NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15973 | 1z7t | 6600 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H THR 2 H1 THR 2 4.136 -1.961 1.406 2 2H THR 2 H2 THR 2 3.670 -0.460 0.888 3 3H THR 2 H3 THR 2 2.636 -1.739 0.762 4 HA THR 2 HA THR 2 3.799 -1.011 -1.323 5 HB THR 2 HB THR 2 6.087 -2.283 -1.441 6 HG1 THR 2 HG1 THR 2 7.163 -2.423 0.480 7 1HG2 THR 2 HG21 THR 2 5.964 0.317 0.135 8 2HG2 THR 2 HG22 THR 2 7.330 -0.306 -0.807 9 3HG2 THR 2 HG23 THR 2 5.848 0.183 -1.638 10 H VAL 3 H VAL 3 4.178 -2.610 -3.034 11 HA VAL 3 HA VAL 3 3.639 -5.433 -2.399 12 HB VAL 3 HB VAL 3 2.205 -3.879 -4.602 13 1HG1 VAL 3 HG11 VAL 3 2.727 -6.155 -5.352 14 2HG1 VAL 3 HG12 VAL 3 2.031 -6.831 -3.863 15 3HG1 VAL 3 HG13 VAL 3 1.004 -5.996 -5.055 16 1HG2 VAL 3 HG21 VAL 3 1.110 -3.435 -2.460 17 2HG2 VAL 3 HG22 VAL 3 0.103 -4.518 -3.418 18 3HG2 VAL 3 HG23 VAL 3 1.093 -5.171 -2.085 19 H SER 4 H SER 4 4.832 -6.738 -3.927 20 HA SER 4 HA SER 4 6.831 -5.302 -5.602 21 1HB SER 4 HB2 SER 4 7.377 -7.434 -3.502 22 2HB SER 4 HB3 SER 4 8.586 -6.587 -4.479 23 HG SER 4 HG SER 4 8.341 -5.730 -2.329 24 H ILE 5 H ILE 5 8.063 -6.720 -6.951 25 HA ILE 5 HA ILE 5 6.542 -8.945 -8.117 26 HB ILE 5 HB ILE 5 9.314 -7.853 -8.784 27 1HG1 ILE 5 HG12 ILE 5 7.805 -6.002 -9.091 28 2HG1 ILE 5 HG13 ILE 5 8.204 -6.654 -10.660 29 1HG2 ILE 5 HG21 ILE 5 7.395 -9.615 -10.381 30 2HG2 ILE 5 HG22 ILE 5 8.861 -8.864 -11.039 31 3HG2 ILE 5 HG23 ILE 5 9.001 -10.047 -9.757 32 1HD1 ILE 5 HD11 ILE 5 5.857 -6.072 -10.566 33 2HD1 ILE 5 HD12 ILE 5 6.021 -7.819 -10.782 34 3HD1 ILE 5 HD13 ILE 5 5.602 -7.148 -9.185 35 H GLN 6 H GLN 6 7.564 -11.100 -8.255 36 HA GLN 6 HA GLN 6 9.126 -11.781 -5.805 37 1HB GLN 6 HB2 GLN 6 7.511 -13.560 -5.365 38 2HB GLN 6 HB3 GLN 6 6.745 -11.979 -5.402 39 1HG GLN 6 HG2 GLN 6 6.121 -12.535 -7.880 40 2HG GLN 6 HG3 GLN 6 6.572 -14.192 -7.483 41 1HE2 GLN 6 HE22 GLN 6 4.464 -11.442 -6.509 42 2HE2 GLN 6 HE21 GLN 6 3.157 -12.431 -5.907 43 H MET 7 H MET 7 9.675 -11.661 -8.880 44 HA MET 7 HA MET 7 11.311 -14.044 -9.019 45 1HB MET 7 HB2 MET 7 10.360 -14.846 -11.123 46 2HB MET 7 HB3 MET 7 9.159 -14.951 -9.844 47 1HG MET 7 HG2 MET 7 9.296 -12.715 -11.898 48 2HG MET 7 HG3 MET 7 8.322 -14.163 -12.078 49 1HE MET 7 HE1 MET 7 6.268 -14.797 -10.439 50 2HE MET 7 HE2 MET 7 5.097 -13.459 -10.325 51 3HE MET 7 HE3 MET 7 5.816 -13.865 -11.892 52 H ALA 8 H ALA 8 12.771 -13.840 -10.947 53 HA ALA 8 HA ALA 8 13.344 -11.034 -11.645 54 1HB ALA 8 HB1 ALA 8 15.297 -11.984 -12.764 55 2HB ALA 8 HB2 ALA 8 15.181 -12.577 -11.089 56 3HB ALA 8 HB3 ALA 8 14.704 -13.630 -12.448 57 H GLY 9 H GLY 9 12.925 -10.063 -13.628 58 1HA GLY 9 HA2 GLY 9 12.618 -11.411 -16.065 59 2HA GLY 9 HA3 GLY 9 11.003 -11.301 -15.373 60 H ASN 10 H ASN 10 10.296 -9.892 -17.030 61 HA ASN 10 HA ASN 10 11.143 -7.043 -16.692 62 1HB ASN 10 HB2 ASN 10 10.924 -8.631 -19.262 63 2HB ASN 10 HB3 ASN 10 10.388 -6.956 -19.235 64 1HD2 ASN 10 HD22 ASN 10 13.205 -7.970 -17.219 65 2HD2 ASN 10 HD21 ASN 10 14.375 -7.169 -18.245 66 H LEU 11 H LEU 11 9.386 -5.711 -16.518 67 HA LEU 11 HA LEU 11 6.966 -7.076 -15.750 68 1HB LEU 11 HB2 LEU 11 8.184 -5.243 -14.503 69 2HB LEU 11 HB3 LEU 11 7.594 -4.109 -15.708 70 HG LEU 11 HG LEU 11 5.231 -4.772 -15.088 71 1HD1 LEU 11 HD11 LEU 11 6.659 -6.413 -12.944 72 2HD1 LEU 11 HD12 LEU 11 4.946 -5.954 -12.867 73 3HD1 LEU 11 HD13 LEU 11 5.508 -7.009 -14.157 74 1HD2 LEU 11 HD21 LEU 11 7.014 -3.839 -12.791 75 2HD2 LEU 11 HD22 LEU 11 6.385 -2.823 -14.113 76 3HD2 LEU 11 HD23 LEU 11 5.270 -3.551 -12.955 77 H TRP 12 H TRP 12 6.463 -7.825 -17.904 78 HA TRP 12 HA TRP 12 6.041 -6.872 -20.259 79 1HB TRP 12 HB2 TRP 12 5.251 -9.077 -19.210 80 2HB TRP 12 HB3 TRP 12 3.729 -8.275 -18.888 81 HD1 TRP 12 HD1 TRP 12 6.014 -9.117 -21.828 82 HE1 TRP 12 HE1 TRP 12 4.644 -9.696 -23.903 83 HE3 TRP 12 HE3 TRP 12 1.362 -8.141 -19.973 84 HZ2 TRP 12 HZ2 TRP 12 1.836 -9.775 -24.648 85 HZ3 TRP 12 HZ3 TRP 12 -0.655 -8.534 -21.361 86 HH2 TRP 12 HH2 TRP 12 -0.429 -9.343 -23.701 87 H LYS 13 H LYS 13 3.363 -6.295 -17.881 88 HA LYS 13 HA LYS 13 2.883 -3.646 -19.028 89 1HB LYS 13 HB2 LYS 13 0.768 -5.849 -19.030 90 2HB LYS 13 HB3 LYS 13 0.383 -4.129 -19.144 91 1HG LYS 13 HG2 LYS 13 1.794 -3.986 -21.222 92 2HG LYS 13 HG3 LYS 13 1.998 -5.746 -21.149 93 1HD LYS 13 HD2 LYS 13 -0.516 -5.980 -21.222 94 2HD LYS 13 HD3 LYS 13 -0.620 -4.223 -21.467 95 1HE LYS 13 HE2 LYS 13 0.825 -4.452 -23.501 96 2HE LYS 13 HE3 LYS 13 0.866 -6.204 -23.258 97 1HZ LYS 13 HZ1 LYS 13 -0.804 -5.574 -24.879 98 2HZ LYS 13 HZ2 LYS 13 -1.545 -6.233 -23.587 99 3HZ LYS 13 HZ3 LYS 13 -1.574 -4.613 -23.816 100 H VAL 14 H VAL 14 1.358 -2.424 -17.600 101 HA VAL 14 HA VAL 14 0.954 -3.497 -14.883 102 HB VAL 14 HB VAL 14 2.193 -0.764 -15.484 103 1HG1 VAL 14 HG11 VAL 14 2.476 -0.647 -12.993 104 2HG1 VAL 14 HG12 VAL 14 0.786 -0.663 -13.479 105 3HG1 VAL 14 HG13 VAL 14 1.538 -2.142 -12.830 106 1HG2 VAL 14 HG21 VAL 14 4.180 -1.653 -14.244 107 2HG2 VAL 14 HG22 VAL 14 3.420 -3.267 -14.280 108 3HG2 VAL 14 HG23 VAL 14 3.916 -2.463 -15.786 109 H HIS 15 H HIS 15 -0.984 -2.660 -14.007 110 HA HIS 15 HA HIS 15 -2.691 -1.223 -15.997 111 1HB HIS 15 HB2 HIS 15 -3.686 -3.204 -13.960 112 2HB HIS 15 HB3 HIS 15 -4.432 -2.704 -15.474 113 HD1 HIS 15 HD1 HIS 15 -2.235 -3.465 -17.598 114 HD2 HIS 15 HD2 HIS 15 -3.014 -5.650 -14.091 115 HE1 HIS 15 HE1 HIS 15 -1.177 -5.771 -17.924 116 H VAL 16 H VAL 16 -1.538 -1.166 -12.698 117 HA VAL 16 HA VAL 16 -3.690 0.506 -11.671 118 HB VAL 16 HB VAL 16 -2.097 0.858 -9.775 119 1HG1 VAL 16 HG11 VAL 16 -3.810 -0.876 -9.709 120 2HG1 VAL 16 HG12 VAL 16 -2.706 -2.034 -10.477 121 3HG1 VAL 16 HG13 VAL 16 -2.345 -1.377 -8.857 122 1HG2 VAL 16 HG21 VAL 16 0.026 0.432 -11.136 123 2HG2 VAL 16 HG22 VAL 16 -0.078 -0.294 -9.539 124 3HG2 VAL 16 HG23 VAL 16 -0.339 -1.302 -10.983 125 H LYS 17 H LYS 17 -3.239 2.611 -10.726 126 HA LYS 17 HA LYS 17 -1.087 4.225 -11.760 127 1HB LYS 17 HB2 LYS 17 -2.536 6.071 -12.484 128 2HB LYS 17 HB3 LYS 17 -2.754 4.662 -13.517 129 1HG LYS 17 HG2 LYS 17 -4.860 4.095 -12.403 130 2HG LYS 17 HG3 LYS 17 -4.662 5.406 -11.241 131 1HD LYS 17 HD2 LYS 17 -4.974 5.743 -14.249 132 2HD LYS 17 HD3 LYS 17 -6.272 5.922 -13.077 133 1HE LYS 17 HE2 LYS 17 -3.762 7.662 -13.200 134 2HE LYS 17 HE3 LYS 17 -5.335 8.087 -13.866 135 1HZ LYS 17 HZ1 LYS 17 -5.059 9.096 -11.731 136 2HZ LYS 17 HZ2 LYS 17 -6.245 7.990 -11.607 137 3HZ LYS 17 HZ3 LYS 17 -4.755 7.684 -10.979 138 H ALA 18 H ALA 18 -0.984 6.213 -10.334 139 HA ALA 18 HA ALA 18 -1.680 5.759 -7.614 140 1HB ALA 18 HB1 ALA 18 0.064 7.369 -8.303 141 2HB ALA 18 HB2 ALA 18 -1.177 8.399 -9.061 142 3HB ALA 18 HB3 ALA 18 -1.173 8.154 -7.302 143 H GLY 19 H GLY 19 -3.486 6.265 -6.435 144 1HA GLY 19 HA2 GLY 19 -5.553 7.160 -5.921 145 2HA GLY 19 HA3 GLY 19 -5.704 7.826 -7.553 146 H ASP 20 H ASP 20 -4.838 4.686 -8.219 147 HA ASP 20 HA ASP 20 -7.570 3.848 -8.747 148 1HB ASP 20 HB2 ASP 20 -5.566 3.289 -10.174 149 2HB ASP 20 HB3 ASP 20 -5.010 2.213 -8.883 150 H GLN 21 H GLN 21 -8.313 1.645 -7.979 151 HA GLN 21 HA GLN 21 -7.720 1.206 -5.073 152 1HB GLN 21 HB2 GLN 21 -10.035 1.955 -5.458 153 2HB GLN 21 HB3 GLN 21 -10.227 0.781 -6.752 154 1HG GLN 21 HG2 GLN 21 -11.410 -0.121 -4.959 155 2HG GLN 21 HG3 GLN 21 -9.951 -1.078 -5.026 156 1HE2 GLN 21 HE22 GLN 21 -8.823 -1.320 -3.021 157 2HE2 GLN 21 HE21 GLN 21 -9.154 -0.313 -1.634 158 H ILE 22 H ILE 22 -6.957 -0.804 -4.568 159 HA ILE 22 HA ILE 22 -7.403 -2.992 -6.506 160 HB ILE 22 HB ILE 22 -5.267 -3.930 -6.182 161 1HG1 ILE 22 HG12 ILE 22 -4.618 -1.648 -4.272 162 2HG1 ILE 22 HG13 ILE 22 -4.774 -3.363 -3.879 163 1HG2 ILE 22 HG21 ILE 22 -4.835 -0.995 -6.849 164 2HG2 ILE 22 HG22 ILE 22 -3.872 -2.375 -7.400 165 3HG2 ILE 22 HG23 ILE 22 -5.534 -2.192 -7.953 166 1HD1 ILE 22 HD11 ILE 22 -2.577 -1.985 -5.437 167 2HD1 ILE 22 HD12 ILE 22 -2.455 -3.015 -3.989 168 3HD1 ILE 22 HD13 ILE 22 -2.818 -3.733 -5.561 169 H GLU 23 H GLU 23 -7.356 -5.119 -5.471 170 HA GLU 23 HA GLU 23 -8.131 -5.144 -2.636 171 1HB GLU 23 HB2 GLU 23 -10.192 -4.869 -3.945 172 2HB GLU 23 HB3 GLU 23 -9.765 -6.270 -4.943 173 1HG GLU 23 HG2 GLU 23 -9.890 -7.730 -2.941 174 2HG GLU 23 HG3 GLU 23 -10.242 -6.327 -1.929 175 H LYS 24 H LYS 24 -7.489 -7.191 -1.706 176 HA LYS 24 HA LYS 24 -5.208 -8.366 -2.747 177 1HB LYS 24 HB2 LYS 24 -6.012 -8.571 -0.410 178 2HB LYS 24 HB3 LYS 24 -7.267 -9.702 -0.939 179 1HG LYS 24 HG2 LYS 24 -5.576 -11.326 -1.654 180 2HG LYS 24 HG3 LYS 24 -4.283 -10.155 -1.388 181 1HD LYS 24 HD2 LYS 24 -4.298 -11.756 0.420 182 2HD LYS 24 HD3 LYS 24 -4.758 -10.168 1.048 183 1HE LYS 24 HE2 LYS 24 -7.154 -10.839 0.991 184 2HE LYS 24 HE3 LYS 24 -6.704 -12.408 0.312 185 1HZ LYS 24 HZ1 LYS 24 -7.057 -12.541 2.693 186 2HZ LYS 24 HZ2 LYS 24 -5.498 -12.875 2.365 187 3HZ LYS 24 HZ3 LYS 24 -5.912 -11.423 2.994 188 H GLY 25 H GLY 25 -4.759 -9.668 -4.432 189 1HA GLY 25 HA2 GLY 25 -4.980 -11.523 -5.809 190 2HA GLY 25 HA3 GLY 25 -6.658 -11.738 -5.307 191 H GLN 26 H GLN 26 -6.649 -8.506 -6.075 192 HA GLN 26 HA GLN 26 -7.744 -8.804 -8.731 193 1HB GLN 26 HB2 GLN 26 -8.274 -6.974 -7.067 194 2HB GLN 26 HB3 GLN 26 -6.639 -6.338 -7.307 195 1HG GLN 26 HG2 GLN 26 -7.191 -5.980 -9.729 196 2HG GLN 26 HG3 GLN 26 -8.835 -6.538 -9.413 197 1HE2 GLN 26 HE22 GLN 26 -6.951 -3.762 -9.680 198 2HE2 GLN 26 HE21 GLN 26 -7.892 -2.668 -8.677 199 H GLU 27 H GLU 27 -6.649 -8.456 -10.716 200 HA GLU 27 HA GLU 27 -3.789 -8.873 -10.801 201 1HB GLU 27 HB2 GLU 27 -5.480 -9.656 -12.494 202 2HB GLU 27 HB3 GLU 27 -5.711 -7.975 -12.989 203 1HG GLU 27 HG2 GLU 27 -3.314 -7.863 -13.657 204 2HG GLU 27 HG3 GLU 27 -3.077 -9.516 -13.090 205 H VAL 28 H VAL 28 -2.176 -7.408 -11.234 206 HA VAL 28 HA VAL 28 -2.813 -4.491 -11.120 207 HB VAL 28 HB VAL 28 -0.989 -6.231 -9.412 208 1HG1 VAL 28 HG11 VAL 28 -0.048 -4.310 -8.350 209 2HG1 VAL 28 HG12 VAL 28 0.286 -4.180 -10.083 210 3HG1 VAL 28 HG13 VAL 28 -0.993 -3.201 -9.366 211 1HG2 VAL 28 HG21 VAL 28 -3.295 -5.979 -8.580 212 2HG2 VAL 28 HG22 VAL 28 -2.177 -5.091 -7.541 213 3HG2 VAL 28 HG23 VAL 28 -3.182 -4.222 -8.721 214 H ALA 29 H ALA 29 -0.526 -7.115 -12.110 215 HA ALA 29 HA ALA 29 0.313 -5.517 -14.386 216 1HB ALA 29 HB1 ALA 29 1.859 -4.646 -12.645 217 2HB ALA 29 HB2 ALA 29 2.329 -6.297 -12.209 218 3HB ALA 29 HB3 ALA 29 2.741 -5.646 -13.802 219 H ILE 30 H ILE 30 2.172 -6.894 -15.492 220 HA ILE 30 HA ILE 30 1.783 -9.802 -15.118 221 HB ILE 30 HB ILE 30 1.498 -8.275 -17.739 222 1HG1 ILE 30 HG12 ILE 30 -0.392 -10.280 -16.416 223 2HG1 ILE 30 HG13 ILE 30 -0.576 -8.534 -16.329 224 1HG2 ILE 30 HG21 ILE 30 1.730 -11.299 -17.337 225 2HG2 ILE 30 HG22 ILE 30 1.401 -10.486 -18.882 226 3HG2 ILE 30 HG23 ILE 30 2.953 -10.272 -18.114 227 1HD1 ILE 30 HD11 ILE 30 -0.812 -8.413 -18.795 228 2HD1 ILE 30 HD12 ILE 30 -0.799 -10.195 -18.855 229 3HD1 ILE 30 HD13 ILE 30 -2.081 -9.346 -17.986 230 H LEU 31 H LEU 31 3.672 -10.880 -15.480 231 HA LEU 31 HA LEU 31 6.167 -9.297 -15.923 232 1HB LEU 31 HB2 LEU 31 5.885 -9.892 -13.629 233 2HB LEU 31 HB3 LEU 31 5.408 -11.550 -14.010 234 HG LEU 31 HG LEU 31 7.626 -11.147 -12.943 235 1HD1 LEU 31 HD11 LEU 31 8.816 -12.874 -14.158 236 2HD1 LEU 31 HD12 LEU 31 7.101 -13.284 -14.000 237 3HD1 LEU 31 HD13 LEU 31 7.736 -12.709 -15.549 238 1HD2 LEU 31 HD21 LEU 31 9.474 -10.334 -14.050 239 2HD2 LEU 31 HD22 LEU 31 8.697 -10.397 -15.646 240 3HD2 LEU 31 HD23 LEU 31 8.194 -9.178 -14.458 241 H GLU 32 H GLU 32 7.514 -10.127 -17.487 242 HA GLU 32 HA GLU 32 6.766 -12.667 -18.847 243 1HB GLU 32 HB2 GLU 32 6.733 -10.659 -20.279 244 2HB GLU 32 HB3 GLU 32 8.388 -10.264 -19.796 245 1HG GLU 32 HG2 GLU 32 9.125 -12.480 -20.783 246 2HG GLU 32 HG3 GLU 32 7.473 -12.730 -21.342 247 H SER 33 H SER 33 8.128 -14.335 -18.441 248 HA SER 33 HA SER 33 10.947 -14.107 -18.244 249 1HB SER 33 HB2 SER 33 10.230 -13.280 -15.911 250 2HB SER 33 HB3 SER 33 9.607 -14.907 -15.618 251 HG SER 33 HG SER 33 11.863 -14.241 -15.007 252 H MET 34 H MET 34 11.828 -16.393 -17.727 253 HA MET 34 HA MET 34 11.890 -18.598 -18.291 254 1HB MET 34 HB2 MET 34 9.134 -18.603 -16.999 255 2HB MET 34 HB3 MET 34 10.187 -20.000 -17.190 256 1HG MET 34 HG2 MET 34 11.790 -19.168 -15.649 257 2HG MET 34 HG3 MET 34 11.080 -17.558 -15.613 258 1HE MET 34 HE1 MET 34 8.092 -17.690 -15.145 259 2HE MET 34 HE2 MET 34 7.985 -17.797 -13.378 260 3HE MET 34 HE3 MET 34 9.194 -16.737 -14.128 261 H LYS 35 H LYS 35 10.941 -16.862 -20.402 262 HA LYS 35 HA LYS 35 9.862 -16.735 -22.366 263 1HB LYS 35 HB2 LYS 35 10.176 -19.761 -22.392 264 2HB LYS 35 HB3 LYS 35 9.834 -18.734 -23.788 265 1HG LYS 35 HG2 LYS 35 11.989 -17.537 -23.442 266 2HG LYS 35 HG3 LYS 35 12.367 -18.630 -22.094 267 1HD LYS 35 HD2 LYS 35 12.254 -20.573 -23.629 268 2HD LYS 35 HD3 LYS 35 11.885 -19.480 -24.984 269 1HE LYS 35 HE2 LYS 35 14.046 -18.305 -24.616 270 2HE LYS 35 HE3 LYS 35 14.414 -19.394 -23.273 271 1HZ LYS 35 HZ1 LYS 35 14.077 -20.227 -26.097 272 2HZ LYS 35 HZ2 LYS 35 15.495 -20.102 -25.307 273 3HZ LYS 35 HZ3 LYS 35 14.417 -21.235 -24.855 274 H MET 36 H MET 36 8.139 -16.696 -20.092 275 HA MET 36 HA MET 36 5.570 -17.402 -21.357 276 1HB MET 36 HB2 MET 36 6.458 -18.146 -18.524 277 2HB MET 36 HB3 MET 36 4.781 -18.172 -19.074 278 1HG MET 36 HG2 MET 36 5.353 -19.843 -20.800 279 2HG MET 36 HG3 MET 36 7.019 -19.869 -20.216 280 1HE MET 36 HE1 MET 36 5.740 -23.367 -19.100 281 2HE MET 36 HE2 MET 36 5.336 -22.490 -20.592 282 3HE MET 36 HE3 MET 36 7.000 -22.458 -19.964 283 H GLU 37 H GLU 37 3.803 -16.327 -19.893 284 HA GLU 37 HA GLU 37 4.774 -13.796 -18.693 285 1HB GLU 37 HB2 GLU 37 2.189 -14.139 -20.266 286 2HB GLU 37 HB3 GLU 37 2.684 -12.728 -19.344 287 1HG GLU 37 HG2 GLU 37 3.203 -12.095 -21.503 288 2HG GLU 37 HG3 GLU 37 4.759 -12.601 -20.860 289 H ILE 38 H ILE 38 3.803 -13.328 -16.733 290 HA ILE 38 HA ILE 38 2.105 -15.421 -15.485 291 HB ILE 38 HB ILE 38 4.647 -14.141 -14.358 292 1HG1 ILE 38 HG12 ILE 38 5.213 -16.790 -14.291 293 2HG1 ILE 38 HG13 ILE 38 4.161 -16.805 -15.693 294 1HG2 ILE 38 HG21 ILE 38 3.011 -14.581 -12.587 295 2HG2 ILE 38 HG22 ILE 38 2.795 -16.251 -13.166 296 3HG2 ILE 38 HG23 ILE 38 4.339 -15.723 -12.470 297 1HD1 ILE 38 HD11 ILE 38 5.722 -15.022 -16.717 298 2HD1 ILE 38 HD12 ILE 38 6.759 -15.253 -15.302 299 3HD1 ILE 38 HD13 ILE 38 6.461 -16.597 -16.416 300 HA PRO 39 HA PRO 39 0.105 -11.501 -14.420 301 1HB PRO 39 HB2 PRO 39 -1.874 -12.394 -12.750 302 2HB PRO 39 HB3 PRO 39 -1.921 -12.619 -14.527 303 1HG PRO 39 HG2 PRO 39 -1.029 -14.608 -12.421 304 2HG PRO 39 HG3 PRO 39 -2.132 -14.881 -13.807 305 1HD PRO 39 HD2 PRO 39 0.524 -15.529 -13.890 306 2HD PRO 39 HD3 PRO 39 -0.341 -14.932 -15.339 307 H ILE 40 H ILE 40 0.174 -10.059 -12.696 308 HA ILE 40 HA ILE 40 1.332 -10.970 -10.105 309 HB ILE 40 HB ILE 40 1.851 -8.391 -11.613 310 1HG1 ILE 40 HG12 ILE 40 3.092 -10.199 -12.694 311 2HG1 ILE 40 HG13 ILE 40 4.123 -8.996 -11.954 312 1HG2 ILE 40 HG21 ILE 40 1.861 -7.939 -9.250 313 2HG2 ILE 40 HG22 ILE 40 2.881 -9.355 -8.920 314 3HG2 ILE 40 HG23 ILE 40 3.532 -7.967 -9.809 315 1HD1 ILE 40 HD11 ILE 40 4.952 -11.289 -11.619 316 2HD1 ILE 40 HD12 ILE 40 4.629 -10.493 -10.075 317 3HD1 ILE 40 HD13 ILE 40 3.490 -11.706 -10.710 318 H VAL 41 H VAL 41 0.161 -10.289 -8.387 319 HA VAL 41 HA VAL 41 -2.309 -8.722 -8.906 320 HB VAL 41 HB VAL 41 -3.347 -10.320 -7.219 321 1HG1 VAL 41 HG11 VAL 41 -3.934 -10.559 -9.525 322 2HG1 VAL 41 HG12 VAL 41 -2.444 -11.465 -9.891 323 3HG1 VAL 41 HG13 VAL 41 -3.705 -12.162 -8.848 324 1HG2 VAL 41 HG21 VAL 41 -2.380 -12.495 -6.845 325 2HG2 VAL 41 HG22 VAL 41 -0.978 -12.124 -7.861 326 3HG2 VAL 41 HG23 VAL 41 -1.215 -11.277 -6.309 327 H ALA 42 H ALA 42 -3.291 -7.825 -6.981 328 HA ALA 42 HA ALA 42 -1.491 -6.420 -5.245 329 1HB ALA 42 HB1 ALA 42 -3.505 -5.705 -4.096 330 2HB ALA 42 HB2 ALA 42 -3.856 -5.720 -5.844 331 3HB ALA 42 HB3 ALA 42 -4.440 -7.028 -4.810 332 H ASP 43 H ASP 43 -0.373 -7.298 -3.566 333 HA ASP 43 HA ASP 43 -0.994 -9.856 -2.389 334 1HB ASP 43 HB2 ASP 43 1.288 -8.970 -2.479 335 2HB ASP 43 HB3 ASP 43 0.820 -7.586 -1.489 336 H ARG 44 H ARG 44 -2.143 -6.604 -1.801 337 HA ARG 44 HA ARG 44 -4.021 -7.545 0.166 338 1HB ARG 44 HB2 ARG 44 -3.526 -5.977 1.912 339 2HB ARG 44 HB3 ARG 44 -2.130 -7.003 1.681 340 1HG ARG 44 HG2 ARG 44 -2.390 -4.182 0.530 341 2HG ARG 44 HG3 ARG 44 -1.709 -4.530 2.112 342 1HD ARG 44 HD2 ARG 44 -0.587 -5.393 -0.573 343 2HD ARG 44 HD3 ARG 44 0.067 -4.157 0.482 344 HE ARG 44 HE ARG 44 0.356 -7.063 0.732 345 1HH1 ARG 44 HH21 ARG 44 0.651 -4.026 2.586 346 2HH1 ARG 44 HH22 ARG 44 1.774 -4.705 3.704 347 1HH2 ARG 44 HH11 ARG 44 1.739 -7.896 2.090 348 2HH2 ARG 44 HH12 ARG 44 2.432 -7.015 3.440 349 H SER 45 H SER 45 -5.743 -5.920 0.472 350 HA SER 45 HA SER 45 -6.273 -4.331 -1.843 351 1HB SER 45 HB2 SER 45 -7.607 -4.235 0.897 352 2HB SER 45 HB3 SER 45 -8.337 -3.842 -0.669 353 HG SER 45 HG SER 45 -8.828 -5.983 0.214 354 H GLY 46 H GLY 46 -6.549 -1.990 -1.941 355 1HA GLY 46 HA2 GLY 46 -6.369 -0.166 0.088 356 2HA GLY 46 HA3 