG 121 1HG ARG 121 1.767 4.978 8.437 554 HD2 ARG 121 2HD ARG 121 -0.688 3.628 9.601 555 HD3 ARG 121 1HD ARG 121 -0.522 5.361 9.320 556 HE ARG 121 HE ARG 121 0.027 4.196 6.851 557 HH11 ARG 121 1HH1 ARG 121 -1.598 3.874 5.308 558 HH12 ARG 121 2HH1 ARG 121 -3.246 3.733 5.823 559 HH21 ARG 121 1HH2 ARG 121 -2.507 4.125 9.187 560 HH22 ARG 121 2HH2 ARG 121 -3.760 3.875 8.019 561 H GLU 122 H GLU 122 2.790 0.758 10.510 562 HA GLU 122 HA GLU 122 3.878 2.189 12.888 563 HB2 GLU 122 2HB GLU 122 1.463 0.357 12.879 564 HB3 GLU 122 1HB GLU 122 2.081 1.287 14.245 565 HG2 GLU 122 2HG GLU 122 1.654 3.382 12.972 566 HG3 GLU 122 1HG GLU 122 0.953 2.416 11.674 567 H ASN 123 H ASN 123 4.980 0.843 14.366 568 HA ASN 123 HA ASN 123 6.296 -1.449 13.292 569 HB2 ASN 123 2HB ASN 123 5.882 -0.802 16.220 570 HB3 ASN 123 1HB ASN 123 7.184 -1.765 15.521 571 HD21 ASN 123 1HD2 ASN 123 5.973 1.522 15.955 572 HD22 ASN 123 2HD2 ASN 123 7.378 2.308 15.409 573 H GLN 124 H GLN 124 3.510 -1.128 15.463 574 HA GLN 124 HA GLN 124 2.620 -3.827 14.670 575 HB2 GLN 124 2HB GLN 124 4.074 -4.139 16.693 576 HB3 GLN 124 1HB GLN 124 2.978 -3.090 17.590 577 HG2 GLN 124 2HG GLN 124 1.117 -4.628 17.170 578 HG3 GLN 124 1HG GLN 124 2.169 -5.662 16.201 579 HE21 GLN 124 1HE2 GLN 124 0.999 -6.903 18.357 580 HE22 GLN 124 2HE2 GLN 124 2.122 -7.133 19.609 581 H LYS 125 H LYS 125 0.339 -4.197 15.312 582 HA LYS 125 HA LYS 125 -1.099 -1.777 16.243 583 HB2 LYS 125 2HB LYS 125 -0.986 -1.882 13.673 584 HB3 LYS 125 1HB LYS 125 -2.039 -3.291 13.803 585 HG2 LYS 125 2HG LYS 125 -3.717 -1.954 15.003 586 HG3 LYS 125 1HG LYS 125 -2.655 -0.549 14.945 587 HD2 LYS 125 2HD LYS 125 -4.253 -0.325 13.150 588 HD3 LYS 125 1HD LYS 125 -2.692 -0.721 12.429 589 HE2 LYS 125 2HE LYS 125 -3.328 -2.929 11.952 590 HE3 LYS 125 1HE LYS 125 -4.628 -2.913 13.144 591 HZ1 LYS 125 1HZ LYS 125 -5.640 -2.730 11.040 592 HZ2 LYS 125 2HZ LYS 125 -4.548 -1.535 10.523 593 HZ3 LYS 125 3HZ LYS 125 -5.702 -1.174 11.715 594 H ASN 126 H ASN 126 -3.377 -3.699 14.918 595 HA ASN 126 HA ASN 126 -3.708 -5.263 17.448 596 HB2 ASN 126 2HB ASN 126 -5.444 -3.495 16.873 597 HB3 ASN 126 1HB ASN 126 -5.884 -4.497 15.490 598 HD21 ASN 126 1HD2 ASN 126 -7.949 -4.235 17.190 599 HD22 ASN 126 2HD2 ASN 126 -8.144 -5.594 18.187 600 H LEU 127 H LEU 127 -3.222 -7.380 17.139 601 HA LEU 127 HA LEU 127 -2.967 -8.611 14.571 602 HB2 LEU 127 2HB LEU 127 -3.327 -9.830 17.323 603 HB3 LEU 127 1HB LEU 127 -2.923 -10.754 15.877 604 HG LEU 127 HG LEU 127 -0.920 -9.246 15.572 605 HD11 LEU 127 1HD1 LEU 127 -0.273 -8.213 17.922 606 HD12 LEU 127 2HD1 LEU 127 -2.021 -8.179 18.149 607 HD13 LEU 127 3HD1 LEU 127 -1.290 -7.309 16.801 608 HD21 LEU 127 1HD2 LEU 127 0.423 -10.494 17.090 609 HD22 LEU 127 2HD2 LEU 127 -0.958 -11.537 16.745 610 HD23 LEU 127 3HD2 LEU 127 -0.892 -10.634 18.258 611 H GLU 128 H GLU 128 -5.635 -8.535 16.907 612 HA GLU 128 HA GLU 128 -7.283 -10.475 15.630 613 HB2 GLU 128 2HB GLU 128 -7.693 -9.521 17.908 614 HB3 GLU 128 1HB GLU 128 -8.197 -8.012 17.145 615 HG2 GLU 128 2HG GLU 128 -10.192 -9.290 17.602 616 HG3 GLU 128 1HG GLU 128 -9.920 -9.340 15.859 617 H SER 129 H SER 129 -6.940 -6.981 15.101 618 HA SER 129 HA SER 129 -9.089 -6.667 13.264 619 HB2 SER 129 2HB SER 129 -6.433 -5.208 13.314 620 HB3 SER 129 1HB SER 129 -7.885 -4.665 12.480 621 HG SER 129 HG SER 129 -7.819 -5.250 15.251 622 H VAL 130 H VAL 130 -5.791 -7.838 12.825 623 HA VAL 130 HA VAL 130 -5.722 -7.775 9.983 624 HB VAL 130 HB VAL 130 -4.374 -9.608 11.976 625 HG11 VAL 130 1HG1 VAL 130 -2.850 -10.061 9.944 626 HG12 VAL 130 2HG1 VAL 130 -4.191 -9.456 8.967 627 HG13 VAL 130 3HG1 VAL 130 -4.409 -10.885 9.977 628 HG21 VAL 130 1HG2 VAL 130 -3.595 -7.336 12.125 629 HG22 VAL 130 2HG2 VAL 130 -3.543 -7.177 10.368 630 HG23 VAL 130 3HG2 VAL 130 -2.385 -8.220 11.195 631 H MET 131 H MET 131 -6.965 -10.288 12.211 632 HA MET 131 HA MET 131 -7.519 -12.248 10.229 633 HB2 MET 131 2HB MET 131 -7.758 -12.640 12.686 634 HB3 MET 131 1HB MET 131 -9.193 -11.613 12.681 635 HG2 MET 131 2HG MET 131 -9.375 -13.595 10.582 636 HG3 MET 131 1HG MET 131 -9.086 -14.378 12.134 637 HE1 MET 131 1HE MET 131 -11.551 -12.283 9.933 638 HE2 MET 131 2HE MET 131 -12.941 -13.207 10.500 639 HE3 MET 131 3HE MET 131 -11.513 -14.051 9.905 640 H ASN 132 H ASN 132 -9.486 -9.546 11.423 641 HA ASN 132 HA ASN 132 -11.718 -10.018 9.674 642 HB2 ASN 132 2HB ASN 132 -11.665 -8.526 11.750 643 HB3 ASN 132 1HB ASN 132 -10.855 -7.324 10.745 644 HD21 ASN 132 1HD2 ASN 132 -13.168 -6.330 11.560 645 HD22 ASN 132 2HD2 ASN 132 -14.408 -6.473 10.408 646 H TRP 133 H TRP 133 -8.692 -8.241 9.339 647 HA TRP 133 HA TRP 133 -9.296 -6.760 7.005 648 HB2 TRP 133 2HB TRP 133 -7.253 -6.334 8.228 649 HB3 TRP 133 1HB TRP 133 -6.676 -7.970 7.914 650 HD1 TRP 133 HD TRP 133 -5.778 -8.537 5.510 651 HE1 TRP 133 1HE TRP 133 -5.065 -7.060 3.521 652 HE3 TRP 133 3HE TRP 133 -7.765 -4.071 6.979 653 HZ2 TRP 133 2HZ TRP 133 -5.309 -4.341 2.668 654 HZ3 TRP 133 3HZ TRP 133 -7.509 -2.058 5.560 655 HH2 TRP 133 HH TRP 133 -6.286 -2.189 3.412 656 H GLN 134 H GLN 134 -8.016 -10.089 7.285 657 HA GLN 134 HA GLN 134 -7.729 -10.447 4.460 658 HB2 GLN 134 2HB GLN 134 -7.167 -12.635 4.932 659 HB3 GLN 134 1HB GLN 134 -6.894 -11.909 6.511 660 HG2 GLN 134 2HG GLN 134 -8.154 -13.846 6.977 661 HG3 GLN 134 1HG GLN 134 -9.346 -12.554 7.020 662 HE21 GLN 134 1HE2 GLN 134 -11.203 -13.616 6.203 663 HE22 GLN 134 2HE2 GLN 134 -11.265 -14.396 4.699 664 H GLN 135 H GLN 135 -10.435 -11.191 6.657 665 HA GLN 135 HA GLN 135 -12.128 -12.245 4.561 666 HB2 GLN 135 2HB GLN 135 -12.429 -12.678 7.027 667 HB3 GLN 135 1HB GLN 135 -12.964 -11.007 7.199 668 HG2 GLN 135 2HG GLN 135 -14.945 -12.332 6.973 669 HG3 GLN 135 1HG GLN 135 -14.717 -11.509 5.427 670 HE21 GLN 135 1HE2 GLN 135 -14.863 -12.868 3.640 671 HE22 GLN 135 2HE2 GLN 135 -14.560 -14.538 3.655 672 H TYR 136 H TYR 136 -11.794 -9.093 6.128 673 HA TYR 136 HA TYR 136 -13.916 -7.791 4.687 674 HB2 TYR 136 2HB TYR 136 -13.094 -6.902 6.792 675 HB3 TYR 136 1HB TYR 136 -11.479 -6.703 6.117 676 HD1 TYR 136 1HD TYR 136 -11.061 -5.033 4.328 677 HD2 TYR 136 2HD TYR 136 -14.846 -5.317 6.339 678 HE1 TYR 136 1HE TYR 136 -11.666 -2.774 3.509 679 HE2 TYR 136 2HE TYR 136 -15.454 -3.058 5.517 680 HH TYR 136 HH TYR 136 -13.759 -1.480 3.061 681 H TRP 137 H TRP 137 -10.367 -7.727 4.241 682 HA TRP 137 HA TRP 137 -10.426 -6.014 1.955 683 HB2 TRP 137 2HB TRP 137 -8.370 -6.304 3.195 684 HB3 TRP 137 1HB TRP 137 -8.367 -8.038 2.869 685 HD1 TRP 137 HD TRP 137 -7.502 -4.707 1.326 686 HE1 TRP 137 1HE TRP 137 -6.387 -5.097 -0.967 687 HE3 TRP 137 3HE TRP 137 -8.316 -9.699 0.799 688 HZ2 TRP 137 2HZ TRP 137 -5.907 -7.252 -2.788 689 HZ3 TRP 137 3HZ TRP 137 -7.527 -10.909 -1.218 690 HH2 TRP 137 