GLY 46 -4.679 -0.398 -0.375 357 H ILE 47 H ILE 47 -5.386 2.069 -0.745 358 HA ILE 47 HA ILE 47 -6.218 2.456 -3.577 359 HB ILE 47 HB ILE 47 -5.581 4.428 -1.340 360 1HG1 ILE 47 HG12 ILE 47 -7.782 3.371 -1.043 361 2HG1 ILE 47 HG13 ILE 47 -7.905 5.084 -1.392 362 1HG2 ILE 47 HG21 ILE 47 -6.376 6.195 -2.934 363 2HG2 ILE 47 HG22 ILE 47 -4.841 5.453 -3.384 364 3HG2 ILE 47 HG23 ILE 47 -6.325 4.985 -4.235 365 1HD1 ILE 47 HD11 ILE 47 -9.637 3.818 -2.569 366 2HD1 ILE 47 HD12 ILE 47 -8.558 4.586 -3.738 367 3HD1 ILE 47 HD13 ILE 47 -8.411 2.845 -3.401 368 H VAL 48 H VAL 48 -4.629 2.852 -5.070 369 HA VAL 48 HA VAL 48 -1.863 2.264 -4.433 370 HB VAL 48 HB VAL 48 -3.084 3.395 -6.952 371 1HG1 VAL 48 HG11 VAL 48 -0.592 3.583 -6.837 372 2HG1 VAL 48 HG12 VAL 48 -0.478 1.847 -6.469 373 3HG1 VAL 48 HG13 VAL 48 -1.108 2.395 -8.039 374 1HG2 VAL 48 HG21 VAL 48 -2.596 0.489 -6.153 375 2HG2 VAL 48 HG22 VAL 48 -4.177 1.256 -6.419 376 3HG2 VAL 48 HG23 VAL 48 -3.076 1.060 -7.771 377 H LYS 49 H LYS 49 -0.724 3.685 -3.233 378 HA LYS 49 HA LYS 49 -1.296 6.561 -3.288 379 1HB LYS 49 HB2 LYS 49 -0.637 5.416 -1.187 380 2HB LYS 49 HB3 LYS 49 0.896 4.933 -1.915 381 1HG LYS 49 HG2 LYS 49 1.232 6.802 -0.428 382 2HG LYS 49 HG3 LYS 49 1.575 7.305 -2.083 383 1HD LYS 49 HD2 LYS 49 -0.630 8.451 -2.207 384 2HD LYS 49 HD3 LYS 49 -1.053 7.817 -0.613 385 1HE LYS 49 HE2 LYS 49 -0.406 10.101 -0.333 386 2HE LYS 49 HE3 LYS 49 0.842 9.088 0.392 387 1HZ LYS 49 HZ1 LYS 49 1.024 10.376 -2.277 388 2HZ LYS 49 HZ2 LYS 49 1.769 10.894 -0.927 389 3HZ LYS 49 HZ3 LYS 49 2.203 9.471 -1.585 390 H GLU 50 H GLU 50 1.194 4.234 -4.527 391 HA GLU 50 HA GLU 50 1.847 6.148 -6.634 392 1HB GLU 50 HB2 GLU 50 3.261 6.791 -4.568 393 2HB GLU 50 HB3 GLU 50 4.103 5.255 -4.776 394 1HG GLU 50 HG2 GLU 50 4.883 5.946 -6.992 395 2HG GLU 50 HG3 GLU 50 3.859 7.382 -6.953 396 H VAL 51 H VAL 51 3.360 5.084 -8.247 397 HA VAL 51 HA VAL 51 3.444 2.117 -8.042 398 HB VAL 51 HB VAL 51 2.931 3.694 -10.603 399 1HG1 VAL 51 HG11 VAL 51 2.374 1.466 -11.539 400 2HG1 VAL 51 HG12 VAL 51 4.039 1.500 -10.952 401 3HG1 VAL 51 HG13 VAL 51 2.776 0.698 -9.991 402 1HG2 VAL 51 HG21 VAL 51 0.634 2.751 -10.552 403 2HG2 VAL 51 HG22 VAL 51 0.957 2.095 -8.930 404 3HG2 VAL 51 HG23 VAL 51 0.904 3.853 -9.204 405 H LYS 52 H LYS 52 5.459 1.320 -8.445 406 HA LYS 52 HA LYS 52 7.610 3.374 -8.581 407 1HB LYS 52 HB2 LYS 52 7.667 0.501 -7.578 408 2HB LYS 52 HB3 LYS 52 8.943 1.695 -7.380 409 1HG LYS 52 HG2 LYS 52 6.214 1.643 -6.038 410 2HG LYS 52 HG3 LYS 52 7.781 1.392 -5.295 411 1HD LYS 52 HD2 LYS 52 6.728 4.031 -6.389 412 2HD LYS 52 HD3 LYS 52 6.870 3.550 -4.695 413 1HE LYS 52 HE2 LYS 52 9.391 3.258 -5.117 414 2HE LYS 52 HE3 LYS 52 9.127 4.058 -6.673 415 1HZ LYS 52 HZ1 LYS 52 9.752 5.714 -5.123 416 2HZ LYS 52 HZ2 LYS 52 8.131 5.931 -5.328 417 3HZ LYS 52 HZ3 LYS 52 8.704 5.203 -3.984 418 H LYS 53 H LYS 53 6.161 1.356 -10.772 419 HA LYS 53 HA LYS 53 8.638 0.862 -12.319 420 1HB LYS 53 HB2 LYS 53 6.529 -1.213 -11.535 421 2HB LYS 53 HB3 LYS 53 7.710 -1.462 -12.813 422 1HG LYS 53 HG2 LYS 53 8.486 -0.968 -9.918 423 2HG LYS 53 HG3 LYS 53 8.296 -2.563 -10.659 424 1HD LYS 53 HD2 LYS 53 9.998 -2.000 -12.357 425 2HD LYS 53 HD3 LYS 53 10.248 -0.415 -11.597 426 1HE LYS 53 HE2 LYS 53 11.083 -1.442 -9.561 427 2HE LYS 53 HE3 LYS 53 10.669 -3.051 -10.129 428 1HZ LYS 53 HZ1 LYS 53 12.741 -1.277 -11.274 429 2HZ LYS 53 HZ2 LYS 53 12.931 -2.746 -10.519 430 3HZ LYS 53 HZ3 LYS 53 12.258 -2.662 -12.007 431 H LYS 54 H LYS 54 7.813 -0.192 -14.540 432 HA LYS 54 HA LYS 54 5.313 0.995 -15.469 433 1HB LYS 54 HB2 LYS 54 6.304 2.234 -17.276 434 2HB LYS 54 HB3 LYS 54 6.980 2.847 -15.770 435 1HG LYS 54 HG2 LYS 54 9.086 1.663 -16.157 436 2HG LYS 54 HG3 LYS 54 8.403 0.794 -17.527 437 1HD LYS 54 HD2 LYS 54 8.012 3.182 -18.570 438 2HD LYS 54 HD3 LYS 54 9.177 3.702 -17.346 439 1HE LYS 54 HE2 LYS 54 10.482 3.242 -19.272 440 2HE LYS 54 HE3 LYS 54 10.728 1.849 -18.215 441 1HZ LYS 54 HZ1 LYS 54 10.315 1.115 -20.454 442 2HZ LYS 54 HZ2 LYS 54 8.990 0.683 -19.589 443 3HZ LYS 54 HZ3 LYS 54 8.944 1.979 -20.583 444 H GLU 55 H GLU 55 4.981 0.322 -17.788 445 HA GLU 55 HA GLU 55 5.286 -2.434 -18.201 446 1HB GLU 55 HB2 GLU 55 5.024 -0.320 -20.388 447 2HB GLU 55 HB3 GLU 55 4.587 -2.021 -20.471 448 1HG GLU 55 HG2 GLU 55 2.508 -1.202 -20.116 449 2HG GLU 55 HG3 GLU 55 2.975 -1.360 -18.429 450 H GLY 56 H GLY 56 6.878 -3.676 -18.969 451 1HA GLY 56 HA2 GLY 56 8.666 -4.397 -20.173 452 2HA GLY 56 HA3 GLY 56 8.828 -2.790 -20.894 453 H ASP 57 H ASP 57 8.907 -2.299 -17.516 454 HA ASP 57 HA ASP 57 11.770 -1.818 -17.633 455 1HB ASP 57 HB2 ASP 57 10.207 -0.423 -16.286 456 2HB ASP 57 HB3 ASP 57 9.953 -1.793 -15.197 457 H PHE 58 H PHE 58 13.345 -2.792 -16.197 458 HA PHE 58 HA PHE 58 13.182 -5.710 -16.033 459 1HB PHE 58 HB2 PHE 58 15.316 -4.594 -16.493 460 2HB PHE 58 HB3 PHE 58 15.175 -3.658 -15.011 461 HD1 PHE 58 HD1 PHE 58 15.761 -4.601 -12.843 462 HD2 PHE 58 HD2 PHE 58 15.824 -7.051 -16.396 463 HE1 PHE 58 HE1 PHE 58 17.034 -6.346 -11.623 464 HE2 PHE 58 HE2 PHE 58 17.090 -8.794 -15.169 465 HZ PHE 58 HZ PHE 58 17.724 -8.434 -12.792 466 H VAL 59 H VAL 59 12.876 -6.934 -14.142 467 HA VAL 59 HA VAL 59 12.453 -5.553 -11.590 468 HB VAL 59 HB VAL 59 10.339 -6.939 -11.279 469 1HG1 VAL 59 HG11 VAL 59 10.195 -4.579 -13.194 470 2HG1 VAL 59 HG12 VAL 59 8.880 -5.185 -12.181 471 3HG1 VAL 59 HG13 VAL 59 10.322 -4.519 -11.417 472 1HG2 VAL 59 HG21 VAL 59 10.489 -8.327 -13.326 473 2HG2 VAL 59 HG22 VAL 59 8.959 -7.429 -13.217 474 3HG2 VAL 59 HG23 VAL 59 10.229 -6.876 -14.322 475 H ASN 60 H ASN 60 12.260 -7.115 -9.791 476 HA ASN 60 HA ASN 60 13.536 -9.680 -10.320 477 1HB ASN 60 HB2 ASN 60 15.166 -7.487 -9.806 478 2HB ASN 60 HB3 ASN 60 14.937 -8.176 -8.198 479 1HD2 ASN 60 HD22 ASN 60 15.603 -9.137 -11.617 480 2HD2 ASN 60 HD21 ASN 60 16.730 -10.418 -11.214 481 H GLU 61 H GLU 61 13.892 -10.904 -8.260 482 HA GLU 61 HA GLU 61 11.414 -11.137 -6.861 483 1HB GLU 61 HB2 GLU 61 12.893 -13.018 -7.299 484 2HB GLU 61 HB3 GLU 61 14.204 -12.274 -6.393 485 1HG GLU 61 HG2 GLU 61 12.755 -12.409 -4.317 486 2HG GLU 61 HG3 GLU 61 11.515 -13.210 -5.280 487 H GLY 62 H GLY 62 10.679 -9.629 -5.477 488 1HA GLY 62 HA2 GLY 62 10.627 -8.578 -3.414 489 2HA GLY 62 HA3 GLY 62 12.390 -8.640 -3.289 490 H ASP 63 H ASP 63 11.567 -7.526 -6.451 491 HA ASP 63 HA ASP 63 12.451 -4.833 -5.773 492 1HB ASP 63 HB2 ASP 63 13.075 -6.195 -7.849 493 2HB ASP 63 HB3 ASP 63 11.437 -5.908 -8.435 494 H VAL 64 H VAL 64 11.058 -3.118 -5.409 495 HA VAL 64 HA VAL 64 8.348 -3.717 -4.821 496 HB VAL 64 HB VAL 64 9.605 -0.957 -5.102 497 1HG1 VAL 64 HG11 VAL 64 7.239 -1.981 -3.458 498 2HG1 VAL 64 HG12 VAL 64 7.922 -0.341 -3.364 499 3HG1 VAL 64 HG13 VAL 64 7.146 -0.884 -4.848 500 1HG2 VAL 64 HG21 VAL 64 11.008 -2.271 -3.566 501 2HG2 VAL 64 HG22 VAL 64 10.034 -1.136 -2.639 502 3HG2 VAL 64 HG23 VAL 64 9.566 -2.849 -2.702 503 H LEU 65 H LEU 65 6.443 -3.138 -5.812 504 HA LEU 65 HA LEU 65 6.537 -2.415 -8.707 505 1HB LEU 65 HB2 LEU 65 5.686 -4.647 -8.352 506 2HB LEU 65 HB3 LEU 65 4.632 -4.117 -7.047 507 HG LEU 65 HG LEU 65 3.213 -2.855 -8.599 508 1HD1 LEU 65 HD11 LEU 65 4.777 -2.177 -10.331 509 2HD1 LEU 65 HD12 LEU 65 5.133 -3.871 -10.729 510 3HD1 LEU 65 HD13 LEU 65 3.530 -3.174 -11.072 511 1HD2 LEU 65 HD21 LEU 65 2.334 -4.838 -9.854 512 2HD2 LEU 65 HD22 LEU 65 3.773 -5.734 -9.390 513 3HD2 LEU 65 HD23 LEU 65 2.648 -5.170 -8.140 514 H LEU 66 H LEU 66 4.687 -1.972 -5.583 515 HA LEU 66 HA LEU 66 4.144 0.782 -6.385 516 1HB LEU 66 HB2 LEU 66 1.730 0.663 -6.388 517 2HB LEU 66 HB3 LEU 66 2.410 -0.342 -7.640 518 HG LEU 66 HG LEU 66 1.970 -2.347 -6.176 519 1HD1 LEU 66 HD11 LEU 66 1.706 -1.455 -3.938 520 2HD1 LEU 66 HD12 LEU 66 0.494 -0.282 -4.500 521 3HD1 LEU 66 HD13 LEU 66 0.127 -2.022 -4.445 522 1HD2 LEU 66 HD21 LEU 66 -0.395 -0.641 -7.001 523 2HD2 LEU 66 HD22 LEU 66 0.536 -1.775 -8.014 524 3HD2 LEU 66 HD23 LEU 66 -0.437 -2.391 -6.681 525 H GLU 67 H GLU 67 2.686 1.866 -4.709 526 HA GLU 67 HA GLU 67 3.117 0.765 -2.011 527 1HB GLU 67 HB2 GLU 67 4.946 2.345 -2.350 528 2HB GLU 67 HB3 GLU 67 3.838 3.557 -2.978 529 1HG GLU 67 HG2 GLU 67 4.512 4.137 -0.739 530 2HG GLU 67 HG3 GLU 67 2.792 3.810 -0.762 531 H LEU 68 H LEU 68 1.560 1.535 -0.496 532 HA LEU 68 HA LEU 68 -1.024 2.294 -1.791 533 1HB LEU 68 HB2 LEU 68 -0.501 0.239 0.397 534 2HB LEU 68 HB3 LEU 68 -2.092 0.721 -0.178 535 HG LEU 68 HG LEU 68 0.018 -0.725 -1.823 536 1HD1 LEU 68 HD11 LEU 68 -1.099 -2.108 -0.096 537 2HD1 LEU 68 HD12 LEU 68 -2.680 -1.677 -0.781 538 3HD1 LEU 68 HD13 LEU 68 -1.521 -2.615 -1.743 539 1HD2 LEU 68 HD21 LEU 68 -1.256 0.711 -3.282 540 2HD2 LEU 68 HD22 LEU 68 -1.801 -0.927 -3.518 541 3HD2 LEU 68 HD23 LEU 68 -2.803 0.184 -2.566 542 H SER 69 H SER 69 -2.684 2.981 -0.268 543 HA SER 69 HA SER 69 -1.991 5.228 1.236 544 1HB SER 69 HB2 SER 69 -4.391 4.815 2.134 545 2HB SER 69 HB3 SER 69 -4.153 5.113 0.406 546 HG SER 69 HG SER 69 -5.518 3.218 1.263 547 H ASN 70 H ASN 70 -1.979 5.649 3.468 548 HA ASN 70 HA ASN 70 -0.961 3.490 5.191 549 1HB ASN 70 HB2 ASN 70 -0.121 5.877 5.347 550 2HB ASN 70 HB3 ASN 70 -1.724 6.354 5.924 551 1HD2 ASN 70 HD22 ASN 70 -1.803 6.475 8.199 552 2HD2 ASN 70 HD21 ASN 70 -0.836 5.472 9.259 553 H SER 71 H SER 71 -2.107 2.747 7.104 554 HA SER 71 HA SER 71 -4.726 2.046 6.693 555 1HB SER 71 HB2 SER 71 -3.383 2.266 9.409 556 2HB SER 71 HB3 SER 71 -4.597 1.083 8.887 557 HG SER 71 HG SER 71 -2.472 0.219 8.860 558 H THR 72 H THR 72 -3.672 5.124 8.021 559 HA THR 72 HA THR 72 -6.009 5.762 9.556 560 HB THR 72 HB THR 72 -5.015 8.128 9.181 561 HG1 THR 72 HG1 THR 72 -3.731 8.025 7.471 562 1HG2 THR 72 HG21 THR 72 -3.230 5.942 10.352 563 2HG2 THR 72 HG22 THR 72 -3.083 7.688 10.653 564 3HG2 THR 72 HG23 THR 72 -4.523 6.814 11.199 565 H GLN 73 H GLN 73 -5.295 5.814 6.094 566 HA GLN 73 HA GLN 73 -7.171 7.909 5.411 567 1HB GLN 73 HB2 GLN 73 -5.762 5.795 3.724 568 2HB GLN 73 HB3 GLN 73 -6.734 7.121 3.080 569 1HG GLN 73 HG2 GLN 73 -5.206 8.781 4.085 570 2HG GLN 73 HG3 GLN 73 -4.233 7.491 4.801 571 1HE2 GLN 73 HE22 GLN 73 -5.445 8.570 1.549 572 2HE2 GLN 73 HE21 GLN 73 -3.986 8.120 0.704 Start of MODEL 2 1 1H THR 2 H1 THR 2 2.514 -1.275 1.201 2 2H THR 2 H2 THR 2 1.470 -2.288 0.421 3 3H THR 2 H3 THR 2 2.646 -2.901 1.385 4 HA THR 2 HA THR 2 3.094 -1.451 -1.126 5 HB THR 2 HB THR 2 5.090 -2.731 0.788 6 HG1 THR 2 HG1 THR 2 5.610 -0.608 1.202 7 1HG2 THR 2 HG21 THR 2 5.566 -1.084 -1.737 8 2HG2 THR 2 HG22 THR 2 6.809 -1.618 -0.591 9 3HG2 THR 2 HG23 THR 2 5.938 -2.820 -1.549 10 H VAL 3 H VAL 3 3.736 -2.818 -2.941 11 HA VAL 3 HA VAL 3 3.262 -5.727 -2.605 12 HB VAL 3 HB VAL 3 2.037 -4.027 -4.817 13 1HG1 VAL 3 HG11 VAL 3 2.515 -6.348 -5.499 14 2HG1 VAL 3 HG12 VAL 3 1.618 -6.958 -4.090 15 3HG1 VAL 3 HG13 VAL 3 0.787 -6.067 -5.389 16 1HG2 VAL 3 HG21 VAL 3 -0.191 -4.566 -3.815 17 2HG2 VAL 3 HG22 VAL 3 0.642 -5.222 -2.383 18 3HG2 VAL 3 HG23 VAL 3 0.770 -3.504 -2.799 19 H SER 4 H SER 4 4.581 -6.921 -4.065 20 HA SER 4 HA SER 4 6.676 -5.416 -5.549 21 1HB SER 4 HB2 SER 4 7.100 -7.579 -3.455 22 2HB SER 4 HB3 SER 4 8.364 -6.766 -4.380 23 HG SER 4 HG SER 4 8.042 -5.877 -2.264 24 H ILE 5 H ILE 5 8.093 -6.905 -6.752 25 HA ILE 5 HA ILE 5 6.568 -9.055 -8.107 26 HB ILE 5 HB ILE 5 9.287 -7.818 -8.760 27 1HG1 ILE 5 HG12 ILE 5 7.770 -7.021 -10.846 28 2HG1 ILE 5 HG13 ILE 5 6.488 -7.064 -9.653 29 1HG2 ILE 5 HG21 ILE 5 8.975 -8.908 -10.973 30 2HG2 ILE 5 HG22 ILE 5 9.045 -10.074 -9.679 31 3HG2 ILE 5 HG23 ILE 5 7.470 -9.651 -10.394 32 1HD1 ILE 5 HD11 ILE 5 7.583 -4.827 -9.980 33 2HD1 ILE 5 HD12 ILE 5 7.692 -5.378 -8.307 34 3HD1 ILE 5 HD13 ILE 5 9.105 -5.498 -9.376 35 H GLN 6 H GLN 6 7.486 -11.217 -8.093 36 HA GLN 6 HA GLN 6 9.602 -11.765 -6.092 37 1HB GLN 6 HB2 GLN 6 8.161 -13.828 -5.443 38 2HB GLN 6 HB3 GLN 6 7.924 -12.279 -4.698 39 1HG GLN 6 HG2 GLN 6 6.194 -13.182 -7.031 40 2HG GLN 6 HG3 GLN 6 5.844 -13.636 -5.369 41 1HE2 GLN 6 HE22 GLN 6 4.799 -11.450 -7.598 42 2HE2 GLN 6 HE21 GLN 6 4.613 -10.018 -6.585 43 H MET 7 H MET 7 9.765 -11.539 -8.948 44 HA MET 7 HA MET 7 10.987 -14.112 -9.596 45 1HB MET 7 HB2 MET 7 8.989 -12.705 -11.430 46 2HB MET 7 HB3 MET 7 10.011 -14.040 -11.896 47 1HG MET 7 HG2 MET 7 8.032 -15.066 -11.618 48 2HG MET 7 HG3 MET 7 8.838 -15.417 -10.089 49 1HE MET 7 HE1 MET 7 6.307 -12.903 -11.853 50 2HE MET 7 HE2 MET 7 5.769 -14.591 -11.835 51 3HE MET 7 HE3 MET 7 4.868 -13.368 -10.912 52 H ALA 8 H ALA 8 12.395 -13.752 -11.527 53 HA ALA 8 HA ALA 8 13.356 -10.938 -11.794 54 1HB ALA 8 HB1 ALA 8 15.401 -11.975 -12.725 55 2HB ALA 8 HB2 ALA 8 15.102 -12.514 -11.056 56 3HB ALA 8 HB3 ALA 8 14.726 -13.589 -12.426 57 H GLY 9 H GLY 9 12.990 -9.936 -13.754 58 1HA GLY 9 HA2 GLY 9 12.864 -11.177 -16.268 59 2HA GLY 9 HA3 GLY 9 11.230 -11.263 -15.611 60 H ASN 10 H ASN 10 10.308 -9.835 -17.077 61 HA ASN 10 HA ASN 10 11.039 -6.954 -16.731 62 1HB ASN 10 HB2 ASN 10 10.720 -8.511 -19.311 63 2HB ASN 10 HB3 ASN 10 10.165 -6.844 -19.222 64 1HD2 ASN 10 HD22 ASN 10 13.091 -7.752 -17.343 65 2HD2 ASN 10 HD21 ASN 10 14.192 -6.951 -18.443 66 H LEU 11 H LEU 11 9.264 -5.652 -16.556 67 HA LEU 11 HA LEU 11 6.892 -7.052 -15.659 68 1HB LEU 11 HB2 LEU 11 8.116 -5.199 -14.450 69 2HB LEU 11 HB3 LEU 11 7.510 -4.082 -15.668 70 HG LEU 11 HG LEU 11 5.145 -4.799 -15.003 71 1HD1 LEU 11 HD11 LEU 11 4.943 -5.873 -12.721 72 2HD1 LEU 11 HD12 LEU 11 5.561 -6.977 -13.944 73 3HD1 LEU 11 HD13 LEU 11 6.673 -6.239 -12.777 74 1HD2 LEU 11 HD21 LEU 11 5.187 -3.421 -12.980 75 2HD2 LEU 11 HD22 LEU 11 6.929 -3.700 -12.792 76 3HD2 LEU 11 HD23 LEU 11 6.301 -2.763 -14.174 77 H TRP 12 H TRP 12 6.407 -7.814 -17.816 78 HA TRP 12 HA TRP 12 5.974 -6.886 -20.182 79 1HB TRP 12 HB2 TRP 12 5.239 -9.099 -19.123 80 2HB TRP 12 HB3 TRP 12 3.705 -8.332 -18.783 81 HD1 TRP 12 HD1 TRP 12 5.965 -9.081 -21.780 82 HE1 TRP 12 HE1 TRP 12 4.571 -9.725 -23.817 83 HE3 TRP 12 HE3 TRP 12 1.314 -8.359 -19.795 84 HZ2 TRP 12 HZ2 TRP 12 1.752 -9.943 -24.490 85 HZ3 TRP 12 HZ3 TRP 12 -0.712 -8.853 -21.131 86 HH2 TRP 12 HH2 TRP 12 -0.506 -9.639 -23.481 87 H LYS 13 H LYS 13 3.287 -6.351 -17.802 88 HA LYS 13 HA LYS 13 2.695 -3.747 -18.993 89 1HB LYS 13 HB2 LYS 13 0.696 -6.054 -18.946 90 2HB LYS 13 HB3 LYS 13 0.221 -4.358 -19.084 91 1HG LYS 13 HG2 LYS 13 1.619 -4.181 -21.173 92 2HG LYS 13 HG3 LYS 13 1.900 -5.930 -21.073 93 1HD LYS 13 HD2 LYS 13 -0.606 -6.268 -21.122 94 2HD LYS 13 HD3 LYS 13 -0.781 -4.522 -21.406 95 1HE LYS 13 HE2 LYS 13 0.662 -4.741 -23.441 96 2HE LYS 13 HE3 LYS 13 0.772 -6.484 -23.161 97 1HZ LYS 13 HZ1 LYS 13 -0.929 -5.957 -24.785 98 2HZ LYS 13 HZ2 LYS 13 -1.637 -6.614 -23.473 99 3HZ LYS 13 HZ3 LYS 13 -1.730 -5.002 -23.739 100 H VAL 14 H VAL 14 1.070 -2.609 -17.580 101 HA VAL 14 HA VAL 14 0.906 -3.567 -14.798 102 HB VAL 14 HB VAL 14 1.997 -0.836 -15.637 103 1HG1 VAL 14 HG11 VAL 14 1.526 -2.035 -12.861 104 2HG1 VAL 14 HG12 VAL 14 2.427 -0.541 -13.185 105 3HG1 VAL 14 HG13 VAL 14 0.709 -0.616 -13.567 106 1HG2 VAL 14 HG21 VAL 14 3.333 -3.232 -14.329 107 2HG2 VAL 14 HG22 VAL 14 3.747 -2.521 -15.904 108 3HG2 VAL 14 HG23 VAL 14 4.069 -1.610 -14.431 109 H HIS 15 H HIS 15 -0.972 -2.756 -13.792 110 HA HIS 15 HA HIS 15 -2.948 -1.477 -15.629 111 1HB HIS 15 HB2 HIS 15 -3.630 -3.683 -13.687 112 2HB HIS 15 HB3 HIS 15 -4.509 -3.162 -15.119 113 HD1 HIS 15 HD1 HIS 15 -2.416 -3.628 -17.418 114 HD2 HIS 15 HD2 HIS 15 -2.784 -6.040 -13.996 115 HE1 HIS 15 HE1 HIS 15 -1.260 -5.847 -17.956 116 H VAL 16 H VAL 16 -1.389 -0.181 -13.434 117 HA VAL 16 HA VAL 16 -3.662 0.768 -11.786 118 HB VAL 16 HB VAL 16 -2.085 0.962 -9.858 119 1HG1 VAL 16 HG11 VAL 16 -3.797 -0.794 -9.899 120 2HG1 VAL 16 HG12 VAL 16 -2.662 -1.897 -10.705 121 3HG1 VAL 16 HG13 VAL 16 -2.333 -1.316 -9.053 122 1HG2 VAL 16 HG21 VAL 16 0.032 0.573 -11.261 123 2HG2 VAL 16 HG22 VAL 16 -0.073 -0.186 -9.679 124 3HG2 VAL 16 HG23 VAL 16 -0.350 -1.157 -11.148 125 H LYS 17 H LYS 17 -3.179 2.853 -10.747 126 HA LYS 17 HA LYS 17 -0.953 4.417 -11.707 127 1HB LYS 17 HB2 LYS 17 -2.345 6.319 -12.456 128 2HB LYS 17 HB3 LYS 17 -2.533 4.912 -13.498 129 1HG LYS 17 HG2 LYS 17 -4.711 4.381 -12.432 130 2HG LYS 17 HG3 LYS 17 -4.501 5.724 -11.303 131 1HD LYS 17 HD2 LYS 17 -6.024 6.396 -13.030 132 2HD LYS 17 HD3 LYS 17 -4.529 7.328 -13.196 133 1HE LYS 17 HE2 LYS 17 -3.790 5.814 -15.029 134 2HE LYS 17 HE3 LYS 17 -5.259 4.849 -14.830 135 1HZ LYS 17 HZ1 LYS 17 -5.467 6.422 -16.647 136 2HZ LYS 17 HZ2 LYS 17 -6.547 6.798 -15.488 137 3HZ LYS 17 HZ3 LYS 17 -5.190 7.692 -15.668 138 H ALA 18 H ALA 18 -0.789 6.387 -10.275 139 HA ALA 18 HA ALA 18 -1.498 5.897 -7.562 140 1HB ALA 18 HB1 ALA 18 0.342 7.414 -8.219 141 2HB ALA 18 HB2 ALA 18 -0.833 8.537 -8.944 142 3HB ALA 18 HB3 ALA 18 -0.841 8.248 -7.192 143 H GLY 19 H GLY 19 -3.332 6.357 -6.402 144 1HA GLY 19 HA2 GLY 19 -5.331 7.403 -5.862 145 2HA GLY 19 HA3 GLY 19 -5.421 8.144 -7.465 146 H ASP 20 H ASP 20 -4.703 5.022 -8.281 147 HA ASP 20 HA ASP 20 -7.458 4.216 -8.757 148 1HB ASP 20 HB2 ASP 20 -5.467 3.606 -10.215 149 2HB ASP 20 HB3 ASP 20 -4.920 2.546 -8.913 150 H GLN 21 H GLN 21 -8.142 1.961 -7.939 151 HA GLN 21 HA GLN 21 -7.282 1.470 -5.125 152 1HB GLN 21 HB2 GLN 21 -9.414 2.639 -5.057 153 2HB GLN 21 HB3 GLN 21 -10.122 1.546 -6.233 154 1HG GLN 21 HG2 GLN 21 -8.989 0.310 -3.719 155 2HG GLN 21 HG3 GLN 21 -10.433 1.294 -3.542 156 1HE2 GLN 21 HE22 GLN 21 -9.541 -1.875 -3.852 157 2HE2 GLN 21 HE21 GLN 21 -10.985 -2.476 -4.636 158 H ILE 22 H ILE 22 -6.951 -0.650 -4.664 159 HA ILE 22 HA ILE 22 -7.611 -2.680 -6.731 160 HB ILE 22 HB ILE 22 -5.462 -3.710 -6.493 161 1HG1 ILE 22 HG12 ILE 22 -4.752 -1.535 -4.474 162 2HG1 ILE 22 HG13 ILE 22 -4.970 -3.257 -4.146 163 1HG2 ILE 22 HG21 ILE 22 -4.080 -2.086 -7.640 164 2HG2 ILE 22 HG22 ILE 22 -5.754 -1.862 -8.149 165 3HG2 ILE 22 HG23 ILE 22 -5.016 -0.737 -6.989 166 1HD1 ILE 22 HD11 ILE 22 -2.733 -1.932 -5.693 167 2HD1 ILE 22 HD12 ILE 22 -2.642 -2.953 -4.236 168 3HD1 ILE 22 HD13 ILE 22 -3.038 -3.676 -5.790 169 H GLU 23 H GLU 23 -7.551 -4.883 -5.813 170 HA GLU 23 HA GLU 23 -8.357 -5.010 -2.970 171 1HB GLU 23 HB2 GLU 23 -10.352 -4.841 -4.361 172 2HB GLU 23 HB3 GLU 23 -9.806 -6.202 -5.361 173 1HG GLU 23 HG2 GLU 23 -9.973 -7.707 -3.403 174 2HG GLU 23 HG3 GLU 23 -10.411 -6.344 -2.373 175 H LYS 24 H LYS 24 -7.729 -6.996 -1.977 176 HA LYS 24 HA LYS 24 -5.339 -8.133 -2.803 177 1HB LYS 24 HB2 LYS 24 -6.389 -8.284 -0.525 178 2HB LYS 24 HB3 LYS 24 -7.492 -9.520 -1.136 179 1HG LYS 24 HG2 LYS 24 -5.637 -11.030 -1.627 180 2HG LYS 24 HG3 LYS 24 -4.453 -9.766 -1.269 181 1HD LYS 24 HD2 LYS 24 -5.225 -9.726 1.102 182 2HD LYS 24 HD3 LYS 24 -6.386 -11.022 0.731 183 1HE LYS 24 HE2 LYS 24 -4.505 -12.499 0.046 184 2HE LYS 24 HE3 LYS 24 -3.355 -11.201 0.397 185 1HZ LYS 24 HZ1 LYS 24 -3.505 -12.773 2.221 186 2HZ LYS 24 HZ2 LYS 24 -4.028 -11.315 2.721 187 3HZ LYS 24 HZ3 LYS 24 -5.102 -12.509 2.403 188 H GLY 25 H GLY 25 -4.696 -9.645 -4.280 189 1HA GLY 25 HA2 GLY 25 -4.805 -11.521 -5.602 190 2HA GLY 25 HA3 GLY 25 -6.503 -11.755 -5.176 191 H GLN 26 H GLN 26 -6.499 -8.555 -6.136 192 HA GLN 26 HA GLN 26 -7.454 -9.069 -8.814 193 1HB GLN 26 HB2 GLN 26 -8.008 -7.037 -7.316 194 2HB GLN 26 HB3 GLN 26 -6.367 -6.460 -7.677 195 1HG GLN 26 HG2 GLN 26 -7.198 -6.829 -10.212 196 2HG GLN 26 HG3 GLN 26 -8.785 -6.708 -9.475 197 1HE2 GLN 26 HE22 GLN 26 -6.020 -4.992 -10.619 198 2HE2 GLN 26 HE21 GLN 26 -6.526 -3.382 -10.119 199 H GLU 27 H GLU 27 -6.251 -9.014 -10.713 200 HA GLU 27 HA GLU 27 -3.359 -9.118 -10.705 201 1HB GLU 27 HB2 GLU 27 -4.897 -10.217 -12.366 202 2HB GLU 27 HB3 GLU 27 -5.371 -8.618 -12.946 203 1HG GLU 27 HG2 GLU 27 -2.964 -8.214 -13.592 204 2HG GLU 27 HG3 GLU 27 -2.584 -9.854 -13.068 205 H VAL 28 H VAL 28 -1.953 -7.426 -10.919 206 HA VAL 28 HA VAL 28 -2.982 -4.705 -11.546 207 HB VAL 28 HB VAL 28 -1.449 -3.822 -9.761 208 1HG1 VAL 28 HG11 VAL 28 -3.903 -3.913 -9.494 209 2HG1 VAL 28 HG12 VAL 28 -3.776 -5.542 -8.792 210 3HG1 VAL 28 HG13 VAL 28 -3.057 -4.156 -7.961 211 1HG2 VAL 28 HG21 VAL 28 -0.093 -5.881 -9.339 212 2HG2 VAL 28 HG22 VAL 28 -0.854 -5.236 -7.871 213 3HG2 VAL 28 HG23 VAL 28 -1.551 -6.653 -8.668 214 H ALA 29 H ALA 29 -0.478 -7.147 -11.987 215 HA ALA 29 HA ALA 29 0.395 -5.596 -14.258 216 1HB ALA 29 HB1 ALA 29 2.428 -6.195 -12.044 217 2HB ALA 29 HB2 ALA 29 2.811 -5.617 -13.674 218 3HB ALA 29 HB3 ALA 29 1.889 -4.592 -12.573 219 H ILE 30 H ILE 30 2.281 -6.946 -15.319 220 HA ILE 30 HA ILE 30 1.946 -9.860 -14.868 221 HB ILE 30 HB ILE 30 1.602 -8.376 -17.506 222 1HG1 ILE 30 HG12 ILE 30 -0.172 -10.463 -16.144 223 2HG1 ILE 30 HG13 ILE 30 -0.430 -8.729 -16.044 224 1HG2 ILE 30 HG21 ILE 30 1.946 -11.393 -17.109 225 2HG2 ILE 30 HG22 ILE 30 1.578 -10.586 -18.647 226 3HG2 ILE 30 HG23 ILE 30 3.130 -10.329 -17.894 227 1HD1 ILE 30 HD11 ILE 30 -1.935 -9.604 -17.674 228 2HD1 ILE 30 HD12 ILE 30 -0.730 -8.605 -18.503 229 3HD1 ILE 30 HD13 ILE 30 -0.632 -10.385 -18.576 230 H LEU 31 H LEU 31 3.810 -10.960 -15.234 231 HA LEU 31 HA LEU 31 6.335 -9.436 -15.696 232 1HB LEU 31 HB2 LEU 31 6.106 -10.151 -13.435 233 2HB LEU 31 HB3 LEU 31 5.543 -11.757 -13.882 234 HG LEU 31 HG LEU 31 7.800 -11.581 -12.872 235 1HD1 LEU 31 HD11 LEU 31 7.145 -13.569 -14.126 236 2HD1 LEU 31 HD12 LEU 31 7.874 -12.897 -15.593 237 3HD1 LEU 31 HD13 LEU 31 8.882 -13.248 -14.178 238 1HD2 LEU 31 HD21 LEU 31 9.685 -10.766 -14.004 239 2HD2 LEU 31 HD22 LEU 31 8.797 -10.550 -15.532 240 3HD2 LEU 31 HD23 LEU 31 8.455 -9.499 -14.146 241 H GLU 32 H GLU 32 7.522 -10.167 -17.406 242 HA GLU 32 HA GLU 32 6.766 -12.703 -18.770 243 1HB GLU 32 HB2 GLU 32 6.554 -10.729 -20.197 244 2HB GLU 32 HB3 GLU 32 8.191 -10.205 -19.782 245 1HG GLU 32 HG2 GLU 32 9.077 -12.319 -20.834 246 2HG GLU 32 HG3 GLU 32 7.427 -12.752 -21.281 247 H SER 33 H SER 33 8.209 -14.315 -18.502 248 HA SER 33 HA SER 33 11.021 -14.013 -18.485 249 1HB SER 33 HB2 SER 33 10.424 -13.240 -16.080 250 2HB SER 33 HB3 SER 33 9.912 -14.905 -15.784 251 HG SER 33 HG SER 33 12.174 -14.128 -15.336 252 H MET 34 H MET 34 11.989 -16.289 -18.049 253 HA MET 34 HA MET 34 12.056 -18.494 -18.622 254 1HB MET 34 HB2 MET 34 9.400 -18.557 -17.135 255 2HB MET 34 HB3 MET 34 10.468 -19.929 -17.401 256 1HG MET 34 HG2 MET 34 12.161 -19.048 -15.982 257 2HG MET 34 HG3 MET 34 11.400 -17.464 -15.880 258 1HE MET 34 HE1 MET 34 9.606 -16.723 -14.237 259 2HE MET 34 HE2 MET 34 8.467 -17.690 -15.201 260 3HE MET 34 HE3 MET 34 8.482 -17.836 -13.433 261 H LYS 35 H LYS 35 10.958 -16.799 -20.669 262 HA LYS 35 HA LYS 35 9.750 -16.694 -22.560 263 1HB LYS 35 HB2 LYS 35 10.082 -19.718 -22.573 264 2HB LYS 35 HB3 LYS 35 9.651 -18.710 -23.957 265 1HG LYS 35 HG2 LYS 35 11.812 -17.500 -23.760 266 2HG LYS 35 HG3 LYS 35 12.282 -18.571 -22.424 267 1HD LYS 35 HD2 LYS 35 12.044 -20.538 -23.920 268 2HD LYS 35 HD3 LYS 35 11.640 -19.476 -25.272 269 1HE LYS 35 HE2 LYS 35 14.256 -19.407 -23.692 270 2HE LYS 35 HE3 LYS 35 14.029 -20.259 -25.221 271 1HZ LYS 35 HZ1 LYS 35 15.023 -18.110 -25.583 272 2HZ LYS 35 HZ2 LYS 35 13.550 -18.127 -26.275 273 3HZ LYS 35 HZ3 LYS 35 13.789 -17.328 -24.866 274 H MET 36 H MET 36 8.176 -16.686 -20.161 275 HA MET 36 HA MET 36 5.534 -17.462 -21.227 276 1HB MET 36 HB2 MET 36 6.752 -18.185 -18.518 277 2HB MET 36 HB3 MET 36 5.017 -18.145 -18.777 278 1HG MET 36 HG2 MET 36 6.962 -19.911 -20.297 279 2HG MET 36 HG3 MET 36 5.965 -20.418 -18.945 280 1HE MET 36 HE1 MET 36 3.067 -19.168 -19.469 281 2HE MET 36 HE2 MET 36 2.354 -20.509 -20.385 282 3HE MET 36 HE3 MET 36 3.410 -20.848 -18.998 283 H GLU 37 H GLU 37 3.844 -16.396 -19.710 284 HA GLU 37 HA GLU 37 4.823 -13.870 -18.527 285 1HB GLU 37 HB2 GLU 37 2.229 -14.154 -20.099 286 2HB GLU 37 HB3 GLU 37 2.779 -12.751 -19.197 287 1HG GLU 37 HG2 GLU 37 3.305 -12.137 -21.348 288 2HG GLU 37 HG3 GLU 37 4.847 -12.731 -20.751 289 H ILE 38 H ILE 38 3.898 -13.458 -16.535 290 HA ILE 38 HA ILE 38 2.056 -15.474 -15.373 291 HB ILE 38 HB ILE 38 4.688 -14.517 -14.139 292 1HG1 ILE 38 HG12 ILE 38 5.116 -17.179 -14.352 293 2HG1 ILE 38 HG13 ILE 38 4.097 -16.998 -15.765 294 1HG2 ILE 38 HG21 ILE 38 2.947 -15.087 -12.484 295 2HG2 ILE 38 HG22 ILE 38 2.724 -16.678 -13.254 296 3HG2 ILE 38 HG23 ILE 38 4.250 -16.271 -12.452 297 1HD1 ILE 38 HD11 ILE 38 6.752 -15.615 -15.166 298 2HD1 ILE 38 HD12 ILE 38 6.439 -16.849 -16.394 299 3HD1 ILE 38 HD13 ILE 38 5.771 -15.223 -16.588 300 HA PRO 39 HA PRO 39 0.394 -11.521 -14.082 301 1HB PRO 39 HB2 PRO 39 -1.452 -12.265 -12.193 302 2HB PRO 39 HB3 PRO 39 -1.663 -12.555 -13.946 303 1HG PRO 39 HG2 PRO 39 -0.627 -14.496 -11.859 304 2HG PRO 39 HG3 PRO 39 -1.894 -14.774 -13.098 305 1HD PRO 39 HD2 PRO 39 0.678 -15.551 -13.492 306 2HD PRO 39 HD3 PRO 39 -0.294 -14.891 -14.838 307 H ILE 40 H ILE 40 0.411 -10.037 -12.363 308 HA ILE 40 HA ILE 40 1.748 -10.774 -9.809 309 HB ILE 40 HB ILE 40 1.980 -8.203 -11.409 310 1HG1 ILE 40 HG12 ILE 40 3.395 -9.964 -12.411 311 2HG1 ILE 40 HG13 ILE 40 4.306 -8.610 -11.774 312 1HG2 ILE 40 HG21 ILE 40 3.132 -8.921 -8.688 313 2HG2 ILE 40 HG22 ILE 40 3.671 -7.536 -9.660 314 3HG2 ILE 40 HG23 ILE 40 2.000 -7.616 -9.086 315 1HD1 ILE 40 HD11 ILE 40 5.379 -10.779 -11.272 316 2HD1 ILE 40 HD12 ILE 40 4.972 -9.900 -9.797 317 3HD1 ILE 40 HD13 ILE 40 3.965 -11.270 -10.322 318 H VAL 41 H VAL 41 0.429 -10.318 -8.134 319 HA VAL 41 HA VAL 41 -2.125 -8.914 -8.679 320 HB VAL 41 HB VAL 41 -3.056 -10.549 -6.962 321 1HG1 VAL 41 HG11 VAL 41 -3.632 -10.787 -9.280 322 2HG1 VAL 41 HG12 VAL 41 -2.119 -11.661 -9.633 323 3HG1 VAL 41 HG13 VAL 41 -3.367 -12.375 -8.582 324 1HG2 VAL 41 HG21 VAL 41 -1.960 -12.670 -6.610 325 2HG2 VAL 41 HG22 VAL 41 -0.591 -12.209 -7.634 326 3HG2 VAL 41 HG23 VAL 41 -0.865 -11.387 -6.077 327 H ALA 42 H ALA 42 -3.186 -7.976 -6.838 328 HA ALA 42 HA ALA 42 -1.467 -6.425 -5.152 329 1HB ALA 42 HB1 ALA 42 -3.536 -5.646 -4.147 330 2HB ALA 42 HB2 ALA 42 -3.792 -5.782 -5.908 331 3HB ALA 42 HB3 ALA 42 -4.427 -7.022 -4.817 332 H ASP 43 H ASP 43 -0.403 -7.164 -3.373 333 HA ASP 43 HA ASP 43 -0.946 -9.660 -2.081 334 1HB ASP 43 HB2 ASP 43 1.269 -8.617 -2.055 335 2HB ASP 43 HB3 ASP 43 0.637 -7.226 -1.172 336 H ARG 44 H ARG 44 -2.258 -6.428 -1.632 337 HA ARG 44 HA ARG 44 -4.375 -7.497 -0.038 338 1HB ARG 44 HB2 ARG 44 -4.224 -5.823 1.792 339 2HB ARG 44 HB3 ARG 44 -3.021 -7.083 1.890 340 1HG ARG 44 HG2 ARG 44 -2.251 -4.487 0.516 341 2HG ARG 44 HG3 ARG 44 -2.476 -4.499 2.273 342 1HD ARG 44 HD2 ARG 44 -0.902 -6.630 2.174 343 2HD ARG 44 HD3 ARG 44 -0.399 -5.934 0.623 344 HE ARG 44 HE ARG 44 -0.368 -3.886 2.593 345 1HH1 ARG 44 HH21 ARG 44 1.382 -6.941 1.982 346 2HH1 ARG 44 HH22 ARG 44 2.760 -6.459 2.920 347 1HH2 ARG 44 HH11 ARG 44 1.347 -3.311 3.839 348 2HH2 ARG 44 HH12 ARG 44 2.750 -4.325 4.017 349 H SER 45 H SER 45 -6.122 -5.840 0.194 350 HA SER 45 HA SER 45 -6.443 -4.195 -2.099 351 1HB SER 45 HB2 SER 45 -7.931 -4.026 0.553 352 2HB SER 45 HB3 SER 45 -8.553 -3.653 -1.059 353 HG SER 45 HG SER 45 -9.162 -5.753 -0.151 354 H GLY 46 H GLY 46 -6.708 -1.816 -2.126 355 1HA GLY 46 HA2 GLY 46 -6.446 -0.068 -0.034 356 2HA GLY 46 HA3 GLY 46 -4.767 -0.361 -0.503 357 H ILE 47 H ILE 47 -5.284 2.122 -0.780 358 HA ILE 47 HA ILE 47 -6.120 2.713 -3.577 359 HB ILE 47 HB ILE 47 -5.265 4.539 -1.284 360 1HG1 ILE 47 HG12 ILE 47 -7.460 3.657 -0.778 361 2HG1 ILE 47 HG13 ILE 47 -7.586 5.345 -1.233 362 1HG2 ILE 47 HG21 ILE 47 -6.213 5.237 -4.092 363 2HG2 ILE 47 HG22 ILE 47 -6.074 6.398 -2.755 364 3HG2 ILE 47 HG23 ILE 47 -4.635 5.584 -3.364 365 1HD1 ILE 47 HD11 ILE 47 -8.354 4.644 -3.528 366 2HD1 ILE 47 HD12 ILE 47 -8.291 2.951 -2.979 367 3HD1 ILE 47 HD13 ILE 47 -9.418 4.086 -2.222 368 H VAL 48 H VAL 48 -4.528 3.075 -5.075 369 HA VAL 48 HA VAL 48 -1.770 2.339 -4.516 370 HB VAL 48 HB VAL 48 -3.005 3.589 -6.966 371 1HG1 VAL 48 HG11 VAL 48 -0.506 3.717 -6.888 372 2HG1 VAL 48 HG12 VAL 48 -0.429 1.967 -6.578 373 3HG1 VAL 48 HG13 VAL 48 -1.064 2.580 -8.121 374 1HG2 VAL 48 HG21 VAL 48 -3.056 1.259 -7.846 375 2HG2 VAL 48 HG22 VAL 48 -2.586 0.649 -6.241 376 3HG2 VAL 48 HG23 VAL 48 -4.145 1.466 -6.484 377 H LYS 49 H LYS 49 -0.606 3.653 -3.243 378 HA LYS 49 HA LYS 49 -0.978 6.555 -3.152 379 1HB LYS 49 HB2 LYS 49 -0.223 5.406 -1.147 380 2HB LYS 49 HB3 LYS 49 1.139 4.676 -2.011 381 1HG LYS 49 HG2 LYS 49 2.148 6.891 -2.353 382 2HG LYS 49 HG3 LYS 49 0.789 7.659 -1.505 383 1HD LYS 49 HD2 LYS 49 1.352 6.491 0.561 384 2HD LYS 49 HD3 LYS 49 2.591 5.536 -0.245 385 1HE LYS 49 HE2 LYS 49 2.663 8.559 0.151 386 2HE LYS 49 HE3 LYS 49 3.541 7.365 1.109 387 1HZ LYS 49 HZ1 LYS 49 3.988 7.980 -1.745 388 2HZ LYS 49 HZ2 LYS 49 5.019 8.216 -0.507 389 3HZ LYS 49 HZ3 LYS 49 4.677 6.690 -1.005 390 H GLU 50 H GLU 50 1.407 4.177 -4.562 391 HA GLU 50 HA GLU 50 1.838 6.010 -6.788 392 1HB GLU 50 HB2 GLU 50 3.291 6.972 -4.961 393 2HB GLU 50 HB3 GLU 50 4.166 5.445 -4.885 394 1HG GLU 50 HG2 GLU 50 5.020 5.750 -7.122 395 2HG GLU 50 HG3 GLU 50 3.898 7.079 -7.444 396 H VAL 51 H VAL 51 2.979 4.946 -8.536 397 HA VAL 51 HA VAL 51 3.272 1.997 -8.219 398 HB VAL 51 HB VAL 51 3.094 3.599 -10.807 399 1HG1 VAL 51 HG11 VAL 51 2.501 1.413 -11.788 400 2HG1 VAL 51 HG12 VAL 51 4.079 1.322 -11.008 401 3HG1 VAL 51 HG13 VAL 51 2.655 0.630 -10.202 402 1HG2 VAL 51 HG21 VAL 51 0.951 3.932 -9.631 403 2HG2 VAL 51 HG22 VAL 51 0.745 2.827 -10.986 404 3HG2 VAL 51 HG23 VAL 51 0.839 2.182 -9.331 405 H LYS 52 H LYS 52 5.322 1.109 -8.584 406 HA LYS 52 HA LYS 52 7.530 3.128 -8.599 407 1HB LYS 52 HB2 LYS 52 7.405 0.350 -7.372 408 2HB LYS 52 HB3 LYS 52 8.738 1.493 -7.210 409 1HG LYS 52 HG2 LYS 52 5.926 1.873 -6.092 410 2HG LYS 52 HG3 LYS 52 7.346 1.349 -5.199 411 1HD LYS 52 HD2 LYS 52 8.449 3.521 -5.586 412 2HD LYS 52 HD3 LYS 52 7.007 4.098 -6.467 413 1HE LYS 52 HE2 LYS 52 5.598 3.732 -4.508 414 2HE LYS 52 HE3 LYS 52 6.931 2.978 -3.628 415 1HZ LYS 52 HZ1 LYS 52 6.498 5.252 -2.946 416 2HZ LYS 52 HZ2 LYS 52 8.031 5.101 -3.528 417 3HZ LYS 52 HZ3 LYS 52 6.873 5.828 -4.442 418 H LYS 53 H LYS 53 6.187 1.368 -10.903 419 HA LYS 53 HA LYS 53 8.679 0.849 -12.330 420 1HB LYS 53 HB2 LYS 53 6.567 -1.317 -11.848 421 2HB LYS 53 HB3 LYS 53 7.879 -1.441 -13.024 422 1HG LYS 53 HG2 LYS 53 8.260 -1.263 -10.030 423 2HG LYS 53 HG3 LYS 53 8.302 -2.740 -10.976 424 1HD LYS 53 HD2 LYS 53 10.243 -2.027 -12.232 425 2HD LYS 53 HD3 LYS 53 10.209 -0.416 -11.523 426 1HE LYS 53 HE2 LYS 53 10.727 -2.989 -9.989 427 2HE LYS 53 HE3 LYS 53 11.946 -1.830 -10.523 428 1HZ LYS 53 HZ1 LYS 53 9.810 -1.377 -8.548 429 2HZ LYS 53 HZ2 LYS 53 11.413 -1.456 -8.268 430 3HZ LYS 53 HZ3 LYS 53 10.771 -0.161 -9.117 431 H LYS 54 H LYS 54 7.804 -0.142 -14.627 432 HA LYS 54 HA LYS 54 5.263 1.032 -15.431 433 1HB LYS 54 HB2 LYS 54 6.183 2.239 -17.333 434 2HB LYS 54 HB3 LYS 54 6.796 2.925 -15.834 435 1HG LYS 54 HG2 LYS 54 8.957 1.845 -16.130 436 2HG LYS 54 HG3 LYS 54 8.391 0.942 -17.534 437 1HD LYS 54 HD2 LYS 54 8.571 3.973 -17.393 438 2HD LYS 54 HD3 LYS 54 9.820 2.938 -18.072 439 1HE LYS 54 HE2 LYS 54 6.952 3.114 -19.114 440 2HE LYS 54 HE3 LYS 54 8.327 3.993 -19.776 441 1HZ LYS 54 HZ1 LYS 54 8.038 1.033 -19.770 442 2HZ LYS 54 HZ2 LYS 54 7.932 2.029 -21.054 443 3HZ LYS 54 HZ3 LYS 54 9.362 1.851 -20.301 444 H GLU 55 H GLU 55 4.794 0.327 -17.704 445 HA GLU 55 HA GLU 55 5.107 -2.428 -18.094 446 1HB GLU 55 HB2 GLU 55 4.694 -0.351 -20.293 447 2HB GLU 55 HB3 GLU 55 4.283 -2.060 -20.333 448 1HG GLU 55 HG2 GLU 55 2.213 -1.276 -19.863 449 2HG GLU 55 HG3 GLU 55 2.785 -1.401 -18.206 450 H GLY 56 H GLY 56 6.698 -3.665 -18.891 451 1HA GLY 56 HA2 GLY 56 8.441 -4.369 -20.187 452 2HA GLY 56 HA3 GLY 56 8.579 -2.754 -20.895 453 H ASP 57 H ASP 57 8.715 -2.259 -17.535 454 HA ASP 57 HA ASP 57 11.560 -1.741 -17.684 455 1HB ASP 57 HB2 ASP 57 9.901 -0.427 -16.321 456 2HB ASP 57 HB3 ASP 57 9.805 -1.792 -15.204 457 H PHE 58 H PHE 58 13.184 -2.698 -16.254 458 HA PHE 58 HA PHE 58 13.059 -5.622 -16.095 459 1HB PHE 58 HB2 PHE 58 15.170 -4.477 -16.598 460 2HB PHE 58 HB3 PHE 58 15.057 -3.551 -15.108 461 HD1 PHE 58 HD1 PHE 58 15.620 -6.964 -16.509 462 HD2 PHE 58 HD2 PHE 58 15.768 -4.476 -12.986 463 HE1 PHE 58 HE1 PHE 58 16.934 -8.705 -15.333 464 HE2 PHE 58 HE2 PHE 58 17.088 -6.220 -11.816 465 HZ PHE 58 HZ PHE 58 17.698 -8.324 -12.996 466 H VAL 59 H VAL 59 12.808 -6.845 -14.192 467 HA VAL 59 HA VAL 59 12.408 -5.469 -11.630 468 HB VAL 59 HB VAL 59 10.315 -6.901 -11.276 469 1HG1 VAL 59 HG11 VAL 59 10.299 -4.465 -11.424 470 2HG1 VAL 59 HG12 VAL 59 10.084 -4.554 -13.189 471 3HG1 VAL 59 HG13 VAL 59 8.828 -5.173 -12.104 472 1HG2 VAL 59 HG21 VAL 59 8.919 -7.417 -13.202 473 2HG2 VAL 59 HG22 VAL 59 10.166 -6.838 -14.319 474 3HG2 VAL 59 HG23 VAL 59 10.462 -8.289 -13.332 475 H ASN 60 H ASN 60 12.323 -7.026 -9.819 476 HA ASN 60 HA ASN 60 13.541 -9.608 -10.367 477 1HB ASN 60 HB2 ASN 60 15.246 -7.419 -9.968 478 2HB ASN 60 HB3 ASN 60 15.109 -8.120 -8.357 479 1HD2 ASN 60 HD22 ASN 60 15.566 -9.047 -11.819 480 2HD2 ASN 60 HD21 ASN 60 16.699 -10.344 -11.492 481 H GLU 61 H GLU 61 13.867 -10.853 -8.365 482 HA GLU 61 HA GLU 61 11.470 -10.936 -6.886 483 1HB GLU 61 HB2 GLU 61 12.886 -12.851 -7.420 484 2HB GLU 61 HB3 GLU 61 14.184 -12.252 -6.400 485 1HG GLU 61 HG2 GLU 61 11.396 -12.938 -5.360 486 2HG GLU 61 HG3 GLU 61 12.675 -14.131 -5.503 487 H GLY 62 H GLY 62 10.825 -9.435 -5.467 488 1HA GLY 62 HA2 GLY 62 10.891 -8.554 -3.289 489 2HA GLY 62 HA3 GLY 62 12.659 -8.528 -3.318 490 H ASP 63 H ASP 63 11.813 -7.362 -6.354 491 HA ASP 63 HA ASP 63 12.346 -4.606 -5.566 492 1HB ASP 63 HB2 ASP 63 13.078 -5.826 -7.742 493 2HB ASP 63 HB3 ASP 63 11.431 -5.548 -8.302 494 H VAL 64 H VAL 64 10.807 -2.897 -5.600 495 HA VAL 64 HA VAL 64 8.156 -3.779 -4.810 496 HB VAL 64 HB VAL 64 9.266 -0.957 -5.112 497 1HG1 VAL 64 HG11 VAL 64 6.820 -2.057 -3.657 498 2HG1 VAL 64 HG12 VAL 64 7.440 -0.403 -3.466 499 3HG1 VAL 64 HG13 VAL 64 6.814 -0.939 -5.027 500 1HG2 VAL 64 HG21 VAL 64 10.606 -2.224 -3.469 501 2HG2 VAL 64 HG22 VAL 64 9.567 -1.070 -2.635 502 3HG2 VAL 64 HG23 VAL 64 9.123 -2.791 -2.672 503 H LEU 65 H LEU 65 