HH TRP 137 -6.321 -9.690 -3.012 691 H LYS 138 H LYS 138 -10.384 -9.567 2.203 692 HA LYS 138 HA LYS 138 -10.093 -10.080 -0.578 693 HB2 LYS 138 2HB LYS 138 -9.875 -11.798 1.220 694 HB3 LYS 138 1HB LYS 138 -11.626 -11.750 1.431 695 HG2 LYS 138 2HG LYS 138 -11.911 -12.386 -0.953 696 HG3 LYS 138 1HG LYS 138 -10.158 -12.498 -1.115 697 HD2 LYS 138 2HD LYS 138 -10.152 -14.206 0.721 698 HD3 LYS 138 1HD LYS 138 -11.916 -14.163 0.709 699 HE2 LYS 138 2HE LYS 138 -10.302 -14.730 -1.784 700 HE3 LYS 138 1HE LYS 138 -10.823 -16.010 -0.689 701 HZ1 LYS 138 1HZ LYS 138 -12.925 -15.851 -1.382 702 HZ2 LYS 138 2HZ LYS 138 -12.288 -15.030 -2.725 703 HZ3 LYS 138 3HZ LYS 138 -12.906 -14.155 -1.407 704 H ASP 139 H ASP 139 -13.056 -9.713 1.367 705 HA ASP 139 HA ASP 139 -14.843 -10.205 -0.826 706 HB2 ASP 139 2HB ASP 139 -15.243 -8.690 1.763 707 HB3 ASP 139 1HB ASP 139 -16.542 -9.104 0.643 708 H GLU 140 H GLU 140 -13.590 -7.154 0.566 709 HA GLU 140 HA GLU 140 -15.055 -5.574 -1.399 710 HB2 GLU 140 2HB GLU 140 -12.916 -4.817 0.604 711 HB3 GLU 140 1HB GLU 140 -13.772 -3.663 -0.420 712 HG2 GLU 140 2HG GLU 140 -15.932 -4.490 0.540 713 HG3 GLU 140 1HG GLU 140 -15.006 -5.506 1.646 714 H ILE 141 H ILE 141 -11.670 -6.552 -0.922 715 HA ILE 141 HA ILE 141 -11.158 -5.588 -3.698 716 HB ILE 141 HB ILE 141 -9.187 -5.742 -1.409 717 HG12 ILE 141 2HG1 ILE 141 -10.420 -3.321 -2.761 718 HG13 ILE 141 1HG1 ILE 141 -10.888 -3.928 -1.172 719 HG21 ILE 141 1HG2 ILE 141 -8.889 -5.551 -4.277 720 HG22 ILE 141 2HG2 ILE 141 -7.637 -5.653 -3.037 721 HG23 ILE 141 3HG2 ILE 141 -8.285 -4.082 -3.509 722 HD11 ILE 141 1HD1 ILE 141 -8.604 -3.599 -0.347 723 HD12 ILE 141 2HD1 ILE 141 -9.234 -2.084 -0.998 724 HD13 ILE 141 3HD1 ILE 141 -8.091 -3.045 -1.941 725 H GLY 142 H GLY 142 -11.120 -7.391 -4.959 726 HA2 GLY 142 2HA GLY 142 -10.212 -9.973 -3.972 727 HA3 GLY 142 1HA GLY 142 -10.572 -9.579 -5.659 728 H SER 143 H SER 143 -8.847 -7.288 -5.798 729 HA SER 143 HA SER 143 -6.231 -7.374 -5.048 730 HB2 SER 143 2HB SER 143 -6.829 -9.644 -6.898 731 HB3 SER 143 1HB SER 143 -5.311 -8.783 -7.131 732 HG SER 143 HG SER 143 -5.208 -9.069 -4.687 733 H GLN 144 H GLN 144 -7.407 -5.247 -5.854 734 HA GLN 144 HA GLN 144 -6.303 -4.675 -8.550 735 HB2 GLN 144 2HB GLN 144 -8.558 -3.271 -8.790 736 HB3 GLN 144 1HB GLN 144 -8.462 -4.960 -9.289 737 HG2 GLN 144 2HG GLN 144 -9.655 -5.717 -7.454 738 HG3 GLN 144 1HG GLN 144 -9.156 -4.364 -6.440 739 HE21 GLN 144 1HE2 GLN 144 -10.062 -2.130 -7.268 740 HE22 GLN 144 2HE2 GLN 144 -11.667 -2.138 -7.820 741 HA PRO 145 HA PRO 145 -5.083 -1.348 -5.542 742 HB2 PRO 145 2HB PRO 145 -3.114 -0.844 -7.694 743 HB3 PRO 145 1HB PRO 145 -2.849 -1.093 -5.963 744 HG2 PRO 145 2HG PRO 145 -2.228 -2.932 -7.838 745 HG3 PRO 145 1HG PRO 145 -2.672 -3.343 -6.177 746 HD2 PRO 145 2HD PRO 145 -4.252 -3.651 -8.671 747 HD3 PRO 145 1HD PRO 145 -4.351 -4.564 -7.151 748 H PHE 146 H PHE 146 -4.996 1.106 -5.978 749 HA PHE 146 HA PHE 146 -6.089 1.852 -8.616 750 HB2 PHE 146 2HB PHE 146 -7.849 3.248 -7.587 751 HB3 PHE 146 1HB PHE 146 -8.083 1.536 -7.263 752 HD1 PHE 146 1HD PHE 146 -8.144 4.716 -5.861 753 HD2 PHE 146 2HD PHE 146 -6.815 0.723 -4.989 754 HE1 PHE 146 1HE PHE 146 -8.220 5.220 -3.438 755 HE2 PHE 146 2HE PHE 146 -6.881 1.240 -2.570 756 HZ PHE 146 HZ PHE 146 -7.586 3.480 -1.790 757 H THR 147 H THR 147 -5.838 4.075 -9.153 758 HA THR 147 HA THR 147 -3.787 5.462 -7.485 759 HB THR 147 HB THR 147 -2.872 6.384 -9.519 760 HG1 THR 147 1HG THR 147 -4.742 6.662 -10.699 761 HG21 THR 147 1HG2 THR 147 -1.739 4.497 -10.003 762 HG22 THR 147 2HG2 THR 147 -3.189 3.693 -10.602 763 HG23 THR 147 3HG2 THR 147 -2.827 3.687 -8.876 764 H CYS 148 H CYS 148 -3.928 7.784 -7.491 765 HA CYS 148 HA CYS 148 -6.528 8.908 -8.342 766 HB2 CYS 148 2HB CYS 148 -5.574 9.830 -5.697 767 HB3 CYS 148 1HB CYS 148 -7.204 9.422 -6.218 768 H TYR 149 H TYR 149 -6.435 11.290 -8.484 769 HA TYR 149 HA TYR 149 -3.706 12.464 -8.315 770 HB2 TYR 149 2HB TYR 149 -5.413 12.635 -10.822 771 HB3 TYR 149 1HB TYR 149 -3.873 13.444 -10.562 772 HD1 TYR 149 1HD TYR 149 -1.787 12.107 -10.268 773 HD2 TYR 149 2HD TYR 149 -5.514 10.308 -11.414 774 HE1 TYR 149 1HE TYR 149 -0.574 10.081 -11.034 775 HE2 TYR 149 2HE TYR 149 -4.303 8.284 -12.181 776 HH TYR 149 HH TYR 149 -0.819 8.198 -12.393 777 H PHE 150 H PHE 150 -3.826 14.560 -7.528 778 HA PHE 150 HA PHE 150 -6.430 15.943 -7.789 779 HB2 PHE 150 2HB PHE 150 -6.941 15.875 -5.593 780 HB3 PHE 150 1HB PHE 150 -5.705 14.628 -5.450 781 HD1 PHE 150 