6.241 -3.481 -5.866 504 HA LEU 65 HA LEU 65 6.317 -2.853 -8.769 505 1HB LEU 65 HB2 LEU 65 5.428 -5.062 -7.997 506 2HB LEU 65 HB3 LEU 65 4.221 -4.259 -7.025 507 HG LEU 65 HG LEU 65 3.476 -5.262 -9.156 508 1HD1 LEU 65 HD11 LEU 65 1.887 -3.597 -9.810 509 2HD1 LEU 65 HD12 LEU 65 2.069 -3.620 -8.058 510 3HD1 LEU 65 HD13 LEU 65 2.816 -2.315 -9.028 511 1HD2 LEU 65 HD21 LEU 65 4.826 -2.888 -10.501 512 2HD2 LEU 65 HD22 LEU 65 5.365 -4.585 -10.595 513 3HD2 LEU 65 HD23 LEU 65 3.803 -4.109 -11.269 514 H LEU 66 H LEU 66 4.381 -2.291 -5.762 515 HA LEU 66 HA LEU 66 4.119 0.531 -6.466 516 1HB LEU 66 HB2 LEU 66 1.708 0.658 -6.478 517 2HB LEU 66 HB3 LEU 66 2.283 -0.378 -7.756 518 HG LEU 66 HG LEU 66 1.703 -2.363 -6.232 519 1HD1 LEU 66 HD11 LEU 66 0.235 -0.173 -4.731 520 2HD1 LEU 66 HD12 LEU 66 -0.196 -1.900 -4.636 521 3HD1 LEU 66 HD13 LEU 66 1.367 -1.370 -4.059 522 1HD2 LEU 66 HD21 LEU 66 0.378 -1.762 -8.186 523 2HD2 LEU 66 HD22 LEU 66 -0.661 -2.319 -6.885 524 3HD2 LEU 66 HD23 LEU 66 -0.541 -0.575 -7.227 525 H GLU 67 H GLU 67 2.838 1.714 -4.796 526 HA GLU 67 HA GLU 67 3.259 0.630 -2.058 527 1HB GLU 67 HB2 GLU 67 5.056 2.182 -2.796 528 2HB GLU 67 HB3 GLU 67 3.837 3.426 -3.127 529 1HG GLU 67 HG2 GLU 67 3.241 3.431 -0.709 530 2HG GLU 67 HG3 GLU 67 4.439 2.163 -0.424 531 H LEU 68 H LEU 68 1.612 1.388 -0.573 532 HA LEU 68 HA LEU 68 -0.911 2.252 -1.926 533 1HB LEU 68 HB2 LEU 68 -0.431 0.083 0.170 534 2HB LEU 68 HB3 LEU 68 -2.028 0.657 -0.290 535 HG LEU 68 HG LEU 68 -0.110 -0.804 -2.123 536 1HD1 LEU 68 HD11 LEU 68 -1.730 -2.644 -1.974 537 2HD1 LEU 68 HD12 LEU 68 -1.106 -2.246 -0.366 538 3HD1 LEU 68 HD13 LEU 68 -2.727 -1.707 -0.847 539 1HD2 LEU 68 HD21 LEU 68 -2.078 -0.888 -3.665 540 2HD2 LEU 68 HD22 LEU 68 -2.968 0.187 -2.574 541 3HD2 LEU 68 HD23 LEU 68 -1.483 0.724 -3.396 542 H SER 69 H SER 69 -2.579 2.941 -0.348 543 HA SER 69 HA SER 69 -1.773 4.917 1.513 544 1HB SER 69 HB2 SER 69 -4.174 4.511 2.322 545 2HB SER 69 HB3 SER 69 -3.959 4.919 0.606 546 HG SER 69 HG SER 69 -5.358 3.009 1.326 547 H ASN 70 H ASN 70 -2.599 1.471 1.905 548 HA ASN 70 HA ASN 70 -2.204 1.023 4.605 549 1HB ASN 70 HB2 ASN 70 -2.973 -0.741 3.170 550 2HB ASN 70 HB3 ASN 70 -1.518 -0.671 2.174 551 1HD2 ASN 70 HD22 ASN 70 -2.598 -1.477 5.540 552 2HD2 ASN 70 HD21 ASN 70 -1.325 -2.636 5.802 553 H SER 71 H SER 71 0.424 1.627 2.203 554 HA SER 71 HA SER 71 2.543 0.632 3.797 555 1HB SER 71 HB2 SER 71 2.611 2.827 1.695 556 2HB SER 71 HB3 SER 71 3.969 1.861 2.271 557 HG SER 71 HG SER 71 3.474 0.462 0.868 558 H THR 72 H THR 72 0.624 3.530 4.265 559 HA THR 72 HA THR 72 2.609 5.120 5.574 560 HB THR 72 HB THR 72 0.672 6.245 6.646 561 HG1 THR 72 HG1 THR 72 -0.959 4.512 5.105 562 1HG2 THR 72 HG21 THR 72 -0.311 7.151 4.584 563 2HG2 THR 72 HG22 THR 72 1.444 6.978 4.438 564 3HG2 THR 72 HG23 THR 72 0.375 5.811 3.639 565 H GLN 73 H GLN 73 0.911 2.242 6.595 566 HA GLN 73 HA GLN 73 0.846 1.041 8.509 567 1HB GLN 73 HB2 GLN 73 3.749 1.928 8.431 568 2HB GLN 73 HB3 GLN 73 3.147 0.613 9.443 569 1HG GLN 73 HG2 GLN 73 2.622 -0.770 7.600 570 2HG GLN 73 HG3 GLN 73 2.686 0.553 6.444 571 1HE2 GLN 73 HE22 GLN 73 4.740 1.462 5.811 572 2HE2 GLN 73 HE21 GLN 73 6.221 0.539 6.012 Start of MODEL 3 1 1H THR 2 H1 THR 2 2.834 -2.798 1.314 2 2H THR 2 H2 THR 2 2.951 -1.163 1.200 3 3H THR 2 H3 THR 2 1.744 -1.954 0.422 4 HA THR 2 HA THR 2 3.394 -1.344 -1.172 5 HB THR 2 HB THR 2 5.322 -2.912 0.590 6 HG1 THR 2 HG1 THR 2 6.055 -0.886 1.185 7 1HG2 THR 2 HG21 THR 2 6.055 -2.837 -1.779 8 2HG2 THR 2 HG22 THR 2 5.808 -1.070 -1.799 9 3HG2 THR 2 HG23 THR 2 7.068 -1.793 -0.776 10 H VAL 3 H VAL 3 3.772 -2.751 -3.018 11 HA VAL 3 HA VAL 3 3.306 -5.644 -2.597 12 HB VAL 3 HB VAL 3 1.928 -4.030 -4.780 13 1HG1 VAL 3 HG11 VAL 3 1.670 -6.948 -3.972 14 2HG1 VAL 3 HG12 VAL 3 0.709 -6.120 -5.227 15 3HG1 VAL 3 HG13 VAL 3 2.436 -6.332 -5.451 16 1HG2 VAL 3 HG21 VAL 3 0.697 -5.220 -2.257 17 2HG2 VAL 3 HG22 VAL 3 0.765 -3.504 -2.695 18 3HG2 VAL 3 HG23 VAL 3 -0.225 -4.600 -3.648 19 H SER 4 H SER 4 4.578 -6.857 -4.040 20 HA SER 4 HA SER 4 6.562 -5.391 -5.705 21 1HB SER 4 HB2 SER 4 7.111 -7.478 -3.561 22 2HB SER 4 HB3 SER 4 8.325 -6.631 -4.526 23 HG SER 4 HG SER 4 8.026 -5.735 -2.404 24 H ILE 5 H ILE 5 7.829 -6.782 -7.039 25 HA ILE 5 HA ILE 5 6.387 -9.097 -8.149 26 HB ILE 5 HB ILE 5 9.075 -7.864 -8.945 27 1HG1 ILE 5 HG12 ILE 5 7.567 -7.132 -11.007 28 2HG1 ILE 5 HG13 ILE 5 6.246 -7.209 -9.856 29 1HG2 ILE 5 HG21 ILE 5 7.200 -9.767 -10.427 30 2HG2 ILE 5 HG22 ILE 5 8.696 -9.067 -11.082 31 3HG2 ILE 5 HG23 ILE 5 8.788 -10.175 -9.736 32 1HD1 ILE 5 HD11 ILE 5 8.775 -5.514 -9.534 33 2HD1 ILE 5 HD12 ILE 5 7.235 -4.930 -10.197 34 3HD1 ILE 5 HD13 ILE 5 7.329 -5.435 -8.512 35 H GLN 6 H GLN 6 7.449 -11.209 -8.122 36 HA GLN 6 HA GLN 6 9.266 -11.646 -5.805 37 1HB GLN 6 HB2 GLN 6 7.850 -13.397 -5.020 38 2HB GLN 6 HB3 GLN 6 6.916 -11.920 -5.158 39 1HG GLN 6 HG2 GLN 6 6.824 -14.269 -7.110 40 2HG GLN 6 HG3 GLN 6 5.647 -13.921 -5.853 41 1HE2 GLN 6 HE22 GLN 6 4.196 -12.042 -6.129 42 2HE2 GLN 6 HE21 GLN 6 3.995 -11.338 -7.714 43 H MET 7 H MET 7 9.612 -11.685 -8.879 44 HA MET 7 HA MET 7 11.372 -13.964 -8.932 45 1HB MET 7 HB2 MET 7 10.419 -14.938 -11.017 46 2HB MET 7 HB3 MET 7 9.350 -15.138 -9.628 47 1HG MET 7 HG2 MET 7 8.022 -13.178 -10.384 48 2HG MET 7 HG3 MET 7 9.012 -13.097 -11.844 49 1HE MET 7 HE1 MET 7 5.140 -14.755 -11.978 50 2HE MET 7 HE2 MET 7 5.799 -14.034 -10.504 51 3HE MET 7 HE3 MET 7 5.954 -13.182 -12.057 52 H ALA 8 H ALA 8 12.817 -13.769 -10.826 53 HA ALA 8 HA ALA 8 13.258 -10.984 -11.605 54 1HB ALA 8 HB1 ALA 8 15.252 -11.884 -12.699 55 2HB ALA 8 HB2 ALA 8 15.133 -12.475 -11.023 56 3HB ALA 8 HB3 ALA 8 14.700 -13.545 -12.383 57 H GLY 9 H GLY 9 12.839 -10.026 -13.571 58 1HA GLY 9 HA2 GLY 9 12.589 -11.358 -16.028 59 2HA GLY 9 HA3 GLY 9 10.967 -11.281 -15.348 60 H ASN 10 H ASN 10 10.235 -9.870 -16.978 61 HA ASN 10 HA ASN 10 11.053 -7.015 -16.648 62 1HB ASN 10 HB2 ASN 10 10.803 -8.612 -19.211 63 2HB ASN 10 HB3 ASN 10 10.281 -6.932 -19.178 64 1HD2 ASN 10 HD21 ASN 10 13.107 -7.920 -17.173 65 2HD2 ASN 10 HD22 ASN 10 14.273 -7.146 -18.226 66 H LEU 11 H LEU 11 9.305 -5.674 -16.536 67 HA LEU 11 HA LEU 11 6.879 -6.992 -15.691 68 1HB LEU 11 HB2 LEU 11 8.133 -5.135 -14.523 69 2HB LEU 11 HB3 LEU 11 7.564 -4.037 -15.771 70 HG LEU 11 HG LEU 11 5.184 -4.628 -15.110 71 1HD1 LEU 11 HD11 LEU 11 5.430 -6.818 -14.064 72 2HD1 LEU 11 HD12 LEU 11 6.605 -6.181 -12.897 73 3HD1 LEU 11 HD13 LEU 11 4.909 -5.686 -12.820 74 1HD2 LEU 11 HD21 LEU 11 7.016 -3.621 -12.890 75 2HD2 LEU 11 HD22 LEU 11 6.405 -2.657 -14.262 76 3HD2 LEU 11 HD23 LEU 11 5.285 -3.283 -13.056 77 H TRP 12 H TRP 12 6.389 -7.794 -17.851 78 HA TRP 12 HA TRP 12 5.987 -6.841 -20.225 79 1HB TRP 12 HB2 TRP 12 5.241 -9.065 -19.193 80 2HB TRP 12 HB3 TRP 12 3.702 -8.298 -18.868 81 HD1 TRP 12 HD1 TRP 12 6.012 -9.042 -21.818 82 HE1 TRP 12 HE1 TRP 12 4.660 -9.648 -23.896 83 HE3 TRP 12 HE3 TRP 12 1.325 -8.253 -19.950 84 HZ2 TRP 12 HZ2 TRP 12 1.858 -9.805 -24.646 85 HZ3 TRP 12 HZ3 TRP 12 -0.675 -8.691 -21.346 86 HH2 TRP 12 HH2 TRP 12 -0.421 -9.457 -23.696 87 H LYS 13 H LYS 13 3.294 -6.312 -17.853 88 HA LYS 13 HA LYS 13 2.737 -3.685 -19.010 89 1HB LYS 13 HB2 LYS 13 0.698 -5.958 -19.005 90 2HB LYS 13 HB3 LYS 13 0.253 -4.250 -19.125 91 1HG LYS 13 HG2 LYS 13 1.647 -4.066 -21.203 92 2HG LYS 13 HG3 LYS 13 1.919 -5.818 -21.127 93 1HD LYS 13 HD2 LYS 13 -0.592 -6.133 -21.147 94 2HD LYS 13 HD3 LYS 13 -0.764 -4.405 -21.461 95 1HE LYS 13 HE2 LYS 13 0.776 -6.391 -23.204 96 2HE LYS 13 HE3 LYS 13 -0.876 -5.853 -23.509 97 1HZ LYS 13 HZ1 LYS 13 -0.031 -3.592 -23.775 98 2HZ LYS 13 HZ2 LYS 13 1.509 -4.095 -23.530 99 3HZ LYS 13 HZ3 LYS 13 0.678 -4.603 -24.833 100 H VAL 14 H VAL 14 1.107 -2.543 -17.588 101 HA VAL 14 HA VAL 14 0.923 -3.550 -14.818 102 HB VAL 14 HB VAL 14 2.038 -0.820 -15.626 103 1HG1 VAL 14 HG11 VAL 14 1.495 -2.001 -12.857 104 2HG1 VAL 14 HG12 VAL 14 2.430 -0.523 -13.163 105 3HG1 VAL 14 HG13 VAL 14 0.721 -0.567 -13.579 106 1HG2 VAL 14 HG21 VAL 14 3.764 -2.534 -15.856 107 2HG2 VAL 14 HG22 VAL 14 4.075 -1.613 -14.390 108 3HG2 VAL 14 HG23 VAL 14 3.317 -3.226 -14.279 109 H HIS 15 H HIS 15 -0.940 -2.739 -13.785 110 HA HIS 15 HA HIS 15 -2.918 -1.403 -15.574 111 1HB HIS 15 HB2 HIS 15 -3.609 -3.648 -13.684 112 2HB HIS 15 HB3 HIS 15 -4.491 -3.085 -15.096 113 HD1 HIS 15 HD1 HIS 15 -2.337 -3.507 -17.390 114 HD2 HIS 15 HD2 HIS 15 -2.888 -6.038 -14.080 115 HE1 HIS 15 HE1 HIS 15 -1.250 -5.745 -17.989 116 H VAL 16 H VAL 16 -1.300 -0.259 -13.273 117 HA VAL 16 HA VAL 16 -3.587 0.714 -11.653 118 HB VAL 16 HB VAL 16 -2.081 0.840 -9.690 119 1HG1 VAL 16 HG11 VAL 16 -3.756 -0.938 -9.835 120 2HG1 VAL 16 HG12 VAL 16 -2.593 -1.992 -10.667 121 3HG1 VAL 16 HG13 VAL 16 -2.297 -1.484 -8.985 122 1HG2 VAL 16 HG21 VAL 16 0.115 0.555 -10.901 123 2HG2 VAL 16 HG22 VAL 16 -0.099 -0.418 -9.442 124 3HG2 VAL 16 HG23 VAL 16 -0.263 -1.174 -11.047 125 H LYS 17 H LYS 17 -3.149 2.796 -10.630 126 HA LYS 17 HA LYS 17 -0.953 4.409 -11.608 127 1HB LYS 17 HB2 LYS 17 -2.410 6.226 -12.435 128 2HB LYS 17 HB3 LYS 17 -2.541 4.774 -13.424 129 1HG LYS 17 HG2 LYS 17 -4.703 4.203 -12.340 130 2HG LYS 17 HG3 LYS 17 -4.548 5.599 -11.270 131 1HD LYS 17 HD2 LYS 17 -6.088 6.140 -13.026 132 2HD LYS 17 HD3 LYS 17 -4.627 7.118 -13.232 133 1HE LYS 17 HE2 LYS 17 -3.829 5.554 -14.997 134 2HE LYS 17 HE3 LYS 17 -5.262 4.544 -14.756 135 1HZ LYS 17 HZ1 LYS 17 -6.619 6.414 -15.499 136 2HZ LYS 17 HZ2 LYS 17 -5.296 7.348 -15.719 137 3HZ LYS 17 HZ3 LYS 17 -5.525 6.025 -16.640 138 H ALA 18 H ALA 18 -0.906 6.464 -10.270 139 HA ALA 18 HA ALA 18 -1.544 6.021 -7.535 140 1HB ALA 18 HB1 ALA 18 0.188 7.619 -8.266 141 2HB ALA 18 HB2 ALA 18 -1.063 8.652 -9.003 142 3HB ALA 18 HB3 ALA 18 -1.024 8.413 -7.243 143 H GLY 19 H GLY 19 -3.340 6.415 -6.343 144 1HA GLY 19 HA2 GLY 19 -5.382 7.314 -5.748 145 2HA GLY 19 HA3 GLY 19 -5.568 8.045 -7.346 146 H ASP 20 H ASP 20 -4.729 4.918 -8.133 147 HA ASP 20 HA ASP 20 -7.461 4.081 -8.633 148 1HB ASP 20 HB2 ASP 20 -5.438 3.505 -10.058 149 2HB ASP 20 HB3 ASP 20 -4.914 2.425 -8.761 150 H GLN 21 H GLN 21 -8.178 1.850 -7.855 151 HA GLN 21 HA GLN 21 -7.491 1.355 -4.977 152 1HB GLN 21 HB2 GLN 21 -9.797 2.209 -5.209 153 2HB GLN 21 HB3 GLN 21 -10.111 1.069 -6.508 154 1HG GLN 21 HG2 GLN 21 -11.217 0.206 -4.630 155 2HG GLN 21 HG3 GLN 21 -9.834 -0.835 -4.864 156 1HE2 GLN 21 HE22 GLN 21 -8.737 -1.340 -2.923 157 2HE2 GLN 21 HE21 GLN 21 -8.852 -0.357 -1.481 158 H ILE 22 H ILE 22 -6.829 -0.736 -4.563 159 HA ILE 22 HA ILE 22 -7.401 -2.828 -6.589 160 HB ILE 22 HB ILE 22 -5.255 -3.812 -6.392 161 1HG1 ILE 22 HG12 ILE 22 -4.521 -1.671 -4.354 162 2HG1 ILE 22 HG13 ILE 22 -4.709 -3.405 -4.066 163 1HG2 ILE 22 HG21 ILE 22 -5.564 -1.951 -8.027 164 2HG2 ILE 22 HG22 ILE 22 -4.798 -0.841 -6.869 165 3HG2 ILE 22 HG23 ILE 22 -3.889 -2.199 -7.545 166 1HD1 ILE 22 HD11 ILE 22 -2.518 -2.035 -5.655 167 2HD1 ILE 22 HD12 ILE 22 -2.380 -3.008 -4.173 168 3HD1 ILE 22 HD13 ILE 22 -2.792 -3.789 -5.700 169 H GLU 23 H GLU 23 -7.227 -5.044 -5.581 170 HA GLU 23 HA GLU 23 -7.996 -5.093 -2.734 171 1HB GLU 23 HB2 GLU 23 -10.051 -4.853 -4.046 172 2HB GLU 23 HB3 GLU 23 -9.593 -6.241 -5.056 173 1HG GLU 23 HG2 GLU 23 -9.713 -7.720 -3.069 174 2HG GLU 23 HG3 GLU 23 -10.074 -6.333 -2.041 175 H LYS 24 H LYS 24 -7.219 -6.998 -1.754 176 HA LYS 24 HA LYS 24 -5.037 -8.331 -2.718 177 1HB LYS 24 HB2 LYS 24 -5.949 -8.378 -0.392 178 2HB LYS 24 HB3 LYS 24 -7.193 -9.518 -0.915 179 1HG LYS 24 HG2 LYS 24 -5.422 -11.157 -1.543 180 2HG LYS 24 HG3 LYS 24 -4.186 -9.997 -1.052 181 1HD LYS 24 HD2 LYS 24 -5.226 -10.033 1.294 182 2HD LYS 24 HD3 LYS 24 -6.306 -11.302 0.708 183 1HE LYS 24 HE2 LYS 24 -4.628 -12.547 1.722 184 2HE LYS 24 HE3 LYS 24 -4.150 -12.580 0.023 185 1HZ LYS 24 HZ1 LYS 24 -2.615 -10.685 0.586 186 2HZ LYS 24 HZ2 LYS 24 -3.007 -10.877 2.160 187 3HZ LYS 24 HZ3 LYS 24 -2.252 -12.082 1.367 188 H GLY 25 H GLY 25 -4.625 -9.721 -4.369 189 1HA GLY 25 HA2 GLY 25 -4.892 -11.679 -5.582 190 2HA GLY 25 HA3 GLY 25 -6.591 -11.784 -5.114 191 H GLN 26 H GLN 26 -6.494 -8.630 -6.074 192 HA GLN 26 HA GLN 26 -7.523 -9.092 -8.728 193 1HB GLN 26 HB2 GLN 26 -7.952 -7.057 -7.179 194 2HB GLN 26 HB3 GLN 26 -6.317 -6.520 -7.624 195 1HG GLN 26 HG2 GLN 26 -7.271 -6.829 -10.112 196 2HG GLN 26 HG3 GLN 26 -8.828 -6.727 -9.309 197 1HE2 GLN 26 HE22 GLN 26 -6.039 -4.994 -10.445 198 2HE2 GLN 26 HE21 GLN 26 -6.551 -3.391 -9.930 199 H GLU 27 H GLU 27 -6.396 -8.975 -10.695 200 HA GLU 27 HA GLU 27 -3.502 -9.179 -10.782 201 1HB GLU 27 HB2 GLU 27 -5.117 -10.177 -12.435 202 2HB GLU 27 HB3 GLU 27 -5.558 -8.546 -12.948 203 1HG GLU 27 HG2 GLU 27 -3.153 -8.191 -13.640 204 2HG GLU 27 HG3 GLU 27 -2.818 -9.863 -13.195 205 H VAL 28 H VAL 28 -2.035 -7.519 -11.078 206 HA VAL 28 HA VAL 28 -3.020 -4.758 -11.563 207 HB VAL 28 HB VAL 28 -1.416 -3.958 -9.794 208 1HG1 VAL 28 HG11 VAL 28 -3.862 -4.013 -9.433 209 2HG1 VAL 28 HG12 VAL 28 -3.736 -5.660 -8.779 210 3HG1 VAL 28 HG13 VAL 28 -2.956 -4.309 -7.943 211 1HG2 VAL 28 HG21 VAL 28 -0.782 -5.458 -7.979 212 2HG2 VAL 28 HG22 VAL 28 -1.540 -6.823 -8.814 213 3HG2 VAL 28 HG23 VAL 28 -0.092 -6.059 -9.500 214 H ALA 29 H ALA 29 -0.540 -7.215 -12.113 215 HA ALA 29 HA ALA 29 0.337 -5.604 -14.348 216 1HB ALA 29 HB1 ALA 29 2.758 -5.702 -13.765 217 2HB ALA 29 HB2 ALA 29 1.862 -4.690 -12.632 218 3HB ALA 29 HB3 ALA 29 2.354 -6.326 -12.157 219 H ILE 30 H ILE 30 2.204 -6.953 -15.449 220 HA ILE 30 HA ILE 30 1.839 -9.869 -15.073 221 HB ILE 30 HB ILE 30 1.530 -8.342 -17.689 222 1HG1 ILE 30 HG12 ILE 30 -0.298 -10.413 -16.380 223 2HG1 ILE 30 HG13 ILE 30 -0.522 -8.678 -16.247 224 1HG2 ILE 30 HG21 ILE 30 3.019 -10.313 -18.095 225 2HG2 ILE 30 HG22 ILE 30 1.819 -11.368 -17.320 226 3HG2 ILE 30 HG23 ILE 30 1.465 -10.544 -18.851 227 1HD1 ILE 30 HD11 ILE 30 -2.028 -9.483 -17.908 228 2HD1 ILE 30 HD12 ILE 30 -0.792 -8.498 -18.707 229 3HD1 ILE 30 HD13 ILE 30 -0.736 -10.279 -18.812 230 H LEU 31 H LEU 31 3.696 -10.978 -15.520 231 HA LEU 31 HA LEU 31 6.228 -9.428 -15.836 232 1HB LEU 31 HB2 LEU 31 5.833 -10.158 -13.583 233 2HB LEU 31 HB3 LEU 31 5.391 -11.790 -14.085 234 HG LEU 31 HG LEU 31 7.552 -11.512 -12.917 235 1HD1 LEU 31 HD11 LEU 31 8.808 -13.090 -14.186 236 2HD1 LEU 31 HD12 LEU 31 7.088 -13.482 -14.340 237 3HD1 LEU 31 HD13 LEU 31 7.939 -12.702 -15.677 238 1HD2 LEU 31 HD21 LEU 31 8.681 -10.368 -15.471 239 2HD2 LEU 31 HD22 LEU 31 8.141 -9.358 -14.116 240 3HD2 LEU 31 HD23 LEU 31 9.445 -10.532 -13.868 241 H GLU 32 H GLU 32 7.516 -10.165 -17.480 242 HA GLU 32 HA GLU 32 6.823 -12.707 -18.875 243 1HB GLU 32 HB2 GLU 32 6.656 -10.711 -20.293 244 2HB GLU 32 HB3 GLU 32 8.287 -10.207 -19.829 245 1HG GLU 32 HG2 GLU 32 9.180 -12.326 -20.860 246 2HG GLU 32 HG3 GLU 32 7.542 -12.737 -21.365 247 H SER 33 H SER 33 8.283 -14.323 -18.561 248 HA SER 33 HA SER 33 11.092 -13.966 -18.383 249 1HB SER 33 HB2 SER 33 10.309 -13.220 -16.016 250 2HB SER 33 HB3 SER 33 9.846 -14.905 -15.758 251 HG SER 33 HG SER 33 12.013 -14.113 -15.117 252 H MET 34 H MET 34 12.062 -16.231 -17.825 253 HA MET 34 HA MET 34 12.232 -18.365 -18.602 254 1HB MET 34 HB2 MET 34 10.902 -19.938 -17.227 255 2HB MET 34 HB3 MET 34 11.700 -18.655 -16.331 256 1HG MET 34 HG2 MET 34 9.571 -17.425 -16.144 257 2HG MET 34 HG3 MET 34 8.738 -18.716 -17.017 258 1HE MET 34 HE1 MET 34 7.049 -18.411 -14.809 259 2HE MET 34 HE2 MET 34 7.616 -18.654 -13.144 260 3HE MET 34 HE3 MET 34 8.201 -17.266 -14.083 261 H LYS 35 H LYS 35 11.074 -16.950 -20.603 262 HA LYS 35 HA LYS 35 9.885 -17.012 -22.503 263 1HB LYS 35 HB2 LYS 35 10.193 -20.024 -22.218 264 2HB LYS 35 HB3 LYS 35 9.780 -19.154 -23.699 265 1HG LYS 35 HG2 LYS 35 11.949 -17.939 -23.599 266 2HG LYS 35 HG3 LYS 35 12.394 -18.879 -22.160 267 1HD LYS 35 HD2 LYS 35 12.220 -20.984 -23.475 268 2HD LYS 35 HD3 LYS 35 11.721 -20.056 -24.890 269 1HE LYS 35 HE2 LYS 35 14.033 -20.578 -25.170 270 2HE LYS 35 HE3 LYS 35 13.900 -18.844 -24.870 271 1HZ LYS 35 HZ1 LYS 35 15.702 -19.857 -23.614 272 2HZ LYS 35 HZ2 LYS 35 14.599 -19.260 -22.579 273 3HZ LYS 35 HZ3 LYS 35 14.686 -20.873 -22.852 274 H MET 36 H MET 36 8.257 -16.762 -20.141 275 HA MET 36 HA MET 36 5.639 -17.552 -21.253 276 1HB MET 36 HB2 MET 36 6.651 -18.113 -18.421 277 2HB MET 36 HB3 MET 36 4.950 -18.166 -18.886 278 1HG MET 36 HG2 MET 36 5.440 -19.955 -20.519 279 2HG MET 36 HG3 MET 36 7.131 -19.947 -20.011 280 1HE MET 36 HE1 MET 36 7.127 -22.510 -19.567 281 2HE MET 36 HE2 MET 36 5.907 -23.350 -18.585 282 3HE MET 36 HE3 MET 36 5.437 -22.583 -20.118 283 H GLU 37 H GLU 37 3.912 -16.388 -19.895 284 HA GLU 37 HA GLU 37 4.861 -13.852 -18.719 285 1HB GLU 37 HB2 GLU 37 2.359 -14.121 -20.435 286 2HB GLU 37 HB3 GLU 37 2.884 -12.709 -19.531 287 1HG GLU 37 HG2 GLU 37 3.535 -12.162 -21.673 288 2HG GLU 37 HG3 GLU 37 5.031 -12.749 -20.962 289 H ILE 38 H ILE 38 3.866 -13.450 -16.757 290 HA ILE 38 HA ILE 38 1.914 -15.442 -15.736 291 HB ILE 38 HB ILE 38 4.450 -14.529 -14.287 292 1HG1 ILE 38 HG12 ILE 38 4.923 -17.169 -14.567 293 2HG1 ILE 38 HG13 ILE 38 4.013 -16.951 -16.047 294 1HG2 ILE 38 HG21 ILE 38 2.605 -15.162 -12.791 295 2HG2 ILE 38 HG22 ILE 38 2.393 -16.702 -13.665 296 3HG2 ILE 38 HG23 ILE 38 3.861 -16.391 -12.729 297 1HD1 ILE 38 HD11 ILE 38 6.405 -16.745 -16.476 298 2HD1 ILE 38 HD12 ILE 38 5.714 -15.133 -16.687 299 3HD1 ILE 38 HD13 ILE 38 6.583 -15.540 -15.197 300 HA PRO 39 HA PRO 39 0.238 -11.487 -14.401 301 1HB PRO 39 HB2 PRO 39 -1.709 -12.289 -12.641 302 2HB PRO 39 HB3 PRO 39 -1.850 -12.466 -14.417 303 1HG PRO 39 HG2 PRO 39 -0.968 -14.560 -12.409 304 2HG PRO 39 HG3 PRO 39 -2.175 -14.725 -13.726 305 1HD PRO 39 HD2 PRO 39 0.397 -15.549 -14.028 306 2HD PRO 39 HD3 PRO 39 -0.490 -14.795 -15.384 307 H ILE 40 H ILE 40 0.305 -10.094 -12.629 308 HA ILE 40 HA ILE 40 1.580 -11.023 -10.104 309 HB ILE 40 HB ILE 40 1.975 -8.417 -11.613 310 1HG1 ILE 40 HG12 ILE 40 3.282 -10.206 -12.661 311 2HG1 ILE 40 HG13 ILE 40 4.275 -8.952 -11.944 312 1HG2 ILE 40 HG21 ILE 40 3.674 -7.903 -9.818 313 2HG2 ILE 40 HG22 ILE 40 1.995 -7.902 -9.266 314 3HG2 ILE 40 HG23 ILE 40 3.043 -9.281 -8.898 315 1HD1 ILE 40 HD11 ILE 40 3.746 -11.686 -10.693 316 2HD1 ILE 40 HD12 ILE 40 5.227 -11.164 -11.512 317 3HD1 ILE 40 HD13 ILE 40 4.762 -10.399 -9.997 318 H VAL 41 H VAL 41 0.335 -10.551 -8.393 319 HA VAL 41 HA VAL 41 -2.179 -9.057 -8.863 320 HB VAL 41 HB VAL 41 -3.107 -10.641 -7.103 321 1HG1 VAL 41 HG11 VAL 41 -3.497 -12.485 -8.684 322 2HG1 VAL 41 HG12 VAL 41 -3.731 -10.905 -9.414 323 3HG1 VAL 41 HG13 VAL 41 -2.247 -11.827 -9.770 324 1HG2 VAL 41 HG21 VAL 41 -0.694 -12.365 -7.800 325 2HG2 VAL 41 HG22 VAL 41 -0.915 -11.511 -6.251 326 3HG2 VAL 41 HG23 VAL 41 -2.049 -12.779 -6.738 327 H ALA 42 H ALA 42 -3.158 -8.067 -7.041 328 HA ALA 42 HA ALA 42 -1.452 -6.509 -5.375 329 1HB ALA 42 HB1 ALA 42 -4.401 -7.201 -5.154 330 2HB ALA 42 HB2 ALA 42 -3.597 -5.857 -4.323 331 3HB ALA 42 HB3 ALA 42 -3.744 -5.857 -6.098 332 H ASP 43 H ASP 43 -0.253 -7.390 -3.737 333 HA ASP 43 HA ASP 43 -0.836 -9.843 -2.377 334 1HB ASP 43 HB2 ASP 43 1.420 -8.959 -2.449 335 2HB ASP 43 HB3 ASP 43 0.912 -7.457 -1.675 336 H ARG 44 H ARG 44 -2.029 -6.568 -1.934 337 HA ARG 44 HA ARG 44 -3.854 -7.406 0.156 338 1HB ARG 44 HB2 ARG 44 -3.130 -5.744 1.791 339 2HB ARG 44 HB3 ARG 44 -1.840 -6.904 1.479 340 1HG ARG 44 HG2 ARG 44 -0.953 -5.087 -0.244 341 2HG ARG 44 HG3 ARG 44 -2.053 -4.008 0.617 342 1HD ARG 44 HD2 ARG 44 0.121 -3.746 1.547 343 2HD ARG 44 HD3 ARG 44 -0.851 -4.618 2.751 344 HE ARG 44 HE ARG 44 0.444 -6.583 1.220 345 1HH1 ARG 44 HH21 ARG 44 1.458 -3.980 3.480 346 2HH1 ARG 44 HH22 ARG 44 2.931 -4.789 3.876 347 1HH2 ARG 44 HH11 ARG 44 2.239 -7.583 1.771 348 2HH2 ARG 44 HH12 ARG 44 3.422 -6.927 2.888 349 H SER 45 H SER 45 -5.524 -5.739 0.472 350 HA SER 45 HA SER 45 -6.100 -4.246 -1.920 351 1HB SER 45 HB2 SER 45 -7.472 -4.134 0.800 352 2HB SER 45 HB3 SER 45 -8.187 -3.782 -0.781 353 HG SER 45 HG SER 45 -8.642 -5.918 0.136 354 H GLY 46 H GLY 46 -6.440 -1.904 -2.049 355 1HA GLY 46 HA2 GLY 46 -6.378 -0.088 -0.013 356 2HA GLY 46 HA3 GLY 46 -4.662 -0.280 -0.399 357 H ILE 47 H ILE 47 -5.505 2.166 -0.702 358 HA ILE 47 HA ILE 47 -6.142 2.663 -3.547 359 HB ILE 47 HB ILE 47 -5.594 4.474 -1.162 360 1HG1 ILE 47 HG12 ILE 47 -7.862 3.453 -1.246 361 2HG1 ILE 47 HG13 ILE 47 -7.862 5.205 -1.329 362 1HG2 ILE 47 HG21 ILE 47 -4.606 5.641 -3.009 363 2HG2 ILE 47 HG22 ILE 47 -5.993 5.298 -4.062 364 3HG2 ILE 47 HG23 ILE 47 -6.161 6.401 -2.676 365 1HD1 ILE 47 HD11 ILE 47 -8.236 3.360 -3.729 366 2HD1 ILE 47 HD12 ILE 47 -9.520 4.214 -2.856 367 3HD1 ILE 47 HD13 ILE 47 -8.313 5.138 -3.756 368 H VAL 48 H VAL 48 -4.535 3.094 -4.991 369 HA VAL 48 HA VAL 48 -1.775 2.450 -4.394 370 HB VAL 48 HB VAL 48 -3.082 3.661 -6.833 371 1HG1 VAL 48 HG11 VAL 48 -1.079 2.803 -8.022 372 2HG1 VAL 48 HG12 VAL 48 -0.618 4.008 -6.817 373 3HG1 VAL 48 HG13 VAL 48 -0.369 2.284 -6.477 374 1HG2 VAL 48 HG21 VAL 48 -2.394 0.754 -6.187 375 2HG2 VAL 48 HG22 VAL 48 -4.030 1.432 -6.324 376 3HG2 VAL 48 HG23 VAL 48 -2.998 1.362 -7.743 377 H LYS 49 H LYS 49 -0.566 3.801 -3.186 378 HA LYS 49 HA LYS 49 -1.056 6.683 -3.093 379 1HB LYS 49 HB2 LYS 49 -0.200 5.457 -1.106 380 2HB LYS 49 HB3 LYS 49 1.234 4.973 -2.006 381 1HG LYS 49 HG2 LYS 49 1.766 6.791 -0.520 382 2HG LYS 49 HG3 LYS 49 1.929 7.344 -2.187 383 1HD LYS 49 HD2 LYS 49 -0.255 8.504 -2.035 384 2HD LYS 49 HD3 LYS 49 -0.491 7.863 -0.392 385 1HE LYS 49 HE2 LYS 49 1.556 9.060 0.356 386 2HE LYS 49 HE3 LYS 49 1.790 9.691 -1.279 387 1HZ LYS 49 HZ1 LYS 49 -0.318 10.874 -1.053 388 2HZ LYS 49 HZ2 LYS 49 -0.536 10.289 0.460 389 3HZ LYS 49 HZ3 LYS 49 0.698 11.302 0.144 390 H GLU 50 H GLU 50 1.367 4.361 -4.506 391 HA GLU 50 HA GLU 50 1.795 6.195 -6.723 392 1HB GLU 50 HB2 GLU 50 3.266 7.157 -4.913 393 2HB GLU 50 HB3 GLU 50 4.082 5.605 -4.776 394 1HG GLU 50 HG2 GLU 50 5.377 7.264 -6.044 395 2HG GLU 50 HG3 GLU 50 5.025 5.841 -6.998 396 H VAL 51 H VAL 51 3.138 5.173 -8.400 397 HA VAL 51 HA VAL 51 3.363 2.199 -8.118 398 HB VAL 51 HB VAL 51 2.968 3.804 -10.683 399 1HG1 VAL 51 HG11 VAL 51 4.103 1.628 -11.015 400 2HG1 VAL 51 HG12 VAL 51 2.815 0.800 -10.115 401 3HG1 VAL 51 HG13 VAL 51 2.470 1.584 -11.672 402 1HG2 VAL 51 HG21 VAL 51 0.918 2.199 -9.099 403 2HG2 VAL 51 HG22 VAL 51 0.891 3.958 -9.371 404 3HG2 VAL 51 HG23 VAL 51 0.675 2.862 -10.733 405 H LYS 52 H LYS 52 5.383 1.347 -8.537 406 HA LYS 52 HA LYS 52 7.562 3.389 -8.632 407 1HB LYS 52 HB2 LYS 52 7.546 0.561 -7.514 408 2HB LYS 52 HB3 LYS 52 8.852 1.735 -7.356 409 1HG LYS 52 HG2 LYS 52 6.085 1.916 -6.088 410 2HG LYS 52 HG3 LYS 52 7.607 1.537 -5.289 411 1HD LYS 52 HD2 LYS 52 8.463 3.803 -5.763 412 2HD LYS 52 HD3 LYS 52 6.913 4.227 -6.540 413 1HE LYS 52 HE2 LYS 52 5.692 3.801 -4.488 414 2HE LYS 52 HE3 LYS 52 7.144 3.190 -3.688 415 1HZ LYS 52 HZ1 LYS 52 6.821 5.996 -4.586 416 2HZ LYS 52 HZ2 LYS 52 6.575 5.449 -3.056 417 3HZ LYS 52 HZ3 LYS 52 8.075 5.387 -3.725 418 H LYS 53 H LYS 53 6.140 1.430 -10.853 419 HA LYS 53 HA LYS 53 8.643 0.930 -12.340 420 1HB LYS 53 HB2 LYS 53 6.514 -1.156 -11.653 421 2HB LYS 53 HB3 LYS 53 7.739 -1.371 -12.902 422 1HG LYS 53 HG2 LYS 53 8.432 -0.952 -9.978 423 2HG LYS 53 HG3 LYS 53 8.244 -2.531 -10.753 424 1HD LYS 53 HD2 LYS 53 9.997 -1.971 -12.390 425 2HD LYS 53 HD3 LYS 53 10.234 -0.388 -11.619 426 1HE LYS 53 HE2 LYS 53 10.999 -1.427 -9.560 427 2HE LYS 53 HE3 LYS 53 10.604 -3.032 -10.151 428 1HZ LYS 53 HZ1 LYS 53 12.246 -2.639 -11.970 429 2HZ LYS 53 HZ2 LYS 53 12.709 -1.251 -11.223 430 3HZ LYS 53 HZ3 LYS 53 12.876 -2.720 -10.463 431 H LYS 54 H LYS 54 7.841 -0.099 -14.592 432 HA LYS 54 HA LYS 54 5.373 1.119 -15.555 433 1HB LYS 54 HB2 LYS 54 6.464 2.350 -17.358 434 2HB LYS 54 HB3 LYS 54 6.948 2.993 -15.791 435 1HG LYS 54 HG2 LYS 54 9.108 1.778 -15.934 436 2HG LYS 54 HG3 LYS 54 8.646 1.102 -17.499 437 1HD LYS 54 HD2 LYS 54 8.964 4.075 -16.906 438 2HD LYS 54 HD3 LYS 54 10.195 3.039 -17.647 439 1HE LYS 54 HE2 LYS 54 8.629 2.524 -19.521 440 2HE LYS 54 HE3 LYS 54 7.432 3.615 -18.811 441 1HZ LYS 54 HZ1 LYS 54 9.010 5.436 -19.111 442 2HZ LYS 54 HZ2 LYS 54 10.114 4.426 -19.773 443 3HZ LYS 54 HZ3 LYS 54 8.705 4.710 -20.536 444 H GLU 55 H GLU 55 4.961 0.405 -17.785 445 HA GLU 55 HA GLU 55 5.268 -2.349 -18.114 446 1HB GLU 55 HB2 GLU 55 4.799 -0.324 -20.351 447 2HB GLU 55 HB3 GLU 55 4.410 -2.039 -20.352 448 1HG GLU 55 HG2 GLU 55 2.341 -1.272 -19.850 449 2HG GLU 55 HG3 GLU 55 2.950 -1.369 -18.204 450 H GLY 56 H GLY 56 6.864 -3.604 -18.817 451 1HA GLY 56 HA2 GLY 56 8.568 -4.379 -20.132 452 2HA GLY 56 HA3 GLY 56 8.756 -2.784 -20.871 453 H ASP 57 H ASP 57 8.872 -2.198 -17.525 454 HA ASP 57 HA ASP 57 11.740 -1.816 -17.640 455 1HB ASP 57 HB2 ASP 57 10.205 -0.365 -16.317 456 2HB ASP 57 HB3 ASP 57 9.925 -1.711 -15.205 457 H PHE 58 H PHE 58 13.285 -2.787 -16.153 458 HA PHE 58 HA PHE 58 13.091 -5.698 -15.971 459 1HB PHE 58 HB2 PHE 58 15.232 -4.547 -16.393 460 2HB PHE 58 HB3 PHE 58 15.076 -3.671 -14.878 461 HD1 PHE 58 HD1 PHE 58 15.733 -6.999 -16.402 462 HD2 PHE 58 HD2 PHE 58 15.638 -4.711 -12.743 463 HE1 PHE 58 HE1 PHE 58 16.994 -8.792 -15.244 464 HE2 PHE 58 HE2 PHE 58 16.911 -6.505 -11.595 465 HZ PHE 58 HZ PHE 58 17.612 -8.537 -12.851 466 H VAL 59 H VAL 59 12.748 -6.912 -14.079 467 HA VAL 59 HA VAL 59 12.268 -5.528 -11.537 468 HB VAL 59 HB VAL 59 10.144 -6.938 -11.273 469 1HG1 VAL 59 HG11 VAL 59 10.142 -4.508 -11.398 470 2HG1 VAL 59 HG12 VAL 59 10.037 -4.566 -13.175 471 3HG1 VAL 59 HG13 VAL 59 8.712 -5.186 -12.175 472 1HG2 VAL 59 HG21 VAL 59 8.818 -7.399 -13.261 473 2HG2 VAL 59 HG22 VAL 59 10.125 -6.847 -14.317 474 3HG2 VAL 59 HG23 VAL 59 10.345 -8.308 -13.326 475 H ASN 60 H ASN 60 12.054 -7.105 -9.742 476 HA ASN 60 HA ASN 60 13.407 -9.635 -10.261 477 1HB ASN 60 HB2 ASN 60 14.969 -7.390 -9.746 478 2HB ASN 60 HB3 ASN 60 14.754 -8.080 -8.137 479 1HD2 ASN 60 HD22 ASN 60 15.453 -9.044 -11.548 480 2HD2 ASN 60 HD21 ASN 60 16.619 -10.286 -11.135 481 H GLU 61 H GLU 61 13.805 -10.831 -8.196 482 HA GLU 61 HA GLU 61 11.348 -11.128 -6.768 483 1HB GLU 61 HB2 GLU 61 12.875 -12.970 -7.210 484 2HB GLU 61 HB3 GLU 61 14.174 -12.176 -6.328 485 1HG GLU 61 HG2 GLU 61 12.774 -12.339 -4.228 486 2HG GLU 61 HG3 GLU 61 11.531 -13.173 -5.158 487 H GLY 62 H GLY 62 10.598 -9.565 -5.458 488 1HA GLY 62 HA2 GLY 62 10.519 -8.545 -3.366 489 2HA GLY 62 HA3 GLY 62 12.284 -8.560 -3.247 490 H ASP 63 H ASP 63 11.398 -7.485 -6.409 491 HA ASP 63 HA ASP 63 12.191 -4.753 -5.743 492 1HB ASP 63 HB2 ASP 63 12.879 -6.148 -7.803 493 2HB ASP 63 HB3 ASP 63 11.251 -5.863 -8.416 494 H VAL 64 H VAL 64 10.709 -3.041 -5.555 495 HA VAL 64 HA VAL 64 8.011 -3.770 -4.942 496 HB VAL 64 HB VAL 64 9.285 -1.019 -5.257 497 1HG1 VAL 64 HG11 VAL 64 6.671 -1.900 -3.954 498 2HG1 VAL 64 HG12 VAL 64 7.419 -0.308 -3.705 499 3HG1 VAL 64 HG13 VAL 64 6.864 -0.777 -5.312 500 1HG2 VAL 64 HG21 VAL 64 10.433 -2.349 -3.518 501 2HG2 VAL 64 HG22 VAL 64 9.445 -1.098 -2.768 502 3HG2 VAL 64 HG23 VAL 64 8.869 -2.779 -2.794 503 H LEU 65 H LEU 65 6.105 -3.365 -6.010 504 HA LEU 65 HA LEU 65 6.220 -2.571 -8.881 505 1HB LEU 65 HB2 LEU 65 5.164 -4.775 -8.482 506 2HB LEU 65 HB3 LEU 65 4.109 -4.076 -7.265 507 HG LEU 65 HG LEU 65 3.033 -2.652 -9.012 508 1HD1 LEU 65 HD11 LEU 65 4.814 -2.413 -10.632 509 2HD1 LEU 65 HD12 LEU 65 4.839 -4.172 -10.918 510 3HD1 LEU 65 HD13 LEU 65 3.434 -3.188 -11.403 511 1HD2 LEU 65 HD21 LEU 65 1.781 -4.436 -10.091 512 2HD2 LEU 65 HD22 LEU 65 3.073 -5.605 -9.735 513 3HD2 LEU 65 HD23 LEU 65 2.118 -4.896 -8.416 514 H LEU 66 H LEU 66 4.367 -2.112 -5.763 515 HA LEU 66 HA LEU 66 4.087 0.698 -6.418 516 1HB LEU 66 HB2 LEU 66 1.730 0.902 -6.425 517 2HB LEU 66 HB3 LEU 66 2.230 -0.111 -7.736 518 HG LEU 66 HG LEU 66 0.059 -0.619 -6.636 519 1HD1 LEU 66 HD11 LEU 66 1.030 -2.276 -8.052 520 2HD1 LEU 66 HD12 LEU 66 2.051 -2.894 -6.731 521 3HD1 LEU 66 HD13 LEU 66 0.284 -3.074 -6.669 522 1HD2 LEU 66 HD21 LEU 66 -0.095 -1.860 -4.593 523 2HD2 LEU 66 HD22 LEU 66 1.651 -1.817 -4.357 524 3HD2 LEU 66 HD23 LEU 66 0.711 -0.310 -4.284 525 H GLU 67 H GLU 67 2.780 1.863 -4.750 526 HA GLU 67 HA GLU 67 3.283 0.803 -2.018 527 1HB GLU 67 HB2 GLU 67 5.075 2.333 -2.716 528 2HB GLU 67 HB3 GLU 67 3.884 3.555 -3.191 529 1HG GLU 67 HG2 GLU 67 3.189 3.829 -0.859 530 2HG GLU 67 HG3 GLU 67 4.230 2.481 -0.370 531 H LEU 68 H LEU 68 1.613 1.459 -0.533 532 HA LEU 68 HA LEU 68 -0.885 2.406 -1.863 533 1HB LEU 68 HB2 LEU 68 -0.509 0.260 0.255 534 2HB LEU 68 HB3 LEU 68 -2.061 0.836 -0.324 535 HG LEU 68 HG LEU 68 -0.007 -0.666 -1.984 536 1HD1 LEU 68 HD11 LEU 68 -1.094 -2.029 -0.235 537 2HD1 LEU 68 HD12 LEU 68 -2.687 -1.577 -0.867 538 3HD1 LEU 68 HD13 LEU 68 -1.574 -2.537 -1.864 539 1HD2 LEU 68 HD21 LEU 68 -1.248 0.756 -3.445 540 2HD2 LEU 68 HD22 LEU 68 -1.931 -0.843 -3.626 541 3HD2 LEU 68 HD23 LEU 68 -2.803 0.356 -2.664 542 H SER 69 H SER 69 -2.374 3.487 -0.552 543 HA SER 69 HA SER 69 -1.350 4.969 1.739 544 1HB SER 69 HB2 SER 69 -4.149 4.843 0.560 545 2HB SER 69 HB3 SER 69 -3.475 6.124 1.583 546 HG SER 69 HG SER 69 -3.439 6.718 -0.607 547 H ASN 70 H ASN 70 -1.987 1.832 1.751 548 HA ASN 70 HA ASN 70 -3.395 1.720 4.337 549 1HB ASN 70 HB2 ASN 70 -5.215 1.493 2.651 550 2HB ASN 70 HB3 ASN 70 -4.277 0.254 1.806 551 1HD2 ASN 70 HD22 ASN 70 -5.053 -1.831 2.248 552 2HD2 ASN 70 HD21 ASN 70 -5.566 -2.333 3.837 553 H SER 71 H SER 71 -2.878 -0.260 5.431 554 HA SER 71 HA SER 71 -1.315 -1.747 6.165 555 1HB SER 71 HB2 SER 71 -2.111 -2.920 3.482 556 2HB SER 71 HB3 SER 71 -1.440 -3.833 4.851 557 HG SER 71 HG SER 71 -3.263 -3.320 6.056 558 H THR 72 H THR 72 0.108 0.358 5.356 559 HA THR 72 HA THR 72 2.626 -0.717 4.295 560 HB THR 72 HB THR 72 1.092 1.675 3.159 561 HG1 THR 72 HG1 THR 72 0.349 -0.183 2.288 562 1HG2 THR 72 HG21 THR 72 3.882 0.644 2.498 563 2HG2 THR 72 HG22 THR 72 2.953 1.775 1.484 564 3HG2 THR 72 HG23 THR 72 3.442 2.252 3.111 565 H GLN 73 H GLN 73 4.403 0.555 5.128 566 HA GLN 73 HA GLN 73 3.872 2.811 6.923 567 1HB GLN 73 HB2 GLN 73 5.278 0.240 7.808 568 2HB GLN 73 HB3 GLN 73 5.321 1.772 8.678 569 1HG GLN 73 HG2 GLN 73 2.835 1.671 8.951 570 2HG GLN 73 HG3 GLN 73 2.836 0.082 8.172 571 1HE2 GLN 73 HE22 GLN 73 3.812 1.877 11.093 572 2HE2 GLN 73 HE21 GLN 73 4.115 0.470 12.080 Start of MODEL 4 1 1H THR 2 H1 THR 2 5.677 -4.122 0.639 2 2H THR 2 H2 THR 2 5.972 -3.141 -0.656 3 3H THR 2 H3 THR 2 5.812 -2.506 0.855 4 HA THR 2 HA THR 2 3.575 -3.299 1.005 5 HB THR 2 HB THR 2 3.942 -1.341 -1.273 6 HG1 THR 2 HG1 THR 2 4.949 -0.216 0.174 7 1HG2 THR 2 HG21 THR 2 1.786 -1.794 0.844 8 2HG2 THR 2 HG22 THR 2 1.920 -0.319 -0.123 9 3HG2 THR 2 HG23 THR 2 1.600 -1.866 -0.921 10 H VAL 3 H VAL 3 3.947 -3.009 -2.648 11 HA VAL 3 HA VAL 3 3.185 -5.872 -2.794 12 HB VAL 3 HB VAL 3 2.018 -3.711 -4.576 13 1HG1 VAL 3 HG11 VAL 3 1.383 -6.681 -4.328 14 2HG1 VAL 3 HG12 VAL 3 0.582 -5.523 -5.421 15 3HG1 VAL 3 HG13 VAL 3 2.281 -5.924 -5.662 16 1HG2 VAL 3 HG21 VAL 3 -0.197 -4.286 -3.549 17 2HG2 VAL 3 HG22 VAL 3 0.664 -5.221 -2.302 18 3HG2 VAL 3 HG23 VAL 3 0.897 -3.466 -2.441 19 H SER 4 H SER 4 4.550 -6.920 -4.119 20 HA SER 4 HA SER 4 6.527 -5.436 -5.764 21 1HB SER 4 HB2 SER 4 7.124 -7.506 -3.618 22 2HB SER 4 HB3 SER 4 8.312 -6.622 -4.580 23 HG SER 4 HG SER 4 7.987 -5.755 -2.447 24 H ILE 5 H ILE 5 7.869 -6.886 -7.018 25 HA ILE 5 HA ILE 5 6.413 -9.200 -8.132 26 HB ILE 5 HB ILE 5 9.076 -7.906 -8.926 27 1HG1 ILE 5 HG12 ILE 5 7.580 -7.263 -11.015 28 2HG1 ILE 5 HG13 ILE 5 6.233 -7.408 -9.902 29 1HG2 ILE 5 HG21 ILE 5 7.304 -9.898 -10.419 30 2HG2 ILE 5 HG22 ILE 5 8.796 -9.159 -11.036 31 3HG2 ILE 5 HG23 ILE 5 8.880 -10.246 -9.672 32 1HD1 ILE 5 HD11 ILE 5 8.642 -5.559 -9.532 33 2HD1 ILE 5 HD12 ILE 5 7.086 -5.079 -10.240 34 3HD1 ILE 5 HD13 ILE 5 7.167 -5.556 -8.547 35 H GLN 6 H GLN 6 7.488 -11.335 -8.038 36 HA GLN 6 HA GLN 6 9.504 -11.647 -5.874 37 1HB GLN 6 HB2 GLN 6 8.223 -13.604 -5.030 38 2HB GLN 6 HB3 GLN 6 7.532 -12.038 -4.704 39 1HG GLN 6 HG2 GLN 6 6.557 -13.646 -7.092 40 2HG GLN 6 HG3 GLN 6 6.007 -14.032 -5.469 41 1HE2 GLN 6 HE22 GLN 6 5.140 -12.193 -8.153 42 2HE2 GLN 6 HE21 GLN 6 4.233 -10.941 -7.325 43 H MET 7 H MET 7 9.753 -11.672 -8.825 44 HA MET 7 HA MET 7 11.424 -14.001 -8.997 45 1HB MET 7 HB2 MET 7 10.441 -14.830 -11.118 46 2HB MET 7 HB3 MET 7 9.413 -15.127 -9.728 47 1HG MET 7 HG2 MET 7 8.989 -12.803 -11.638 48 2HG MET 7 HG3 MET 7 8.296 -14.401 -11.872 49 1HE MET 7 HE1 MET 7 5.815 -13.439 -12.086 50 2HE MET 7 HE2 MET 7 6.017 -15.003 -11.262 51 3HE MET 7 HE3 MET 7 4.891 -13.793 -10.614 52 H ALA 8 H ALA 8 12.859 -13.778 -10.892 53 HA ALA 8 HA ALA 8 13.327 -10.970 -11.620 54 1HB ALA 8 HB1 ALA 8 15.331 -11.862 -12.703 55 2HB ALA 8 HB2 ALA 8 15.205 -12.451 -11.028 56 3HB ALA 8 HB3 ALA 8 14.785 -13.525 -12.388 57 H GLY 9 H GLY 9 12.921 -10.016 -13.595 58 1HA GLY 9 HA2 GLY 9 12.681 -11.325 -16.055 59 2HA GLY 9 HA3 GLY 9 11.057 -11.310 -15.373 60 H ASN 10 H ASN 10 10.250 -9.883 -16.959 61 HA ASN 10 HA ASN 10 11.039 -7.017 -16.603 62 1HB ASN 10 HB2 ASN 10 10.781 -8.592 -19.177 63 2HB ASN 10 HB3 ASN 10 10.219 -6.925 -19.127 64 1HD2 ASN 10 HD22 ASN 10 13.102 -7.898 -17.186 65 2HD2 ASN 10 HD21 ASN 10 14.232 -7.074 -18.239 66 H LEU 11 H LEU 11 9.282 -5.644 -16.557 67 HA LEU 11 HA LEU 11 6.867 -6.964 -15.665 68 1HB LEU 11 HB2 LEU 11 8.113 -5.075 -14.521 69 2HB LEU 11 HB3 LEU 11 7.483 -3.998 -15.758 70 HG LEU 11 HG LEU 11 5.140 -4.680 -15.064 71 1HD1 LEU 11 HD11 LEU 11 5.459 -6.853 -14.017 72 2HD1 LEU 11 HD12 LEU 11 6.656 -6.193 -12.886 73 3HD1 LEU 11 HD13 LEU 11 4.952 -5.742 -12.750 74 1HD2 LEU 11 HD21 LEU 11 5.193 -3.347 -12.995 75 2HD2 LEU 11 HD22 LEU 11 6.941 -3.612 -12.847 76 3HD2 LEU 11 HD23 LEU 11 6.281 -2.660 -14.203 77 H TRP 12 H TRP 12 6.306 -7.815 -17.743 78 HA TRP 12 HA TRP 12 5.954 -6.893 -20.168 79 1HB TRP 12 HB2 TRP 12 5.223 -9.111 -19.074 80 2HB TRP 12 HB3 TRP 12 3.671 -8.351 -18.807 81 HD1 TRP 12 HD1 TRP 12 6.049 -9.074 -21.712 82 HE1 TRP 12 HE1 TRP 12 4.740 -9.775 -23.797 83 HE3 