1HD PHE 150 -6.553 18.123 -4.843 782 HD2 PHE 150 2HD PHE 150 -3.399 15.214 -4.750 783 HE1 PHE 150 1HE PHE 150 -5.213 19.641 -3.413 784 HE2 PHE 150 2HE PHE 150 -2.043 16.724 -3.329 785 HZ PHE 150 HZ PHE 150 -2.949 18.936 -2.652 786 H ASN 151 H ASN 151 -6.308 18.196 -7.736 787 HA ASN 151 HA ASN 151 -3.629 19.401 -7.317 788 HB2 ASN 151 2HB ASN 151 -3.602 20.485 -9.469 789 HB3 ASN 151 1HB ASN 151 -3.871 18.766 -9.747 790 HD21 ASN 151 1HD2 ASN 151 -4.703 20.892 -11.584 791 HD22 ASN 151 2HD2 ASN 151 -6.398 20.835 -11.673 792 H GLN 152 H GLN 152 -3.811 21.272 -6.241 793 HA GLN 152 HA GLN 152 -6.471 22.485 -5.839 794 HB2 GLN 152 2HB GLN 152 -4.952 22.112 -3.896 795 HB3 GLN 152 1HB GLN 152 -3.771 23.190 -4.637 796 HG2 GLN 152 2HG GLN 152 -5.284 25.069 -4.476 797 HG3 GLN 152 1HG GLN 152 -6.602 24.026 -3.948 798 HE21 GLN 152 1HE2 GLN 152 -6.019 26.082 -2.230 799 HE22 GLN 152 2HE2 GLN 152 -5.171 25.522 -0.870 800 H HIS 153 H HIS 153 -3.959 22.722 -8.003 801 HA HIS 153 HA HIS 153 -3.406 25.416 -8.386 802 HB2 HIS 153 2HB HIS 153 -3.910 23.244 -10.434 803 HB3 HIS 153 1HB HIS 153 -3.246 24.826 -10.835 804 HD1 HIS 153 1HD HIS 153 -0.764 25.034 -10.666 805 HD2 HIS 153 2HD HIS 153 -2.199 21.877 -8.345 806 HE1 HIS 153 1HE HIS 153 1.269 23.873 -9.694 807 HE2 HIS 153 2HE HIS 153 0.406 21.950 -8.285 808 H GLN 154 H GLN 154 -6.376 23.673 -9.218 809 HA GLN 154 HA GLN 154 -7.541 25.843 -10.722 810 HB2 GLN 154 2HB GLN 154 -8.812 23.532 -9.224 811 HB3 GLN 154 1HB GLN 154 -9.683 24.620 -10.300 812 HG2 GLN 154 2HG GLN 154 -8.248 23.957 -12.175 813 HG3 GLN 154 1HG GLN 154 -7.320 22.902 -11.107 814 HE21 GLN 154 1HE2 GLN 154 -8.680 21.828 -13.375 815 HE22 GLN 154 2HE2 GLN 154 -9.957 20.854 -12.830 816 H ARG 155 H ARG 155 -8.546 24.608 -7.526 817 HA ARG 155 HA ARG 155 -8.276 27.162 -6.248 818 HB2 ARG 155 2HB ARG 155 -10.656 26.847 -7.770 819 HB3 ARG 155 1HB ARG 155 -11.111 26.758 -6.067 820 HG2 ARG 155 2HG ARG 155 -9.347 28.931 -7.231 821 HG3 ARG 155 1HG ARG 155 -11.085 29.100 -6.990 822 HD2 ARG 155 2HD ARG 155 -10.500 28.313 -4.530 823 HD3 ARG 155 1HD ARG 155 -8.898 28.919 -4.948 824 HE ARG 155 HE ARG 155 -10.781 30.910 -5.678 825 HH11 ARG 155 1HH1 ARG 155 -11.133 32.659 -4.291 826 HH12 ARG 155 2HH1 ARG 