TRP 12 HE3 TRP 12 1.316 -8.507 -19.882 84 HZ2 TRP 12 HZ2 TRP 12 1.956 -10.120 -24.544 85 HZ3 TRP 12 HZ3 TRP 12 -0.647 -9.097 -21.269 86 HH2 TRP 12 HH2 TRP 12 -0.341 -9.897 -23.604 87 H LYS 13 H LYS 13 3.293 -6.354 -17.770 88 HA LYS 13 HA LYS 13 2.595 -3.805 -19.036 89 1HB LYS 13 HB2 LYS 13 0.668 -6.166 -18.864 90 2HB LYS 13 HB3 LYS 13 0.148 -4.488 -19.063 91 1HG LYS 13 HG2 LYS 13 1.507 -4.359 -21.178 92 2HG LYS 13 HG3 LYS 13 1.834 -6.094 -21.017 93 1HD LYS 13 HD2 LYS 13 -0.651 -6.510 -21.026 94 2HD LYS 13 HD3 LYS 13 -0.893 -4.777 -21.338 95 1HE LYS 13 HE2 LYS 13 0.518 -4.982 -23.396 96 2HE LYS 13 HE3 LYS 13 0.692 -6.715 -23.090 97 1HZ LYS 13 HZ1 LYS 13 -1.056 -6.269 -24.690 98 2HZ LYS 13 HZ2 LYS 13 -1.718 -6.928 -23.354 99 3HZ LYS 13 HZ3 LYS 13 -1.869 -5.325 -23.643 100 H VAL 14 H VAL 14 1.014 -2.631 -17.639 101 HA VAL 14 HA VAL 14 0.893 -3.557 -14.821 102 HB VAL 14 HB VAL 14 1.939 -0.826 -15.701 103 1HG1 VAL 14 HG11 VAL 14 0.667 -0.564 -13.622 104 2HG1 VAL 14 HG12 VAL 14 1.484 -1.971 -12.898 105 3HG1 VAL 14 HG13 VAL 14 2.387 -0.485 -13.245 106 1HG2 VAL 14 HG21 VAL 14 4.018 -1.565 -14.495 107 2HG2 VAL 14 HG22 VAL 14 3.289 -3.184 -14.327 108 3HG2 VAL 14 HG23 VAL 14 3.692 -2.531 -15.930 109 H HIS 15 H HIS 15 -0.969 -2.787 -13.759 110 HA HIS 15 HA HIS 15 -3.048 -1.625 -15.558 111 1HB HIS 15 HB2 HIS 15 -3.577 -3.786 -13.522 112 2HB HIS 15 HB3 HIS 15 -4.539 -3.331 -14.918 113 HD1 HIS 15 HD1 HIS 15 -2.309 -3.743 -17.218 114 HD2 HIS 15 HD2 HIS 15 -2.985 -6.243 -13.902 115 HE1 HIS 15 HE1 HIS 15 -1.269 -6.012 -17.783 116 H VAL 16 H VAL 16 -1.420 -0.263 -13.418 117 HA VAL 16 HA VAL 16 -3.674 0.700 -11.749 118 HB VAL 16 HB VAL 16 -2.091 0.947 -9.851 119 1HG1 VAL 16 HG11 VAL 16 -2.564 -1.945 -10.654 120 2HG1 VAL 16 HG12 VAL 16 -2.261 -1.325 -9.013 121 3HG1 VAL 16 HG13 VAL 16 -3.743 -0.871 -9.868 122 1HG2 VAL 16 HG21 VAL 16 0.042 0.635 -11.220 123 2HG2 VAL 16 HG22 VAL 16 -0.047 -0.172 -9.659 124 3HG2 VAL 16 HG23 VAL 16 -0.288 -1.111 -11.154 125 H LYS 17 H LYS 17 -3.236 2.796 -10.787 126 HA LYS 17 HA LYS 17 -1.062 4.406 -11.800 127 1HB LYS 17 HB2 LYS 17 -2.528 6.252 -12.544 128 2HB LYS 17 HB3 LYS 17 -2.709 4.829 -13.568 129 1HG LYS 17 HG2 LYS 17 -4.830 4.244 -12.417 130 2HG LYS 17 HG3 LYS 17 -4.648 5.647 -11.346 131 1HD LYS 17 HD2 LYS 17 -4.737 7.158 -13.311 132 2HD LYS 17 HD3 LYS 17 -4.930 5.750 -14.380 133 1HE LYS 17 HE2 LYS 17 -7.019 5.132 -13.180 134 2HE LYS 17 HE3 LYS 17 -6.827 6.532 -12.117 135 1HZ LYS 17 HZ1 LYS 17 -7.061 7.960 -14.066 136 2HZ LYS 17 HZ2 LYS 17 -7.238 6.665 -15.049 137 3HZ LYS 17 HZ3 LYS 17 -8.362 6.992 -13.918 138 H ALA 18 H ALA 18 -0.894 6.346 -10.359 139 HA ALA 18 HA ALA 18 -1.616 5.867 -7.652 140 1HB ALA 18 HB1 ALA 18 -0.943 8.505 -9.029 141 2HB ALA 18 HB2 ALA 18 -0.970 8.218 -7.276 142 3HB ALA 18 HB3 ALA 18 0.223 7.380 -8.287 143 H GLY 19 H GLY 19 -3.435 6.318 -6.514 144 1HA GLY 19 HA2 GLY 19 -5.449 7.362 -5.975 145 2HA GLY 19 HA3 GLY 19 -5.587 8.018 -7.611 146 H ASP 20 H ASP 20 -4.806 4.882 -8.306 147 HA ASP 20 HA ASP 20 -7.553 4.066 -8.773 148 1HB ASP 20 HB2 ASP 20 -5.553 3.456 -10.212 149 2HB ASP 20 HB3 ASP 20 -5.022 2.382 -8.909 150 H GLN 21 H GLN 21 -8.314 1.884 -7.954 151 HA GLN 21 HA GLN 21 -7.600 1.407 -5.078 152 1HB GLN 21 HB2 GLN 21 -9.922 2.212 -5.336 153 2HB GLN 21 HB3 GLN 21 -10.203 1.050 -6.622 154 1HG GLN 21 HG2 GLN 21 -11.307 0.186 -4.745 155 2HG GLN 21 HG3 GLN 21 -9.900 -0.826 -4.950 156 1HE2 GLN 21 HE22 GLN 21 -8.798 -1.272 -2.997 157 2HE2 GLN 21 HE21 GLN 21 -8.944 -0.270 -1.571 158 H ILE 22 H ILE 22 -6.913 -0.675 -4.628 159 HA ILE 22 HA ILE 22 -7.447 -2.796 -6.634 160 HB ILE 22 HB ILE 22 -5.299 -3.761 -6.416 161 1HG1 ILE 22 HG12 ILE 22 -4.594 -1.597 -4.391 162 2HG1 ILE 22 HG13 ILE 22 -4.783 -3.329 -4.087 163 1HG2 ILE 22 HG21 ILE 22 -4.883 -0.791 -6.929 164 2HG2 ILE 22 HG22 ILE 22 -3.922 -2.129 -7.564 165 3HG2 ILE 22 HG23 ILE 22 -5.596 -1.939 -8.082 166 1HD1 ILE 22 HD11 ILE 22 -2.581 -1.971 -5.660 167 2HD1 ILE 22 HD12 ILE 22 -2.457 -2.946 -4.176 168 3HD1 ILE 22 HD13 ILE 22 -2.854 -3.726 -5.702 169 H GLU 23 H GLU 23 -7.262 -4.986 -5.619 170 HA GLU 23 HA GLU 23 -8.176 -5.043 -2.812 171 1HB GLU 23 HB2 GLU 23 -10.117 -4.767 -4.332 172 2HB GLU 23 HB3 GLU 23 -9.591 -6.190 -5.246 173 1HG GLU 23 HG2 GLU 23 -11.282 -7.034 -3.904 174 2HG GLU 23 HG3 GLU 23 -9.852 -7.481 -2.991 175 H LYS 24 H LYS 24 -7.343 -6.909 -1.799 176 HA LYS 24 HA LYS 24 -5.186 -8.288 -2.703 177 1HB LYS 24 HB2 LYS 24 -6.133 -8.308 -0.403 178 2HB LYS 24 HB3 LYS 24 -7.402 -9.416 -0.938 179 1HG LYS 24 HG2 LYS 24 -5.677 -11.117 -1.512 180 2HG LYS 24 HG3 LYS 24 -4.408 -9.988 -1.030 181 1HD LYS 24 HD2 LYS 24 -5.477 -9.953 1.308 182 2HD LYS 24 HD3 LYS 24 -6.582 -11.204 0.729 183 1HE LYS 24 HE2 LYS 24 -4.946 -12.474 1.782 184 2HE LYS 24 HE3 LYS 24 -4.449 -12.545 0.089 185 1HZ LYS 24 HZ1 LYS 24 -3.291 -10.840 2.217 186 2HZ LYS 24 HZ2 LYS 24 -2.555 -12.068 1.442 187 3HZ LYS 24 HZ3 LYS 24 -2.882 -10.670 0.646 188 H GLY 25 H GLY 25 -4.745 -9.684 -4.323 189 1HA GLY 25 HA2 GLY 25 -4.979 -11.668 -5.508 190 2HA GLY 25 HA3 GLY 25 -6.695 -11.752 -5.102 191 H GLN 26 H GLN 26 -6.569 -8.627 -6.104 192 HA GLN 26 HA GLN 26 -7.483 -9.124 -8.801 193 1HB GLN 26 HB2 GLN 26 -8.006 -7.088 -7.273 194 2HB GLN 26 HB3 GLN 26 -6.357 -6.538 -7.648 195 1HG GLN 26 HG2 GLN 26 -7.194 -6.859 -10.171 196 2HG GLN 26 HG3 GLN 26 -8.787 -6.763 -9.441 197 1HE2 GLN 26 HE22 GLN 26 -5.971 -5.012 -10.462 198 2HE2 GLN 26 HE21 GLN 26 -6.507 -3.413 -9.961 199 H GLU 27 H GLU 27 -6.236 -9.045 -10.727 200 HA GLU 27 HA GLU 27 -3.343 -9.092 -10.543 201 1HB GLU 27 HB2 GLU 27 -3.323 -9.310 -12.873 202 2HB GLU 27 HB3 GLU 27 -4.629 -10.317 -12.286 203 1HG GLU 27 HG2 GLU 27 -4.859 -7.623 -13.687 204 2HG GLU 27 HG3 GLU 27 -5.198 -9.202 -14.372 205 H VAL 28 H VAL 28 -1.918 -7.451 -10.961 206 HA VAL 28 HA VAL 28 -2.951 -4.714 -11.486 207 HB VAL 28 HB VAL 28 -1.327 -3.907 -9.712 208 1HG1 VAL 28 HG11 VAL 28 -2.898 -4.218 -7.882 209 2HG1 VAL 28 HG12 VAL 28 -3.781 -3.910 -9.385 210 3HG1 VAL 28 HG13 VAL 28 -3.697 -5.556 -8.723 211 1HG2 VAL 28 HG21 VAL 28 -1.557 -6.753 -8.689 212 2HG2 VAL 28 HG22 VAL 28 -0.077 -6.070 -9.389 213 3HG2 VAL 28 HG23 VAL 28 -0.743 -5.404 -7.882 214 H ALA 29 H ALA 29 -0.469 -7.167 -12.011 215 HA ALA 29 HA ALA 29 0.387 -5.594 -14.278 216 1HB ALA 29 HB1 ALA 29 2.433 -6.261 -12.095 217 2HB ALA 29 HB2 ALA 29 2.811 -5.659 -13.718 218 3HB ALA 29 HB3 ALA 29 1.922 -4.638 -12.587 219 H ILE 30 H ILE 30 2.236 -6.959 -15.385 220 HA ILE 30 HA ILE 30 1.889 -9.865 -14.928 221 HB ILE 30 HB ILE 30 1.542 -8.409 -17.578 222 1HG1 ILE 30 HG12 ILE 30 -0.230 -10.509 -16.240 223 2HG1 ILE 30 HG13 ILE 30 -0.485 -8.781 -16.087 224 1HG2 ILE 30 HG21 ILE 30 1.910 -11.412 -17.144 225 2HG2 ILE 30 HG22 ILE 30 1.505 -10.639 -18.687 226 3HG2 ILE 30 HG23 ILE 30 3.067 -10.345 -17.966 227 1HD1 ILE 30 HD11 ILE 30 -0.697 -10.369 -18.662 228 2HD1 ILE 30 HD12 ILE 30 -1.994 -9.599 -17.742 229 3HD1 ILE 30 HD13 ILE 30 -0.783 -8.591 -18.552 230 H LEU 31 H LEU 31 3.743 -10.967 -15.347 231 HA LEU 31 HA LEU 31 6.263 -9.422 -15.726 232 1HB LEU 31 HB2 LEU 31 5.931 -10.118 -13.465 233 2HB LEU 31 HB3 LEU 31 5.436 -11.746 -13.925 234 HG LEU 31 HG LEU 31 7.644 -11.454 -12.820 235 1HD1 LEU 31 HD11 LEU 31 7.822 -12.850 -15.510 236 2HD1 LEU 31 HD12 LEU 31 8.828 -13.133 -14.080 237 3HD1 LEU 31 HD13 LEU 31 7.101 -13.515 -14.038 238 1HD2 LEU 31 HD21 LEU 31 9.529 -10.602 -13.871 239 2HD2 LEU 31 HD22 LEU 31 8.746 -10.538 -15.469 240 3HD2 LEU 31 HD23 LEU 31 8.261 -9.407 -14.195 241 H GLU 32 H GLU 32 7.548 -10.196 -17.348 242 HA GLU 32 HA GLU 32 6.786 -12.715 -18.727 243 1HB GLU 32 HB2 GLU 32 6.574 -10.700 -20.086 244 2HB GLU 32 HB3 GLU 32 8.247 -10.251 -19.772 245 1HG GLU 32 HG2 GLU 32 7.396 -12.851 -21.127 246 2HG GLU 32 HG3 GLU 32 7.682 -11.362 -22.013 247 H SER 33 H SER 33 8.178 -14.340 -18.358 248 HA SER 33 HA SER 33 10.982 -14.059 -18.339 249 1HB SER 33 HB2 SER 33 10.283 -13.264 -15.931 250 2HB SER 33 HB3 SER 33 9.956 -14.973 -15.629 251 HG SER 33 HG SER 33 12.104 -14.063 -15.155 252 H MET 34 H MET 34 11.943 -16.335 -17.826 253 HA MET 34 HA MET 34 12.085 -18.429 -18.675 254 1HB MET 34 HB2 MET 34 9.365 -18.827 -17.359 255 2HB MET 34 HB3 MET 34 10.478 -20.082 -17.862 256 1HG MET 34 HG2 MET 34 10.749 -19.958 -15.574 257 2HG MET 34 HG3 MET 34 12.179 -19.214 -16.264 258 1HE MET 34 HE1 MET 34 8.589 -17.429 -15.745 259 2HE MET 34 HE2 MET 34 8.731 -18.591 -14.404 260 3HE MET 34 HE3 MET 34 8.795 -16.842 -14.087 261 H LYS 35 H LYS 35 10.965 -16.435 -20.488 262 HA LYS 35 HA LYS 35 9.818 -16.104 -22.383 263 1HB LYS 35 HB2 LYS 35 10.371 -19.053 -22.883 264 2HB LYS 35 HB3 LYS 35 9.892 -17.862 -24.096 265 1HG LYS 35 HG2 LYS 35 11.952 -16.551 -23.633 266 2HG LYS 35 HG3 LYS 35 12.474 -17.792 -22.475 267 1HD LYS 35 HD2 LYS 35 12.418 -19.496 -24.279 268 2HD LYS 35 HD3 LYS 35 11.963 -18.257 -25.453 269 1HE LYS 35 HE2 LYS 35 14.533 -18.265 -23.797 270 2HE LYS 35 HE3 LYS 35 14.402 -18.864 -25.452 271 1HZ LYS 35 HZ1 LYS 35 13.786 -16.627 -26.157 272 2HZ LYS 35 HZ2 LYS 35 13.934 -16.058 -24.628 273 3HZ LYS 35 HZ3 LYS 35 15.238 -16.620 -25.423 274 H MET 36 H MET 36 8.178 -16.480 -20.131 275 HA MET 36 HA MET 36 5.633 -17.239 -21.418 276 1HB MET 36 HB2 MET 36 6.635 -18.150 -18.676 277 2HB MET 36 HB3 MET 36 4.943 -18.219 -19.176 278 1HG MET 36 HG2 MET 36 5.543 -19.689 -21.068 279 2HG MET 36 HG3 MET 36 7.219 -19.706 -20.530 280 1HE MET 36 HE1 MET 36 7.145 -21.782 -17.250 281 2HE MET 36 HE2 MET 36 8.141 -20.957 -18.469 282 3HE MET 36 HE3 MET 36 7.109 -20.011 -17.368 283 H GLU 37 H GLU 37 3.819 -16.313 -19.925 284 HA GLU 37 HA GLU 37 4.707 -13.788 -18.628 285 1HB GLU 37 HB2 GLU 37 2.170 -14.198 -20.259 286 2HB GLU 37 HB3 GLU 37 2.587 -12.785 -19.306 287 1HG GLU 37 HG2 GLU 37 3.124 -12.113 -21.449 288 2HG GLU 37 HG3 GLU 37 4.684 -12.536 -20.757 289 H ILE 38 H ILE 38 3.810 -13.423 -16.637 290 HA ILE 38 HA ILE 38 1.952 -15.433 -15.486 291 HB ILE 38 HB ILE 38 4.560 -14.455 -14.211 292 1HG1 ILE 38 HG12 ILE 38 5.014 -17.106 -14.396 293 2HG1 ILE 38 HG13 ILE 38 4.011 -16.955 -15.824 294 1HG2 ILE 38 HG21 ILE 38 2.769 -15.022 -12.601 295 2HG2 ILE 38 HG22 ILE 38 2.584 -16.620 -13.360 296 3HG2 ILE 38 HG23 ILE 38 4.085 -16.187 -12.520 297 1HD1 ILE 38 HD11 ILE 38 5.673 -15.180 -16.657 298 2HD1 ILE 38 HD12 ILE 38 6.639 -15.523 -15.214 299 3HD1 ILE 38 HD13 ILE 38 6.362 -16.790 -16.421 300 HA PRO 39 HA PRO 39 0.345 -11.408 -14.218 301 1HB PRO 39 HB2 PRO 39 -1.627 -12.146 -12.459 302 2HB PRO 39 HB3 PRO 39 -1.772 -12.301 -14.237 303 1HG PRO 39 HG2 PRO 39 -1.000 -14.434 -12.232 304 2HG PRO 39 HG3 PRO 39 -2.170 -14.551 -13.586 305 1HD PRO 39 HD2 PRO 39 0.405 -15.462 -13.785 306 2HD PRO 39 HD3 PRO 39 -0.440 -14.730 -15.182 307 H ILE 40 H ILE 40 0.394 -10.015 -12.446 308 HA ILE 40 HA ILE 40 1.678 -10.925 -9.919 309 HB ILE 40 HB ILE 40 2.032 -8.301 -11.414 310 1HG1 ILE 40 HG12 ILE 40 3.344 -10.058 -12.513 311 2HG1 ILE 40 HG13 ILE 40 4.349 -8.827 -11.772 312 1HG2 ILE 40 HG21 ILE 40 3.730 -7.768 -9.645 313 2HG2 ILE 40 HG22 ILE 40 2.072 -7.855 -9.043 314 3HG2 ILE 40 HG23 ILE 40 3.186 -9.198 -8.743 315 1HD1 ILE 40 HD11 ILE 40 3.800 -11.570 -10.548 316 2HD1 ILE 40 HD12 ILE 40 5.260 -11.095 -11.425 317 3HD1 ILE 40 HD13 ILE 40 4.882 -10.321 -9.887 318 H VAL 41 H VAL 41 0.382 -10.504 -8.236 319 HA VAL 41 HA VAL 41 -2.142 -9.039 -8.740 320 HB VAL 41 HB VAL 41 -3.057 -10.611 -6.967 321 1HG1 VAL 41 HG11 VAL 41 -3.636 -10.925 -9.286 322 2HG1 VAL 41 HG12 VAL 41 -2.130 -11.827 -9.599 323 3HG1 VAL 41 HG13 VAL 41 -3.387 -12.488 -8.524 324 1HG2 VAL 41 HG21 VAL 41 -0.592 -12.300 -7.586 325 2HG2 VAL 41 HG22 VAL 41 -0.863 -11.419 -6.060 326 3HG2 VAL 41 HG23 VAL 41 -1.959 -12.720 -6.541 327 H ALA 42 H ALA 42 -3.154 -8.017 -6.983 328 HA ALA 42 HA ALA 42 -1.508 -6.448 -5.251 329 1HB ALA 42 HB1 ALA 42 -3.772 -5.792 -6.077 330 2HB ALA 42 HB2 ALA 42 -4.475 -7.133 -5.165 331 3HB ALA 42 HB3 ALA 42 -3.701 -5.792 -4.299 332 H ASP 43 H ASP 43 -0.351 -7.398 -3.617 333 HA ASP 43 HA ASP 43 -1.039 -9.852 -2.304 334 1HB ASP 43 HB2 ASP 43 1.244 -8.968 -2.319 335 2HB ASP 43 HB3 ASP 43 0.725 -7.521 -1.449 336 H ARG 44 H ARG 44 -2.157 -6.561 -1.877 337 HA ARG 44 HA ARG 44 -4.046 -7.320 0.190 338 1HB ARG 44 HB2 ARG 44 -3.280 -5.646 1.802 339 2HB ARG 44 HB3 ARG 44 -2.039 -6.873 1.538 340 1HG ARG 44 HG2 ARG 44 -1.077 -5.119 -0.238 341 2HG ARG 44 HG3 ARG 44 -2.100 -3.984 0.640 342 1HD ARG 44 HD2 ARG 44 0.127 -3.852 1.469 343 2HD ARG 44 HD3 ARG 44 -0.871 -4.583 2.744 344 HE ARG 44 HE ARG 44 0.157 -6.774 1.410 345 1HH1 ARG 44 HH11 ARG 44 1.704 -3.936 2.909 346 2HH1 ARG 44 HH12 ARG 44 3.284 -4.674 2.943 347 1HH2 ARG 44 HH21 ARG 44 2.055 -7.784 1.698 348 2HH2 ARG 44 HH22 ARG 44 3.454 -7.005 2.420 349 H SER 45 H SER 45 -5.670 -5.604 0.440 350 HA SER 45 HA SER 45 -6.115 -4.123 -1.991 351 1HB SER 45 HB2 SER 45 -7.682 -3.916 0.610 352 2HB SER 45 HB3 SER 45 -8.262 -3.711 -1.041 353 HG SER 45 HG SER 45 -8.880 -5.721 -0.540 354 H GLY 46 H GLY 46 -6.511 -1.775 -2.100 355 1HA GLY 46 HA2 GLY 46 -6.466 0.061 -0.081 356 2HA GLY 46 HA3 GLY 46 -4.746 -0.135 -0.438 357 H ILE 47 H ILE 47 -5.479 2.330 -0.854 358 HA ILE 47 HA ILE 47 -6.183 2.694 -3.711 359 HB ILE 47 HB ILE 47 -5.588 4.644 -1.452 360 1HG1 ILE 47 HG12 ILE 47 -7.843 3.627 -1.347 361 2HG1 ILE 47 HG13 ILE 47 -7.864 5.363 -1.591 362 1HG2 ILE 47 HG21 ILE 47 -6.218 6.458 -3.062 363 2HG2 ILE 47 HG22 ILE 47 -4.680 5.673 -3.418 364 3HG2 ILE 47 HG23 ILE 47 -6.115 5.266 -4.378 365 1HD1 ILE 47 HD11 ILE 47 -9.575 4.233 -2.949 366 2HD1 ILE 47 HD12 ILE 47 -8.409 5.063 -3.985 367 3HD1 ILE 47 HD13 ILE 47 -8.323 3.298 -3.787 368 H VAL 48 H VAL 48 -4.563 3.054 -5.177 369 HA VAL 48 HA VAL 48 -1.815 2.398 -4.528 370 HB VAL 48 HB VAL 48 -3.009 3.545 -7.047 371 1HG1 VAL 48 HG11 VAL 48 -1.059 2.506 -8.133 372 2HG1 VAL 48 HG12 VAL 48 -0.509 3.677 -6.930 373 3HG1 VAL 48 HG13 VAL 48 -0.441 1.936 -6.567 374 1HG2 VAL 48 HG21 VAL 48 -4.147 1.433 -6.498 375 2HG2 VAL 48 HG22 VAL 48 -3.050 1.197 -7.847 376 3HG2 VAL 48 HG23 VAL 48 -2.584 0.635 -6.223 377 H LYS 49 H LYS 49 -0.650 3.769 -3.320 378 HA LYS 49 HA LYS 49 -1.108 6.668 -3.386 379 1HB LYS 49 HB2 LYS 49 -0.551 5.517 -1.264 380 2HB LYS 49 HB3 LYS 49 0.973 4.948 -1.951 381 1HG LYS 49 HG2 LYS 49 1.350 6.822 -0.467 382 2HG LYS 49 HG3 LYS 49 1.790 7.267 -2.116 383 1HD LYS 49 HD2 LYS 49 -0.334 8.541 -2.353 384 2HD LYS 49 HD3 LYS 49 -0.858 7.968 -0.766 385 1HE LYS 49 HE2 LYS 49 -0.083 10.216 -0.509 386 2HE LYS 49 HE3 LYS 49 1.070 9.146 0.289 387 1HZ LYS 49 HZ1 LYS 49 1.440 10.353 -2.397 388 2HZ LYS 49 HZ2 LYS 49 2.160 10.860 -1.029 389 3HZ LYS 49 HZ3 LYS 49 2.532 9.397 -1.635 390 H GLU 50 H GLU 50 1.285 4.224 -4.594 391 HA GLU 50 HA GLU 50 2.055 6.138 -6.659 392 1HB GLU 50 HB2 GLU 50 3.527 6.756 -4.705 393 2HB GLU 50 HB3 GLU 50 4.140 5.106 -4.670 394 1HG GLU 50 HG2 GLU 50 5.704 6.664 -5.720 395 2HG GLU 50 HG3 GLU 50 5.223 5.389 -6.818 396 H VAL 51 H VAL 51 3.392 5.082 -8.324 397 HA VAL 51 HA VAL 51 3.393 2.097 -8.209 398 HB VAL 51 HB VAL 51 2.985 3.790 -10.715 399 1HG1 VAL 51 HG11 VAL 51 2.403 1.614 -11.749 400 2HG1 VAL 51 HG12 VAL 51 4.048 1.582 -11.115 401 3HG1 VAL 51 HG13 VAL 51 2.742 0.777 -10.219 402 1HG2 VAL 51 HG21 VAL 51 0.934 2.186 -9.140 403 2HG2 VAL 51 HG22 VAL 51 0.942 3.956 -9.335 404 3HG2 VAL 51 HG23 VAL 51 0.662 2.924 -10.737 405 H LYS 52 H LYS 52 5.406 1.294 -8.386 406 HA LYS 52 HA LYS 52 7.601 3.279 -8.457 407 1HB LYS 52 HB2 LYS 52 7.537 0.335 -7.672 408 2HB LYS 52 HB3 LYS 52 8.900 1.427 -7.433 409 1HG LYS 52 HG2 LYS 52 6.184 1.607 -6.057 410 2HG LYS 52 HG3 LYS 52 7.692 1.026 -5.363 411 1HD LYS 52 HD2 LYS 52 8.702 3.281 -5.627 412 2HD LYS 52 HD3 LYS 52 7.139 3.891 -6.242 413 1HE LYS 52 HE2 LYS 52 6.018 3.306 -4.188 414 2HE LYS 52 HE3 LYS 52 7.450 2.477 -3.565 415 1HZ LYS 52 HZ1 LYS 52 7.285 5.395 -4.048 416 2HZ LYS 52 HZ2 LYS 52 7.148 4.640 -2.593 417 3HZ LYS 52 HZ3 LYS 52 8.569 4.595 -3.415 418 H LYS 53 H LYS 53 6.130 1.316 -10.774 419 HA LYS 53 HA LYS 53 8.647 0.937 -12.308 420 1HB LYS 53 HB2 LYS 53 6.492 -1.138 -11.666 421 2HB LYS 53 HB3 LYS 53 7.715 -1.351 -12.917 422 1HG LYS 53 HG2 LYS 53 8.415 -0.954 -9.988 423 2HG LYS 53 HG3 LYS 53 8.212 -2.530 -10.765 424 1HD LYS 53 HD2 LYS 53 9.969 -1.983 -12.401 425 2HD LYS 53 HD3 LYS 53 10.216 -0.401 -11.634 426 1HE LYS 53 HE2 LYS 53 10.978 -1.439 -9.573 427 2HE LYS 53 HE3 LYS 53 10.584 -3.043 -10.165 428 1HZ LYS 53 HZ1 LYS 53 12.222 -2.644 -11.988 429 2HZ LYS 53 HZ2 LYS 53 12.683 -1.258 -11.239 430 3HZ LYS 53 HZ3 LYS 53 12.855 -2.728 -10.480 431 H LYS 54 H LYS 54 7.853 -0.053 -14.575 432 HA LYS 54 HA LYS 54 5.404 1.211 -15.515 433 1HB LYS 54 HB2 LYS 54 6.459 2.372 -17.369 434 2HB LYS 54 HB3 LYS 54 7.047 3.033 -15.849 435 1HG LYS 54 HG2 LYS 54 9.160 1.847 -16.060 436 2HG LYS 54 HG3 LYS 54 8.605 0.970 -17.487 437 1HD LYS 54 HD2 LYS 54 8.947 3.986 -17.331 438 2HD LYS 54 HD3 LYS 54 10.150 2.881 -17.981 439 1HE LYS 54 HE2 LYS 54 7.329 3.250 -19.103 440 2HE LYS 54 HE3 LYS 54 8.782 4.025 -19.724 441 1HZ LYS 54 HZ1 LYS 54 8.270 1.097 -19.740 442 2HZ LYS 54 HZ2 LYS 54 8.288 2.101 -21.019 443 3HZ LYS 54 HZ3 LYS 54 9.673 1.809 -20.219 444 H GLU 55 H GLU 55 5.035 0.481 -17.809 445 HA GLU 55 HA GLU 55 5.326 -2.337 -17.989 446 1HB GLU 55 HB2 GLU 55 4.695 -0.396 -20.255 447 2HB GLU 55 HB3 GLU 55 4.301 -2.123 -20.163 448 1HG GLU 55 HG2 GLU 55 2.975 -1.534 -18.035 449 2HG GLU 55 HG3 GLU 55 3.139 0.154 -18.503 450 H GLY 56 H GLY 56 6.873 -3.577 -18.895 451 1HA GLY 56 HA2 GLY 56 8.603 -4.236 -20.242 452 2HA GLY 56 HA3 GLY 56 8.748 -2.596 -20.889 453 H ASP 57 H ASP 57 8.869 -2.197 -17.515 454 HA ASP 57 HA ASP 57 11.743 -1.775 -17.633 455 1HB ASP 57 HB2 ASP 57 10.200 -0.357 -16.277 456 2HB ASP 57 HB3 ASP 57 9.934 -1.728 -15.192 457 H PHE 58 H PHE 58 13.285 -2.780 -16.154 458 HA PHE 58 HA PHE 58 13.085 -5.690 -15.989 459 1HB PHE 58 HB2 PHE 58 15.225 -4.521 -16.392 460 2HB PHE 58 HB3 PHE 58 15.059 -3.664 -14.867 461 HD1 PHE 58 HD1 PHE 58 15.636 -4.720 -12.749 462 HD2 PHE 58 HD2 PHE 58 15.720 -6.975 -16.428 463 HE1 PHE 58 HE1 PHE 58 16.931 -6.514 -11.626 464 HE2 PHE 58 HE2 PHE 58 17.001 -8.771 -15.296 465 HZ PHE 58 HZ PHE 58 17.637 -8.531 -12.905 466 H VAL 59 H VAL 59 12.745 -6.907 -14.092 467 HA VAL 59 HA VAL 59 12.261 -5.523 -11.553 468 HB VAL 59 HB VAL 59 10.156 -6.963 -11.268 469 1HG1 VAL 59 HG11 VAL 59 10.010 -4.577 -13.151 470 2HG1 VAL 59 HG12 VAL 59 8.692 -5.222 -12.156 471 3HG1 VAL 59 HG13 VAL 59 10.114 -4.535 -11.373 472 1HG2 VAL 59 HG21 VAL 59 8.815 -7.434 -13.242 473 2HG2 VAL 59 HG22 VAL 59 10.099 -6.848 -14.310 474 3HG2 VAL 59 HG23 VAL 59 10.357 -8.315 -13.338 475 H ASN 60 H ASN 60 12.071 -7.109 -9.754 476 HA ASN 60 HA ASN 60 13.459 -9.615 -10.285 477 1HB ASN 60 HB2 ASN 60 14.998 -7.355 -9.791 478 2HB ASN 60 HB3 ASN 60 14.799 -8.033 -8.175 479 1HD2 ASN 60 HD22 ASN 60 15.487 -9.014 -11.582 480 2HD2 ASN 60 HD21 ASN 60 16.667 -10.243 -11.167 481 H GLU 61 H GLU 61 13.910 -10.795 -8.214 482 HA GLU 61 HA GLU 61 11.459 -11.146 -6.796 483 1HB GLU 61 HB2 GLU 61 13.026 -12.955 -7.240 484 2HB GLU 61 HB3 GLU 61 14.295 -12.147 -6.326 485 1HG GLU 61 HG2 GLU 61 12.855 -12.354 -4.256 486 2HG GLU 61 HG3 GLU 61 11.648 -13.202 -5.220 487 H GLY 62 H GLY 62 10.671 -9.588 -5.500 488 1HA GLY 62 HA2 GLY 62 10.556 -8.588 -3.397 489 2HA GLY 62 HA3 GLY 62 12.320 -8.549 -3.275 490 H ASP 63 H ASP 63 11.406 -7.506 -6.440 491 HA ASP 63 HA ASP 63 12.168 -4.768 -5.775 492 1HB ASP 63 HB2 ASP 63 12.890 -6.157 -7.814 493 2HB ASP 63 HB3 ASP 63 11.263 -5.902 -8.449 494 H VAL 64 H VAL 64 10.685 -3.090 -5.537 495 HA VAL 64 HA VAL 64 8.006 -3.880 -4.945 496 HB VAL 64 HB VAL 64 9.109 -1.051 -5.127 497 1HG1 VAL 64 HG11 VAL 64 6.656 -1.147 -4.867 498 2HG1 VAL 64 HG12 VAL 64 6.820 -2.275 -3.508 499 3HG1 VAL 64 HG13 VAL 64 7.395 -0.600 -3.364 500 1HG2 VAL 64 HG21 VAL 64 9.208 -3.024 -2.798 501 2HG2 VAL 64 HG22 VAL 64 10.602 -2.317 -3.644 502 3HG2 VAL 64 HG23 VAL 64 9.560 -1.286 -2.673 503 H LEU 65 H LEU 65 6.102 -3.531 -6.019 504 HA LEU 65 HA LEU 65 6.189 -2.656 -8.859 505 1HB LEU 65 HB2 LEU 65 5.002 -4.777 -8.455 506 2HB LEU 65 HB3 LEU 65 4.052 -4.041 -7.169 507 HG LEU 65 HG LEU 65 2.945 -2.537 -8.808 508 1HD1 LEU 65 HD11 LEU 65 4.533 -4.112 -10.875 509 2HD1 LEU 65 HD12 LEU 65 3.190 -2.999 -11.234 510 3HD1 LEU 65 HD13 LEU 65 4.680 -2.371 -10.538 511 1HD2 LEU 65 HD21 LEU 65 1.935 -4.700 -8.213 512 2HD2 LEU 65 HD22 LEU 65 1.567 -4.232 -9.881 513 3HD2 LEU 65 HD23 LEU 65 2.797 -5.474 -9.563 514 H LEU 66 H LEU 66 4.448 -2.088 -5.697 515 HA LEU 66 HA LEU 66 4.052 0.718 -6.433 516 1HB LEU 66 HB2 LEU 66 1.624 0.667 -6.485 517 2HB LEU 66 HB3 LEU 66 2.308 -0.313 -7.753 518 HG LEU 66 HG LEU 66 1.851 -2.340 -6.250 519 1HD1 LEU 66 HD11 LEU 66 -0.124 -2.001 -4.683 520 2HD1 LEU 66 HD12 LEU 66 1.377 -1.331 -4.077 521 3HD1 LEU 66 HD13 LEU 66 0.168 -0.251 -4.801 522 1HD2 LEU 66 HD21 LEU 66 -0.490 -2.479 -6.962 523 2HD2 LEU 66 HD22 LEU 66 -0.489 -0.733 -7.310 524 3HD2 LEU 66 HD23 LEU 66 0.549 -1.851 -8.236 525 H GLU 67 H GLU 67 2.655 1.827 -4.776 526 HA GLU 67 HA GLU 67 3.121 0.771 -2.039 527 1HB GLU 67 HB2 GLU 67 4.889 2.399 -2.754 528 2HB GLU 67 HB3 GLU 67 3.625 3.612 -3.017 529 1HG GLU 67 HG2 GLU 67 3.022 3.378 -0.572 530 2HG GLU 67 HG3 GLU 67 4.409 2.297 -0.387 531 H LEU 68 H LEU 68 1.486 1.575 -0.547 532 HA LEU 68 HA LEU 68 -1.034 2.359 -1.912 533 1HB LEU 68 HB2 LEU 68 -0.566 0.281 0.260 534 2HB LEU 68 HB3 LEU 68 -2.155 0.808 -0.276 535 HG LEU 68 HG LEU 68 -0.115 -0.614 -2.028 536 1HD1 LEU 68 HD11 LEU 68 -2.708 -1.616 -0.793 537 2HD1 LEU 68 HD12 LEU 68 -1.643 -2.526 -1.882 538 3HD1 LEU 68 HD13 LEU 68 -1.065 -2.053 -0.273 539 1HD2 LEU 68 HD21 LEU 68 -2.037 -0.835 -3.612 540 2HD2 LEU 68 HD22 LEU 68 -2.981 0.267 -2.594 541 3HD2 LEU 68 HD23 LEU 68 -1.479 0.797 -3.393 542 H SER 69 H SER 69 -2.716 3.116 -0.415 543 HA SER 69 HA SER 69 -1.966 5.345 1.096 544 1HB SER 69 HB2 SER 69 -4.445 5.131 1.814 545 2HB SER 69 HB3 SER 69 -4.078 5.262 0.092 546 HG SER 69 HG SER 69 -4.990 3.041 1.548 547 H ASN 70 H ASN 70 -2.163 1.984 2.115 548 HA ASN 70 HA ASN 70 -1.453 2.629 4.880 549 1HB ASN 70 HB2 ASN 70 -3.997 2.705 4.774 550 2HB ASN 70 HB3 ASN 70 -3.971 1.041 4.187 551 1HD2 ASN 70 HD22 ASN 70 -5.272 0.431 6.081 552 2HD2 ASN 70 HD21 ASN 70 -4.516 0.274 7.643 553 H SER 71 H SER 71 -1.144 0.419 6.040 554 HA SER 71 HA SER 71 0.000 -1.518 6.192 555 1HB SER 71 HB2 SER 71 -1.656 -2.296 3.766 556 2HB SER 71 HB3 SER 71 -0.979 -3.377 4.997 557 HG SER 71 HG SER 71 -3.191 -2.898 5.379 558 H THR 72 H THR 72 1.600 0.382 4.969 559 HA THR 72 HA THR 72 2.771 -0.588 2.549 560 HB THR 72 HB THR 72 4.394 1.383 3.159 561 HG1 THR 72 HG1 THR 72 3.933 1.654 5.320 562 1HG2 THR 72 HG21 THR 72 2.693 3.015 2.456 563 2HG2 THR 72 HG22 THR 72 2.591 1.526 1.504 564 3HG2 THR 72 HG23 THR 72 1.402 1.837 2.787 565 H GLN 73 H GLN 73 2.890 -2.538 4.739 566 HA GLN 73 HA GLN 73 5.553 -2.760 5.803 567 1HB GLN 73 HB2 GLN 73 3.432 -4.902 5.298 568 2HB GLN 73 HB3 GLN 73 4.905 -5.109 6.244 569 1HG GLN 73 HG2 GLN 73 4.133 -3.340 7.827 570 2HG GLN 73 HG3 GLN 73 2.636 -3.172 6.905 571 1HE2 GLN 73 HE21 GLN 73 4.513 -5.388 9.000 572 2HE2 GLN 73 HE22 GLN 73 3.171 -6.429 9.402 Start of MODEL 5 1 1H THR 2 H1 THR 2 5.192 -0.215 -0.643 2 2H THR 2 H2 THR 2 6.045 -1.437 -1.351 3 3H THR 2 H3 THR 2 4.624 -0.916 -2.000 4 HA THR 2 HA THR 2 4.967 -2.324 0.547 5 HB THR 2 HB THR 2 2.431 -2.374 0.532 6 HG1 THR 2 HG1 THR 2 1.391 -1.160 -0.835 7 1HG2 THR 2 HG21 THR 2 3.717 -0.895 2.075 8 2HG2 THR 2 HG22 THR 2 3.657 0.394 0.851 9 3HG2 THR 2 HG23 THR 2 2.158 -0.206 1.581 10 H VAL 3 H VAL 3 3.098 -2.526 -2.592 11 HA VAL 3 HA VAL 3 3.306 -5.468 -2.449 12 HB VAL 3 HB VAL 3 2.038 -3.685 -4.556 13 1HG1 VAL 3 HG11 VAL 3 2.502 -5.931 -5.429 14 2HG1 VAL 3 HG12 VAL 3 1.721 -6.664 -4.012 15 3HG1 VAL 3 HG13 VAL 3 0.771 -5.720 -5.189 16 1HG2 VAL 3 HG21 VAL 3 0.867 -3.319 -2.452 17 2HG2 VAL 3 HG22 VAL 3 -0.137 -4.323 -3.498 18 3HG2 VAL 3 HG23 VAL 3 0.766 -5.068 -2.159 19 H SER 4 H SER 4 4.576 -6.660 -3.839 20 HA SER 4 HA SER 4 6.627 -5.293 -5.486 21 1HB SER 4 HB2 SER 4 7.106 -7.354 -3.296 22 2HB SER 4 HB3 SER 4 8.346 -6.574 -4.287 23 HG SER 4 HG SER 4 8.064 -5.635 -2.168 24 H ILE 5 H ILE 5 7.937 -6.928 -6.661 25 HA ILE 5 HA ILE 5 6.281 -9.196 -7.658 26 HB ILE 5 HB ILE 5 8.484 -7.477 -8.806 27 1HG1 ILE 5 HG12 ILE 5 5.796 -8.366 -9.955 28 2HG1 ILE 5 HG13 ILE 5 5.913 -6.997 -8.861 29 1HG2 ILE 5 HG21 ILE 5 7.531 -10.120 -10.003 30 2HG2 ILE 5 HG22 ILE 5 8.540 -8.918 -10.819 31 3HG2 ILE 5 HG23 ILE 5 9.173 -9.743 -9.409 32 1HD1 ILE 5 HD11 ILE 5 7.440 -5.849 -10.399 33 2HD1 ILE 5 HD12 ILE 5 7.239 -7.188 -11.572 34 3HD1 ILE 5 HD13 ILE 5 5.855 -6.197 -11.111 35 H GLN 6 H GLN 6 7.386 -11.270 -7.876 36 HA GLN 6 HA GLN 6 9.456 -11.738 -5.794 37 1HB GLN 6 HB2 GLN 6 8.085 -13.698 -5.034 38 2HB GLN 6 HB3 GLN 6 7.517 -12.114 -4.587 39 1HG GLN 6 HG2 GLN 6 6.363 -13.499 -7.035 40 2HG GLN 6 HG3 GLN 6 5.825 -13.931 -5.419 41 1HE2 GLN 6 HE22 GLN 6 4.950 -11.952 -7.968 42 2HE2 GLN 6 HE21 GLN 6 4.187 -10.663 -7.058 43 H MET 7 H MET 7 9.646 -11.655 -8.754 44 HA MET 7 HA MET 7 11.204 -14.066 -9.020 45 1HB MET 7 HB2 MET 7 10.196 -14.719 -11.192 46 2HB MET 7 HB3 MET 7 9.133 -15.027 -9.828 47 1HG MET 7 HG2 MET 7 8.874 -12.556 -11.575 48 2HG MET 7 HG3 MET 7 8.115 -14.091 -11.965 49 1HE MET 7 HE1 MET 7 5.629 -13.568 -12.029 50 2HE MET 7 HE2 MET 7 5.961 -15.005 -11.030 51 3HE MET 7 HE3 MET 7 4.761 -13.805 -10.501 52 H ALA 8 H ALA 8 12.715 -13.819 -10.802 53 HA ALA 8 HA ALA 8 13.298 -11.028 -11.509 54 1HB ALA 8 HB1 ALA 8 14.656 -13.637 -12.291 55 2HB ALA 8 HB2 ALA 8 15.271 -11.996 -12.588 56 3HB ALA 8 HB3 ALA 8 15.116 -12.594 -10.920 57 H GLY 9 H GLY 9 12.860 -10.044 -13.460 58 1HA GLY 9 HA2 GLY 9 12.628 -11.375 -15.925 59 2HA GLY 9 HA3 GLY 9 10.999 -11.278 -15.263 60 H ASN 10 H ASN 10 10.320 -9.861 -16.920 61 HA ASN 10 HA ASN 10 11.079 -6.998 -16.535 62 1HB ASN 10 HB2 ASN 10 11.126 -8.585 -19.129 63 2HB ASN 10 HB3 ASN 10 10.544 -6.927 -19.135 64 1HD2 ASN 10 HD22 ASN 10 13.279 -7.960 -17.004 65 2HD2 ASN 10 HD21 ASN 10 14.479 -7.097 -17.942 66 H LEU 11 H LEU 11 9.330 -5.708 -16.577 67 HA LEU 11 HA LEU 11 6.773 -6.970 -16.151 68 1HB LEU 11 HB2 LEU 11 7.910 -4.194 -16.195 69 2HB LEU 11 HB3 LEU 11 6.188 -4.341 -16.470 70 HG LEU 11 HG LEU 11 7.561 -5.712 -14.125 71 1HD1 LEU 11 HD11 LEU 11 6.237 -2.980 -14.217 72 2HD1 LEU 11 HD12 LEU 11 6.791 -3.821 -12.746 73 3HD1 LEU 11 HD13 LEU 11 7.963 -3.321 -13.981 74 1HD2 LEU 11 HD21 LEU 11 5.167 -5.527 -13.190 75 2HD2 LEU 11 HD22 LEU 11 4.665 -5.130 -14.844 76 3HD2 LEU 11 HD23 LEU 11 5.407 -6.697 -14.485 77 H TRP 12 H TRP 12 5.357 -7.629 -17.625 78 HA TRP 12 HA TRP 12 5.739 -7.102 -20.468 79 1HB TRP 12 HB2 TRP 12 4.846 -9.253 -19.376 80 2HB TRP 12 HB3 TRP 12 3.361 -8.378 -19.059 81 HD1 TRP 12 HD1 TRP 12 5.594 -9.281 -22.039 82 HE1 TRP 12 HE1 TRP 12 4.172 -9.821 -24.090 83 HE3 TRP 12 HE3 TRP 12 0.986 -8.290 -20.071 84 HZ2 TRP 12 HZ2 TRP 12 1.348 -9.868 -24.777 85 HZ3 TRP 12 HZ3 TRP 12 -1.061 -8.644 -21.422 86 HH2 TRP 12 HH2 TRP 12 -0.892 -9.424 -23.777 87 H LYS 13 H LYS 13 3.221 -6.368 -17.984 88 HA LYS 13 HA LYS 13 2.722 -3.713 -19.124 89 1HB LYS 13 HB2 LYS 13 0.620 -5.924 -18.958 90 2HB LYS 13 HB3 LYS 13 0.211 -4.208 -19.054 91 1HG LYS 13 HG2 LYS 13 1.474 -4.082 -21.235 92 2HG LYS 13 HG3 LYS 13 1.672 -5.844 -21.160 93 1HD LYS 13 HD2 LYS 13 -0.832 -6.074 -21.054 94 2HD LYS 13 HD3 LYS 13 -0.959 -4.315 -21.282 95 1HE LYS 13 HE2 LYS 13 0.330 -4.532 -23.421 96 2HE LYS 13 HE3 LYS 13 0.386 -6.285 -23.193 97 1HZ LYS 13 HZ1 LYS 13 -2.043 -6.308 -23.338 98 2HZ LYS 13 HZ2 LYS 13 -2.085 -4.687 -23.553 99 3HZ LYS 13 HZ3 LYS 13 -1.401 -5.642 -24.678 100 H VAL 14 H VAL 14 1.342 -2.460 -17.593 101 HA VAL 14 HA VAL 14 0.990 -3.545 -14.872 102 HB VAL 14 HB VAL 14 2.292 -0.863 -15.540 103 1HG1 VAL 14 HG11 VAL 14 1.501 -2.059 -12.840 104 2HG1 VAL 14 HG12 VAL 14 2.487 -0.599 -13.062 105 3HG1 VAL 14 HG13 VAL 14 0.812 -0.603 -13.601 106 1HG2 VAL 14 HG21 VAL 14 3.936 -2.700 -15.666 107 2HG2 VAL 14 HG22 VAL 14 4.217 -1.713 -14.231 108 3HG2 VAL 14 HG23 VAL 14 3.410 -3.288 -14.070 109 H HIS 15 H HIS 15 -0.986 -2.782 -14.029 110 HA HIS 15 HA HIS 15 -2.689 -1.338 -16.017 111 1HB HIS 15 HB2 HIS 15 -3.663 -3.291 -13.938 112 2HB HIS 15 HB3 HIS 15 -4.445 -2.789 -15.434 113 HD1 HIS 15 HD1 HIS 15 -2.266 -3.571 -17.593 114 HD2 HIS 15 HD2 HIS 15 -3.126 -5.769 -14.113 115 HE1 HIS 15 HE1 HIS 15 -1.329 -5.923 -17.963 116 H VAL 16 H VAL 16 -1.557 -1.274 -12.698 117 HA VAL 16 HA VAL 16 -3.709 0.393 -11.681 118 HB VAL 16 HB VAL 16 -2.134 0.771 -9.790 119 1HG1 VAL 16 HG11 VAL 16 -2.593 -2.143 -10.517 120 2HG1 VAL 16 HG12 VAL 16 -2.265 -1.488 -8.891 121 3HG1 VAL 16 HG13 VAL 16 -3.753 -1.051 -9.738 122 1HG2 VAL 16 HG21 VAL 16 -0.043 -0.279 -9.588 123 2HG2 VAL 16 HG22 VAL 16 -0.270 -1.280 -11.040 124 3HG2 VAL 16 HG23 VAL 16 0.005 0.472 -11.171 125 H LYS 17 H LYS 17 -3.284 2.543 -10.794 126 HA LYS 17 HA LYS 17 -1.146 4.137 -11.891 127 1HB LYS 17 HB2 LYS 17 -2.622 5.951 -12.678 128 2HB LYS 17 HB3 LYS 17 -2.803 4.498 -13.658 129 1HG LYS 17 HG2 LYS 17 -4.913 3.942 -12.486 130 2HG LYS 17 HG3 LYS 17 -4.731 5.377 -11.455 131 1HD LYS 17 HD2 LYS 17 -4.837 6.831 -13.459 132 2HD LYS 17 HD3 LYS 17 -5.025 5.393 -14.489 133 1HE LYS 17 HE2 LYS 17 -7.109 4.797 -13.267 134 2HE LYS 17 HE3 LYS 17 -6.921 6.227 -12.243 135 1HZ LYS 17 HZ1 LYS 17 -7.167 7.600 -14.231 136 2HZ LYS 17 HZ2 LYS 17 -7.340 6.278 -15.178 137 3HZ LYS 17 HZ3 LYS 17 -8.462 6.630 -14.053 138 H ALA 18 H ALA 18 -0.934 6.078 -10.472 139 HA ALA 18 HA ALA 18 -1.691 5.596 -7.759 140 1HB ALA 18 HB1 ALA 18 0.260 6.960 -8.400 141 2HB ALA 18 HB2 ALA 18 -0.822 8.194 -9.095 142 3HB ALA 18 HB3 ALA 18 -0.852 7.868 -7.348 143 H GLY 19 H GLY 19 -3.548 6.080 -6.675 144 1HA GLY 19 HA2 GLY 19 -5.525 7.274 -6.219 145 2HA GLY 19 HA3 GLY 19 -5.605 7.843 -7.892 146 H ASP 20 H ASP 20 -4.846 4.718 -8.467 147 HA ASP 20 HA ASP 20 -7.585 3.798 -8.835 148 1HB ASP 20 HB2 ASP 20 -5.623 3.201 -10.313 149 2HB ASP 20 HB3 ASP 20 -4.986 2.222 -8.982 150 H GLN 21 H GLN 21 -8.128 1.526 -7.907 151 HA GLN 21 HA GLN 21 -7.242 1.259 -5.071 152 1HB GLN 21 HB2 GLN 21 -9.422 2.343 -5.102 153 2HB GLN 21 HB3 GLN 21 -10.079 1.124 -6.180 154 1HG GLN 21 HG2 GLN 21 -8.898 0.198 -3.551 155 2HG GLN 21 HG3 GLN 21 -10.415 1.081 -3.498 156 1HE2 GLN 21 HE22 GLN 21 -9.288 -2.029 -3.481 157 2HE2 GLN 21 HE21 GLN 21 -10.661 -2.808 -4.234 158 H ILE 22 H ILE 22 -6.795 -0.798 -4.466 159 HA ILE 22 HA ILE 22 -7.466 -2.988 -6.339 160 HB ILE 22 HB ILE 22 -5.321 -3.954 -6.195 161 1HG1 ILE 22 HG12 ILE 22 -4.517 -1.713 -4.294 162 2HG1 ILE 22 HG13 ILE 22 -4.661 -3.435 -3.924 163 1HG2 ILE 22 HG21 ILE 22 -5.685 -2.153 -7.912 164 2HG2 ILE 22 HG22 ILE 22 -4.847 -1.017 -6.840 165 3HG2 ILE 22 HG23 ILE 22 -3.995 -2.419 -7.501 166 1HD1 ILE 22 HD11 ILE 22 -2.828 -3.818 -5.707 167 2HD1 ILE 22 HD12 ILE 22 -2.571 -2.064 -5.634 168 3HD1 ILE 22 HD13 ILE 22 -2.344 -3.069 -4.184 169 H GLU 23 H GLU 23 -7.410 -5.092 -5.317 170 HA GLU 23 HA GLU 23 -7.925 -5.105 -2.416 171 1HB GLU 23 HB2 GLU 23 -10.083 -4.847 -3.587 172 2HB GLU 23 HB3 GLU 23 -9.714 -6.254 -4.601 173 1HG GLU 23 HG2 GLU 23 -9.702 -7.697 -2.580 174 2HG GLU 23 HG3 GLU 23 -9.994 -6.286 -1.561 175 H LYS 24 H LYS 24 -7.148 -7.087 -1.512 176 HA LYS 24 HA LYS 24 -5.020 -8.354 -2.683 177 1HB LYS 24 HB2 LYS 24 -5.672 -8.483 -0.309 178 2HB LYS 24 HB3 LYS 24 -6.994 -9.583 -0.711 179 1HG LYS 24 HG2 LYS 24 -5.462 -11.314 -1.418 180 2HG LYS 24 HG3 LYS 24 -4.089 -10.191 -1.384 181 1HD LYS 24 HD2 LYS 24 -4.304 -9.970 1.072 182 2HD LYS 24 HD3 LYS 24 -5.731 -11.009 1.058 183 1HE LYS 24 HE2 LYS 24 -3.754 -12.218 1.828 184 2HE LYS 24 HE3 LYS 24 -4.402 -12.936 0.351 185 1HZ LYS 24 HZ1 LYS 24 -2.160 -11.004 0.288 186 2HZ LYS 24 HZ2 LYS 24 -1.915 -12.623 0.476 187 3HZ LYS 24 HZ3 LYS 24 -2.617 -12.053 -0.880 188 H GLY 25 H GLY 25 -4.723 -9.640 -4.421 189 1HA GLY 25 HA2 GLY 25 -5.061 -11.572 -5.685 190 2HA GLY 25 HA3 GLY 25 -6.738 -11.676 -5.149 191 H GLN 26 H GLN 26 -6.670 -8.494 -5.961 192 HA GLN 26 HA GLN 26 -7.807 -8.795 -8.585 193 1HB GLN 26 HB2 GLN 26 -8.270 -6.969 -6.908 194 2HB GLN 26 HB3 GLN 26 -6.641 -6.339 -7.195 195 1HG GLN 26 HG2 GLN 26 -7.257 -5.932 -9.579 196 2HG GLN 26 HG3 GLN 26 -8.885 -6.537 -9.254 197 1HE2 GLN 26 HE22 GLN 26 -7.135 -3.704 -9.541 198 2HE2 GLN 26 HE21 GLN 26 -8.064 -2.659 -8.478 199 H GLU 27 H GLU 27 -6.784 -8.402 -10.611 200 HA GLU 27 HA GLU 27 -3.939 -8.924 -10.778 201 1HB GLU 27 HB2 GLU 27 -5.699 -9.650 -12.428 202 2HB GLU 27 HB3 GLU 27 -5.864 -7.963 -12.934 203 1HG GLU 27 HG2 GLU 27 -3.483 -7.956 -13.644 204 2HG GLU 27 HG3 GLU 27 -3.287 -9.600 -13.040 205 H VAL 28 H VAL 28 -2.284 -7.501 -11.276 206 HA VAL 28 HA VAL 28 -2.851 -4.570 -11.102 207 HB VAL 28 HB VAL 28 -1.056 -6.376 -9.440 208 1HG1 VAL 28 HG11 VAL 28 -0.018 -4.452 -8.392 209 2HG1 VAL 28 HG12 VAL 28 0.372 -4.477 -10.113 210 3HG1 VAL 28 HG13 VAL 28 -0.847 -3.347 -9.513 211 1HG2 VAL 28 HG21 VAL 28 -3.333 -5.975 -8.578 212 2HG2 VAL 28 HG22 VAL 28 -2.135 -5.167 -7.560 213 3HG2 VAL 28 HG23 VAL 28 -3.099 -4.228 -8.718 214 H ALA 29 H ALA 29 -0.625 -7.207 -12.187 215 HA ALA 29 HA ALA 29 0.199 -5.597 -14.455 216 1HB ALA 29 HB1 ALA 29 2.217 -6.343 -12.265 217 2HB ALA 29 HB2 ALA 29 2.633 -5.733 -13.867 218 3HB ALA 29 HB3 ALA 29 1.748 -4.703 -12.740 219 H ILE 30 H ILE 30 2.083 -6.985 -15.555 220 HA ILE 30 HA ILE 30 1.694 -9.887 -15.149 221 HB ILE 30 HB ILE 30 1.338 -8.407 -17.791 222 1HG1 ILE 30 HG12 ILE 30 -0.505 -10.373 -16.350 223 2HG1 ILE 30 HG13 ILE 30 -0.701 -8.628 -16.347 224 1HG2 ILE 30 HG21 ILE 30 1.245 -10.612 -18.901 225 2HG2 ILE 30 HG22 ILE 30 2.794 -10.435 -18.114 226 3HG2 ILE 30 HG23 ILE 30 1.538 -11.428 -17.349 227 1HD1 ILE 30 HD11 ILE 30 -2.245 -9.551 -17.914 228 2HD1 