155 -10.714 32.517 -2.615 827 HH21 ARG 155 1HH2 ARG 155 -9.556 29.262 -2.909 828 HH22 ARG 155 2HH2 ARG 155 -9.821 30.594 -1.833 829 HA PRO 156 HA PRO 156 -10.000 24.013 -3.208 830 HB2 PRO 156 2HB PRO 156 -11.725 22.111 -3.942 831 HB3 PRO 156 1HB PRO 156 -12.209 23.817 -3.929 832 HG2 PRO 156 2HG PRO 156 -11.653 22.045 -6.217 833 HG3 PRO 156 1HG PRO 156 -12.679 23.485 -6.125 834 HD2 PRO 156 2HD PRO 156 -9.944 23.304 -7.077 835 HD3 PRO 156 1HD PRO 156 -11.005 24.723 -7.046 836 H ASP 157 H ASP 157 -10.630 21.193 -5.052 837 HA ASP 157 HA ASP 157 -7.908 20.176 -5.127 838 HB2 ASP 157 2HB ASP 157 -8.282 18.399 -3.420 839 HB3 ASP 157 1HB ASP 157 -8.314 20.014 -2.715 840 H ASP 158 H ASP 158 -8.919 19.923 -7.353 841 HA ASP 158 HA ASP 158 -11.112 18.196 -7.878 842 HB2 ASP 158 2HB ASP 158 -9.862 19.586 -9.594 843 HB3 ASP 158 1HB ASP 158 -8.580 18.377 -9.543 844 H VAL 159 H VAL 159 -11.175 15.866 -8.172 845 HA VAL 159 HA VAL 159 -8.700 14.446 -7.274 846 HB VAL 159 HB VAL 159 -10.054 12.986 -5.852 847 HG11 VAL 159 1HG1 VAL 159 -10.064 14.460 -4.103 848 HG12 VAL 159 2HG1 VAL 159 -11.024 15.650 -4.981 849 HG13 VAL 159 3HG1 VAL 159 -9.291 15.526 -5.276 850 HG21 VAL 159 1HG2 VAL 159 -12.235 12.786 -6.421 851 HG22 VAL 159 2HG2 VAL 159 -12.211 14.297 -7.326 852 HG23 VAL 159 3HG2 VAL 159 -12.487 14.318 -5.586 853 H LEU 160 H LEU 160 -8.419 12.358 -8.058 854 HA LEU 160 HA LEU 160 -10.336 11.420 -10.155 855 HB2 LEU 160 2HB LEU 160 -7.348 11.702 -10.245 856 HB3 LEU 160 1HB LEU 160 -8.126 10.440 -11.192 857 HG LEU 160 HG LEU 160 -9.611 12.195 -12.201 858 HD11 LEU 160 1HD1 LEU 160 -9.718 14.125 -11.016 859 HD12 LEU 160 2HD1 LEU 160 -8.212 14.542 -11.833 860 HD13 LEU 160 3HD1 LEU 160 -8.174 13.827 -10.223 861 HD21 LEU 160 1HD2 LEU 160 -8.037 12.805 -13.821 862 HD22 LEU 160 2HD2 LEU 160 -7.263 11.406 -13.078 863 HD23 LEU 160 3HD2 LEU 160 -6.757 13.035 -12.631 864 H LEU 161 H LEU 161 -10.546 9.087 -10.228 865 HA LEU 161 HA LEU 161 -9.050 7.609 -8.116 866 HB2 LEU 161 2HB LEU 161 -11.303 8.362 -7.258 867 HB3 LEU 161 1HB LEU 161 -12.037 7.338 -8.494 868 HG LEU 161 HG LEU 161 -10.326 5.551 -7.444 869 HD11 LEU 161 1HD1 LEU 161 -9.461 7.210 -5.802 870 HD12 LEU 161 2HD1 LEU 161 -10.206 5.819 -5.017 871 HD13 LEU 161 3HD1 LEU 161 -11.081 7.347 -5.119 872 HD21 LEU 161 1HD2 LEU 161 -12.240 4.787 -6.028 873 HD22 LEU 161 2HD2 LEU 161 -12.728 5.216 -7.668 874 HD23 LEU 161 3HD2 LEU 161 -13.040 6.329 -6.335 875 H HIS 162 H HIS 162 -8.116 7.073 -10.466 876 HA HIS 162 HA HIS 162 -9.667 5.187 -12.045 877 HB2 HIS 162 2HB HIS 162 -6.686 5.759 -11.955 878 HB3 HIS 162 1HB HIS 162 -7.461 4.707 -13.141 879 HD1 HIS 162 1HD HIS 162 -6.046 7.203 -14.177 880 HD2 HIS 162 2HD HIS 162 -10.076 7.175 -13.096 881 HE1 HIS 162 1HE HIS 162 -7.131 9.142 -15.397 882 HE2 HIS 162 2HE HIS 162 -9.582 9.134 -14.744 883 H ARG 163 H ARG 163 -9.438 2.870 -12.032 884 HA ARG 163 HA ARG 163 -8.159 1.807 -9.540 885 HB2 ARG 163 2HB ARG 163 -10.581 0.810 -11.058 886 HB3 ARG 163 1HB ARG 163 -9.854 -0.018 -9.679 887 HG2 ARG 163 2HG ARG 163 -10.208 2.048 -8.313 888 HG3 ARG 163 1HG ARG 163 -11.059 2.764 -9.682 889 HD2 ARG 163 2HD ARG 163 -11.847 0.229 -8.217 890 HD3 ARG 163 1HD ARG 163 -12.677 1.782 -8.130 891 HE ARG 163 HE ARG 163 -12.637 1.133 -10.847 892 HH11 ARG 163 1HH1 ARG 163 -14.356 0.033 -11.817 893 HH12 ARG 163 2HH1 ARG 163 -15.402 -0.946 -10.844 894 HH21 ARG 163 1HH2 ARG 163 -13.719 -0.267 -7.888 895 HH22 ARG 163 2HH2 ARG 163 -15.041 -1.116 -8.619 896 H THR 164 H THR 164 -7.177 -0.304 -9.670 897 HA THR 164 HA THR 164 -5.726 -0.757 -12.142 898 HB THR 164 HB THR 164 -5.913 -2.389 -9.599 899 HG1 THR 164 1HG THR 164 -4.353 -0.293 -10.530 900 HG21 THR 164 1HG2 THR 164 -3.554 -3.055 -10.850 901 HG22 THR 164 2HG2 THR 164 -4.671 -2.923 -12.207 902 HG23 THR 164 3HG2 THR 164 -5.023 -4.030 -10.881 903 H HIS 165 H HIS 165 -6.113 -2.304 -13.707 904 HA HIS 165 HA HIS 165 -8.561 -3.992 -13.335 905 HB2 HIS 165 2HB HIS 165 -8.866 -2.239 -15.050 906 HB3 HIS 165 1HB HIS 165 -7.433 -2.823 -15.898 907 HD1 HIS 165 1HD HIS 165 -7.655 -4.970 -17.286 908 HD2 HIS 165 2HD HIS 165 -11.131 -4.024 -15.183 909 HE1 HIS 165 1HE HIS 165 -9.466 -6.509 -18.164 910 HE2 HIS 165 2HE HIS 165 -11.586 -5.942 -16.892 911 H ASP 166 H ASP 166 -8.238 -6.164 -13.519 912 HA ASP 166 HA ASP 166 -5.526 -7.098 -14.238 913 HB2 ASP 166 2HB ASP 166 -7.919 -8.522 -13.040 914 HB3 ASP 166 1HB ASP 166 -6.379 -9.305 -13.392
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