ILE 30 HD12 ILE 30 -1.021 -8.629 -18.799 229 3HD1 ILE 30 HD13 ILE 30 -0.970 -10.413 -18.782 230 H LEU 31 H LEU 31 3.603 -10.943 -15.439 231 HA LEU 31 HA LEU 31 6.075 -9.326 -15.898 232 1HB LEU 31 HB2 LEU 31 5.809 -9.976 -13.631 233 2HB LEU 31 HB3 LEU 31 5.326 -11.629 -14.040 234 HG LEU 31 HG LEU 31 7.519 -11.252 -12.946 235 1HD1 LEU 31 HD11 LEU 31 8.734 -12.954 -14.139 236 2HD1 LEU 31 HD12 LEU 31 7.014 -13.361 -14.066 237 3HD1 LEU 31 HD13 LEU 31 7.713 -12.752 -15.575 238 1HD2 LEU 31 HD21 LEU 31 9.388 -10.398 -14.017 239 2HD2 LEU 31 HD22 LEU 31 8.628 -10.429 -15.624 240 3HD2 LEU 31 HD23 LEU 31 8.106 -9.239 -14.417 241 H GLU 32 H GLU 32 7.425 -10.072 -17.501 242 HA GLU 32 HA GLU 32 6.757 -12.615 -18.890 243 1HB GLU 32 HB2 GLU 32 6.692 -10.563 -20.286 244 2HB GLU 32 HB3 GLU 32 8.348 -10.177 -19.804 245 1HG GLU 32 HG2 GLU 32 9.080 -12.381 -20.820 246 2HG GLU 32 HG3 GLU 32 7.427 -12.618 -21.383 247 H SER 33 H SER 33 8.157 -14.264 -18.472 248 HA SER 33 HA SER 33 10.964 -13.932 -18.302 249 1HB SER 33 HB2 SER 33 10.210 -13.169 -15.945 250 2HB SER 33 HB3 SER 33 9.746 -14.844 -15.660 251 HG SER 33 HG SER 33 11.929 -14.077 -15.057 252 H MET 34 H MET 34 11.953 -16.158 -17.771 253 HA MET 34 HA MET 34 12.227 -18.141 -18.838 254 1HB MET 34 HB2 MET 34 11.106 -19.987 -17.701 255 2HB MET 34 HB3 MET 34 11.823 -18.815 -16.618 256 1HG MET 34 HG2 MET 34 8.859 -18.717 -17.244 257 2HG MET 34 HG3 MET 34 9.517 -19.852 -16.071 258 1HE MET 34 HE1 MET 34 7.263 -18.081 -15.268 259 2HE MET 34 HE2 MET 34 8.074 -18.931 -13.938 260 3HE MET 34 HE3 MET 34 7.739 -17.186 -13.808 261 H LYS 35 H LYS 35 11.023 -16.641 -20.651 262 HA LYS 35 HA LYS 35 9.834 -16.576 -22.560 263 1HB LYS 35 HB2 LYS 35 10.132 -19.603 -22.511 264 2HB LYS 35 HB3 LYS 35 9.821 -18.616 -23.926 265 1HG LYS 35 HG2 LYS 35 12.365 -18.620 -22.250 266 2HG LYS 35 HG3 LYS 35 12.152 -19.337 -23.836 267 1HD LYS 35 HD2 LYS 35 12.052 -16.351 -23.214 268 2HD LYS 35 HD3 LYS 35 13.394 -17.231 -23.949 269 1HE LYS 35 HE2 LYS 35 11.933 -17.867 -25.868 270 2HE LYS 35 HE3 LYS 35 10.606 -16.938 -25.159 271 1HZ LYS 35 HZ1 LYS 35 11.779 -15.663 -26.832 272 2HZ LYS 35 HZ2 LYS 35 11.973 -14.942 -25.387 273 3HZ LYS 35 HZ3 LYS 35 13.196 -15.804 -26.045 274 H MET 36 H MET 36 8.199 -16.613 -20.159 275 HA MET 36 HA MET 36 5.606 -17.368 -21.365 276 1HB MET 36 HB2 MET 36 6.640 -18.049 -18.569 277 2HB MET 36 HB3 MET 36 4.931 -18.078 -18.995 278 1HG MET 36 HG2 MET 36 7.059 -19.783 -20.328 279 2HG MET 36 HG3 MET 36 5.993 -20.308 -19.030 280 1HE MET 36 HE1 MET 36 4.730 -22.306 -22.168 281 2HE MET 36 HE2 MET 36 6.403 -21.808 -21.834 282 3HE MET 36 HE3 MET 36 5.375 -22.417 -20.516 283 H GLU 37 H GLU 37 3.839 -16.281 -20.022 284 HA GLU 37 HA GLU 37 4.721 -13.726 -18.803 285 1HB GLU 37 HB2 GLU 37 2.194 -14.144 -20.455 286 2HB GLU 37 HB3 GLU 37 2.627 -12.712 -19.534 287 1HG GLU 37 HG2 GLU 37 3.189 -12.102 -21.691 288 2HG GLU 37 HG3 GLU 37 4.738 -12.542 -20.986 289 H ILE 38 H ILE 38 3.761 -13.347 -16.822 290 HA ILE 38 HA ILE 38 1.993 -15.454 -15.697 291 HB ILE 38 HB ILE 38 4.502 -14.299 -14.389 292 1HG1 ILE 38 HG12 ILE 38 5.131 -16.910 -14.593 293 2HG1 ILE 38 HG13 ILE 38 4.126 -16.820 -16.024 294 1HG2 ILE 38 HG21 ILE 38 2.731 -14.996 -12.809 295 2HG2 ILE 38 HG22 ILE 38 2.655 -16.594 -13.583 296 3HG2 ILE 38 HG23 ILE 38 4.117 -16.076 -12.718 297 1HD1 ILE 38 HD11 ILE 38 5.676 -14.912 -16.823 298 2HD1 ILE 38 HD12 ILE 38 6.672 -15.259 -15.402 299 3HD1 ILE 38 HD13 ILE 38 6.440 -16.490 -16.652 300 HA PRO 39 HA PRO 39 -0.113 -11.631 -14.427 301 1HB PRO 39 HB2 PRO 39 -1.330 -13.435 -12.348 302 2HB PRO 39 HB3 PRO 39 -2.136 -12.282 -13.451 303 1HG PRO 39 HG2 PRO 39 -2.206 -14.968 -13.890 304 2HG PRO 39 HG3 PRO 39 -2.031 -13.813 -15.254 305 1HD PRO 39 HD2 PRO 39 0.108 -15.463 -13.900 306 2HD PRO 39 HD3 PRO 39 -0.128 -15.103 -15.638 307 H ILE 40 H ILE 40 0.057 -10.156 -12.725 308 HA ILE 40 HA ILE 40 1.350 -10.991 -10.184 309 HB ILE 40 HB ILE 40 1.789 -8.420 -11.735 310 1HG1 ILE 40 HG12 ILE 40 3.115 -10.228 -12.735 311 2HG1 ILE 40 HG13 ILE 40 4.095 -8.967 -12.016 312 1HG2 ILE 40 HG21 ILE 40 3.451 -7.906 -9.915 313 2HG2 ILE 40 HG22 ILE 40 1.764 -7.880 -9.398 314 3HG2 ILE 40 HG23 ILE 40 2.793 -9.269 -8.993 315 1HD1 ILE 40 HD11 ILE 40 5.020 -11.194 -11.568 316 2HD1 ILE 40 HD12 ILE 40 4.577 -10.400 -10.056 317 3HD1 ILE 40 HD13 ILE 40 3.538 -11.675 -10.725 318 H VAL 41 H VAL 41 0.170 -10.337 -8.469 319 HA VAL 41 HA VAL 41 -2.347 -8.839 -8.970 320 HB VAL 41 HB VAL 41 -3.275 -10.491 -7.215 321 1HG1 VAL 41 HG11 VAL 41 -3.757 -12.247 -8.910 322 2HG1 VAL 41 HG12 VAL 41 -4.063 -10.615 -9.470 323 3HG1 VAL 41 HG13 VAL 41 -2.596 -11.471 -10.016 324 1HG2 VAL 41 HG21 VAL 41 -2.287 -12.676 -7.032 325 2HG2 VAL 41 HG22 VAL 41 -0.998 -12.276 -8.173 326 3HG2 VAL 41 HG23 VAL 41 -1.051 -11.498 -6.567 327 H ALA 42 H ALA 42 -3.304 -7.930 -7.066 328 HA ALA 42 HA ALA 42 -1.571 -6.429 -5.391 329 1HB ALA 42 HB1 ALA 42 -3.686 -5.859 -4.233 330 2HB ALA 42 HB2 ALA 42 -3.925 -5.819 -5.998 331 3HB ALA 42 HB3 ALA 42 -4.498 -7.200 -5.060 332 H ASP 43 H ASP 43 -0.305 -7.318 -3.831 333 HA ASP 43 HA ASP 43 -0.782 -9.828 -2.537 334 1HB ASP 43 HB2 ASP 43 1.452 -8.877 -2.700 335 2HB ASP 43 HB3 ASP 43 0.950 -7.436 -1.811 336 H ARG 44 H ARG 44 -1.948 -6.566 -1.912 337 HA ARG 44 HA ARG 44 -3.739 -7.463 0.168 338 1HB ARG 44 HB2 ARG 44 -2.946 -5.888 1.875 339 2HB ARG 44 HB3 ARG 44 -1.767 -7.140 1.523 340 1HG ARG 44 HG2 ARG 44 -0.648 -5.354 -0.060 341 2HG ARG 44 HG3 ARG 44 -1.707 -4.201 0.764 342 1HD ARG 44 HD2 ARG 44 0.432 -4.195 1.866 343 2HD ARG 44 HD3 ARG 44 -0.741 -4.982 2.946 344 HE ARG 44 HE ARG 44 0.679 -6.876 1.255 345 1HH1 ARG 44 HH21 ARG 44 0.814 -5.280 4.455 346 2HH1 ARG 44 HH22 ARG 44 2.263 -6.107 4.904 347 1HH2 ARG 44 HH11 ARG 44 2.263 -8.100 1.943 348 2HH2 ARG 44 HH12 ARG 44 3.067 -7.887 3.489 349 H SER 45 H SER 45 -5.237 -5.623 0.763 350 HA SER 45 HA SER 45 -5.962 -4.223 -1.679 351 1HB SER 45 HB2 SER 45 -7.234 -4.127 1.087 352 2HB SER 45 HB3 SER 45 -8.007 -3.765 -0.464 353 HG SER 45 HG SER 45 -8.470 -5.899 0.370 354 H GLY 46 H GLY 46 -6.400 -1.898 -1.793 355 1HA GLY 46 HA2 GLY 46 -6.327 -0.022 0.153 356 2HA GLY 46 HA3 GLY 46 -4.610 -0.175 -0.243 357 H ILE 47 H ILE 47 -5.342 2.233 -0.717 358 HA ILE 47 HA ILE 47 -6.180 2.565 -3.551 359 HB ILE 47 HB ILE 47 -5.381 4.603 -1.421 360 1HG1 ILE 47 HG12 ILE 47 -7.539 3.655 -0.826 361 2HG1 ILE 47 HG13 ILE 47 -7.731 5.307 -1.386 362 1HG2 ILE 47 HG21 ILE 47 -6.388 5.042 -4.257 363 2HG2 ILE 47 HG22 ILE 47 -6.279 6.304 -3.013 364 3HG2 ILE 47 HG23 ILE 47 -4.817 5.503 -3.580 365 1HD1 ILE 47 HD11 ILE 47 -8.500 4.443 -3.618 366 2HD1 ILE 47 HD12 ILE 47 -8.355 2.787 -2.980 367 3HD1 ILE 47 HD13 ILE 47 -9.523 3.911 -2.269 368 H VAL 48 H VAL 48 -4.620 2.940 -5.078 369 HA VAL 48 HA VAL 48 -1.828 2.338 -4.526 370 HB VAL 48 HB VAL 48 -3.166 3.420 -7.019 371 1HG1 VAL 48 HG11 VAL 48 -0.538 1.893 -6.624 372 2HG1 VAL 48 HG12 VAL 48 -1.226 2.445 -8.169 373 3HG1 VAL 48 HG13 VAL 48 -0.666 3.628 -6.979 374 1HG2 VAL 48 HG21 VAL 48 -3.155 1.059 -7.793 375 2HG2 VAL 48 HG22 VAL 48 -2.616 0.532 -6.180 376 3HG2 VAL 48 HG23 VAL 48 -4.214 1.274 -6.407 377 H LYS 49 H LYS 49 -0.867 3.776 -3.201 378 HA LYS 49 HA LYS 49 -1.378 6.640 -3.306 379 1HB LYS 49 HB2 LYS 49 -0.762 5.479 -1.197 380 2HB LYS 49 HB3 LYS 49 0.773 4.979 -1.904 381 1HG LYS 49 HG2 LYS 49 1.117 6.823 -0.399 382 2HG LYS 49 HG3 LYS 49 1.509 7.331 -2.042 383 1HD LYS 49 HD2 LYS 49 -0.682 8.485 -2.221 384 2HD LYS 49 HD3 LYS 49 -1.118 7.953 -0.593 385 1HE LYS 49 HE2 LYS 49 1.272 9.726 -1.298 386 2HE LYS 49 HE3 LYS 49 -0.299 10.329 -0.770 387 1HZ LYS 49 HZ1 LYS 49 1.231 10.220 1.067 388 2HZ LYS 49 HZ2 LYS 49 0.021 9.167 1.335 389 3HZ LYS 49 HZ3 LYS 49 1.494 8.628 0.863 390 H GLU 50 H GLU 50 1.105 4.314 -4.539 391 HA GLU 50 HA GLU 50 1.766 6.234 -6.629 392 1HB GLU 50 HB2 GLU 50 3.220 6.778 -4.507 393 2HB GLU 50 HB3 GLU 50 4.095 5.298 -4.905 394 1HG GLU 50 HG2 GLU 50 4.723 6.216 -7.085 395 2HG GLU 50 HG3 GLU 50 3.654 7.602 -6.856 396 H VAL 51 H VAL 51 3.417 5.158 -8.182 397 HA VAL 51 HA VAL 51 3.346 2.193 -8.047 398 HB VAL 51 HB VAL 51 3.006 3.803 -10.613 399 1HG1 VAL 51 HG11 VAL 51 2.633 0.825 -9.999 400 2HG1 VAL 51 HG12 VAL 51 2.340 1.603 -11.564 401 3HG1 VAL 51 HG13 VAL 51 3.979 1.537 -10.915 402 1HG2 VAL 51 HG21 VAL 51 0.873 2.369 -8.992 403 2HG2 VAL 51 HG22 VAL 51 0.944 4.124 -9.306 404 3HG2 VAL 51 HG23 VAL 51 0.648 3.001 -10.638 405 H LYS 52 H LYS 52 5.373 1.319 -8.459 406 HA LYS 52 HA LYS 52 7.582 3.325 -8.511 407 1HB LYS 52 HB2 LYS 52 7.465 0.451 -7.488 408 2HB LYS 52 HB3 LYS 52 8.867 1.507 -7.386 409 1HG LYS 52 HG2 LYS 52 6.214 1.933 -5.946 410 2HG LYS 52 HG3 LYS 52 7.733 1.364 -5.254 411 1HD LYS 52 HD2 LYS 52 8.791 3.566 -5.966 412 2HD LYS 52 HD3 LYS 52 7.153 4.141 -6.360 413 1HE LYS 52 HE2 LYS 52 6.432 3.718 -4.040 414 2HE LYS 52 HE3 LYS 52 8.030 3.070 -3.638 415 1HZ LYS 52 HZ1 LYS 52 8.952 5.276 -4.116 416 2HZ LYS 52 HZ2 LYS 52 7.453 5.864 -4.456 417 3HZ LYS 52 HZ3 LYS 52 7.824 5.366 -2.941 418 H LYS 53 H LYS 53 6.110 1.451 -10.786 419 HA LYS 53 HA LYS 53 8.599 0.858 -12.276 420 1HB LYS 53 HB2 LYS 53 6.399 -1.132 -11.544 421 2HB LYS 53 HB3 LYS 53 7.612 -1.419 -12.775 422 1HG LYS 53 HG2 LYS 53 8.300 -0.992 -9.848 423 2HG LYS 53 HG3 LYS 53 8.090 -2.566 -10.625 424 1HD LYS 53 HD2 LYS 53 9.863 -2.030 -12.253 425 2HD LYS 53 HD3 LYS 53 10.127 -0.461 -11.466 426 1HE LYS 53 HE2 LYS 53 10.859 -1.546 -9.411 427 2HE LYS 53 HE3 LYS 53 10.468 -3.135 -10.050 428 1HZ LYS 53 HZ1 LYS 53 12.559 -1.315 -11.089 429 2HZ LYS 53 HZ2 LYS 53 12.757 -2.783 -10.332 430 3HZ LYS 53 HZ3 LYS 53 12.124 -2.706 -11.839 431 H LYS 54 H LYS 54 7.800 -0.199 -14.495 432 HA LYS 54 HA LYS 54 5.352 0.982 -15.526 433 1HB LYS 54 HB2 LYS 54 6.477 2.193 -17.336 434 2HB LYS 54 HB3 LYS 54 6.882 2.888 -15.772 435 1HG LYS 54 HG2 LYS 54 9.082 1.809 -15.787 436 2HG LYS 54 HG3 LYS 54 8.709 0.952 -17.283 437 1HD LYS 54 HD2 LYS 54 8.847 3.984 -17.035 438 2HD LYS 54 HD3 LYS 54 10.178 2.945 -17.571 439 1HE LYS 54 HE2 LYS 54 8.752 2.087 -19.435 440 2HE LYS 54 HE3 LYS 54 7.463 3.192 -18.943 441 1HZ LYS 54 HZ1 LYS 54 8.960 5.045 -19.406 442 2HZ LYS 54 HZ2 LYS 54 10.152 4.023 -19.867 443 3HZ LYS 54 HZ3 LYS 54 8.777 4.120 -20.734 444 H GLU 55 H GLU 55 5.046 0.269 -17.790 445 HA GLU 55 HA GLU 55 5.561 -2.474 -18.242 446 1HB GLU 55 HB2 GLU 55 5.075 -0.383 -20.412 447 2HB GLU 55 HB3 GLU 55 4.733 -2.107 -20.459 448 1HG GLU 55 HG2 GLU 55 2.622 -1.391 -20.054 449 2HG GLU 55 HG3 GLU 55 3.146 -1.502 -18.379 450 H GLY 56 H GLY 56 7.247 -3.558 -19.234 451 1HA GLY 56 HA2 GLY 56 9.078 -3.922 -20.523 452 2HA GLY 56 HA3 GLY 56 9.214 -2.195 -20.874 453 H ASP 57 H ASP 57 9.053 -2.147 -17.541 454 HA ASP 57 HA ASP 57 11.922 -1.762 -17.400 455 1HB ASP 57 HB2 ASP 57 10.262 -0.390 -16.117 456 2HB ASP 57 HB3 ASP 57 9.952 -1.797 -15.091 457 H PHE 58 H PHE 58 13.341 -2.813 -15.921 458 HA PHE 58 HA PHE 58 13.138 -5.733 -15.831 459 1HB PHE 58 HB2 PHE 58 15.295 -4.624 -16.198 460 2HB PHE 58 HB3 PHE 58 15.106 -3.697 -14.719 461 HD1 PHE 58 HD1 PHE 58 15.607 -4.652 -12.535 462 HD2 PHE 58 HD2 PHE 58 15.833 -7.069 -16.103 463 HE1 PHE 58 HE1 PHE 58 16.883 -6.376 -11.291 464 HE2 PHE 58 HE2 PHE 58 17.100 -8.793 -14.851 465 HZ PHE 58 HZ PHE 58 17.658 -8.436 -12.455 466 H VAL 59 H VAL 59 12.811 -6.977 -13.944 467 HA VAL 59 HA VAL 59 12.322 -5.605 -11.399 468 HB VAL 59 HB VAL 59 10.239 -6.966 -11.053 469 1HG1 VAL 59 HG11 VAL 59 10.186 -4.561 -11.449 470 2HG1 VAL 59 HG12 VAL 59 10.053 -4.821 -13.208 471 3HG1 VAL 59 HG13 VAL 59 8.761 -5.342 -12.128 472 1HG2 VAL 59 HG21 VAL 59 10.474 -8.552 -12.940 473 2HG2 VAL 59 HG22 VAL 59 8.923 -7.707 -12.948 474 3HG2 VAL 59 HG23 VAL 59 10.187 -7.220 -14.091 475 H ASN 60 H ASN 60 12.143 -7.182 -9.601 476 HA ASN 60 HA ASN 60 13.494 -9.711 -10.127 477 1HB ASN 60 HB2 ASN 60 15.071 -7.491 -9.580 478 2HB ASN 60 HB3 ASN 60 14.813 -8.166 -7.970 479 1HD2 ASN 60 HD22 ASN 60 15.519 -9.193 -11.355 480 2HD2 ASN 60 HD21 ASN 60 16.679 -10.436 -10.923 481 H GLU 61 H GLU 61 13.842 -10.939 -8.090 482 HA GLU 61 HA GLU 61 11.374 -11.189 -6.669 483 1HB GLU 61 HB2 GLU 61 12.839 -13.077 -7.151 484 2HB GLU 61 HB3 GLU 61 14.154 -12.355 -6.228 485 1HG GLU 61 HG2 GLU 61 12.701 -12.508 -4.159 486 2HG GLU 61 HG3 GLU 61 11.454 -13.283 -5.135 487 H GLY 62 H GLY 62 10.695 -9.597 -5.360 488 1HA GLY 62 HA2 GLY 62 10.689 -8.650 -3.206 489 2HA GLY 62 HA3 GLY 62 12.456 -8.604 -3.189 490 H ASP 63 H ASP 63 11.436 -7.560 -6.306 491 HA ASP 63 HA ASP 63 12.249 -4.845 -5.650 492 1HB ASP 63 HB2 ASP 63 12.820 -6.230 -7.749 493 2HB ASP 63 HB3 ASP 63 11.182 -5.890 -8.300 494 H VAL 64 H VAL 64 10.839 -3.154 -5.250 495 HA VAL 64 HA VAL 64 8.100 -3.759 -4.722 496 HB VAL 64 HB VAL 64 9.401 -1.012 -4.878 497 1HG1 VAL 64 HG11 VAL 64 7.640 -0.412 -3.196 498 2HG1 VAL 64 HG12 VAL 64 6.935 -0.883 -4.738 499 3HG1 VAL 64 HG13 VAL 64 6.932 -2.034 -3.388 500 1HG2 VAL 64 HG21 VAL 64 10.689 -2.412 -3.303 501 2HG2 VAL 64 HG22 VAL 64 9.707 -1.257 -2.408 502 3HG2 VAL 64 HG23 VAL 64 9.182 -2.950 -2.526 503 H LEU 65 H LEU 65 6.232 -3.095 -5.762 504 HA LEU 65 HA LEU 65 6.490 -2.362 -8.648 505 1HB LEU 65 HB2 LEU 65 5.709 -4.624 -8.366 506 2HB LEU 65 HB3 LEU 65 4.529 -4.140 -7.149 507 HG LEU 65 HG LEU 65 3.185 -2.955 -8.808 508 1HD1 LEU 65 HD11 LEU 65 3.725 -3.191 -11.258 509 2HD1 LEU 65 HD12 LEU 65 4.817 -2.125 -10.386 510 3HD1 LEU 65 HD13 LEU 65 5.343 -3.773 -10.803 511 1HD2 LEU 65 HD21 LEU 65 2.780 -5.345 -8.459 512 2HD2 LEU 65 HD22 LEU 65 2.524 -4.934 -10.167 513 3HD2 LEU 65 HD23 LEU 65 4.011 -5.748 -9.676 514 H LEU 66 H LEU 66 4.506 -1.945 -5.601 515 HA LEU 66 HA LEU 66 4.024 0.800 -6.450 516 1HB LEU 66 HB2 LEU 66 1.599 0.723 -6.479 517 2HB LEU 66 HB3 LEU 66 2.282 -0.304 -7.710 518 HG LEU 66 HG LEU 66 1.853 -2.274 -6.150 519 1HD1 LEU 66 HD11 LEU 66 1.431 -1.197 -3.990 520 2HD1 LEU 66 HD12 LEU 66 0.177 -0.165 -4.712 521 3HD1 LEU 66 HD13 LEU 66 -0.072 -1.916 -4.538 522 1HD2 LEU 66 HD21 LEU 66 0.521 -1.842 -8.105 523 2HD2 LEU 66 HD22 LEU 66 -0.500 -2.434 -6.801 524 3HD2 LEU 66 HD23 LEU 66 -0.509 -0.699 -7.199 525 H GLU 67 H GLU 67 2.528 1.906 -4.819 526 HA GLU 67 HA GLU 67 3.259 1.056 -2.065 527 1HB GLU 67 HB2 GLU 67 4.745 2.890 -3.115 528 2HB GLU 67 HB3 GLU 67 3.291 3.876 -3.205 529 1HG GLU 67 HG2 GLU 67 4.272 4.625 -1.262 530 2HG GLU 67 HG3 GLU 67 3.090 3.483 -0.633 531 H LEU 68 H LEU 68 1.557 1.341 -0.620 532 HA LEU 68 HA LEU 68 -1.034 2.220 -1.798 533 1HB LEU 68 HB2 LEU 68 -0.402 0.039 0.230 534 2HB LEU 68 HB3 LEU 68 -2.033 0.565 -0.161 535 HG LEU 68 HG LEU 68 -0.132 -0.687 -2.162 536 1HD1 LEU 68 HD11 LEU 68 -1.600 -2.668 -1.966 537 2HD1 LEU 68 HD12 LEU 68 -0.812 -2.287 -0.427 538 3HD1 LEU 68 HD13 LEU 68 -2.519 -1.862 -0.683 539 1HD2 LEU 68 HD21 LEU 68 -1.760 0.781 -3.232 540 2HD2 LEU 68 HD22 LEU 68 -2.141 -0.882 -3.583 541 3HD2 LEU 68 HD23 LEU 68 -3.098 -0.006 -2.373 542 H SER 69 H SER 69 -2.643 3.057 -0.360 543 HA SER 69 HA SER 69 -1.791 4.851 1.701 544 1HB SER 69 HB2 SER 69 -4.281 4.904 2.144 545 2HB SER 69 HB3 SER 69 -3.828 5.240 0.464 546 HG SER 69 HG SER 69 -5.588 3.608 1.044 547 H ASN 70 H ASN 70 -2.806 1.494 1.637 548 HA ASN 70 HA ASN 70 -3.551 0.917 4.231 549 1HB ASN 70 HB2 ASN 70 -3.757 -0.758 2.534 550 2HB ASN 70 HB3 ASN 70 -2.030 -0.704 2.154 551 1HD2 ASN 70 HD22 ASN 70 -0.760 -2.277 3.102 552 2HD2 ASN 70 HD21 ASN 70 -1.207 -3.221 4.510 553 H SER 71 H SER 71 -2.596 0.548 6.154 554 HA SER 71 HA SER 71 0.341 0.220 6.361 555 1HB SER 71 HB2 SER 71 -1.310 2.109 8.097 556 2HB SER 71 HB3 SER 71 0.428 1.803 8.229 557 HG SER 71 HG SER 71 -0.048 3.735 7.097 558 H THR 72 H THR 72 -2.409 -1.415 6.729 559 HA THR 72 HA THR 72 -1.795 -2.439 9.466 560 HB THR 72 HB THR 72 -4.348 -2.728 9.561 561 HG1 THR 72 HG1 THR 72 -5.531 -1.419 8.229 562 1HG2 THR 72 HG21 THR 72 -4.699 -0.449 10.384 563 2HG2 THR 72 HG22 THR 72 -3.100 -1.020 10.879 564 3HG2 THR 72 HG23 THR 72 -3.251 0.126 9.530 565 H GLN 73 H GLN 73 -3.160 -3.241 6.215 566 HA GLN 73 HA GLN 73 -3.170 -6.107 6.777 567 1HB GLN 73 HB2 GLN 73 -3.193 -4.612 4.111 568 2HB GLN 73 HB3 GLN 73 -3.378 -6.353 4.334 569 1HG GLN 73 HG2 GLN 73 -5.422 -5.903 5.745 570 2HG GLN 73 HG3 GLN 73 -5.278 -4.192 5.336 571 1HE2 GLN 73 HE21 GLN 73 -7.605 -4.798 4.589 572 2HE2 GLN 73 HE22 GLN 73 -7.766 -5.349 2.938 Start of MODEL 6 1 1H THR 2 H1 THR 2 1.607 -2.284 0.076 2 2H THR 2 H2 THR 2 2.784 -2.612 1.167 3 3H THR 2 H3 THR 2 2.421 -1.051 0.823 4 HA THR 2 HA THR 2 3.172 -1.354 -1.454 5 HB THR 2 HB THR 2 5.147 -1.908 0.789 6 HG1 THR 2 HG1 THR 2 5.189 0.324 0.832 7 1HG2 THR 2 HG21 THR 2 6.246 -2.227 -1.445 8 2HG2 THR 2 HG22 THR 2 5.689 -0.599 -1.915 9 3HG2 THR 2 HG23 THR 2 6.833 -0.803 -0.578 10 H VAL 3 H VAL 3 3.918 -2.751 -3.094 11 HA VAL 3 HA VAL 3 3.922 -5.646 -2.448 12 HB VAL 3 HB VAL 3 2.394 -4.668 -4.847 13 1HG1 VAL 3 HG11 VAL 3 1.122 -6.740 -4.485 14 2HG1 VAL 3 HG12 VAL 3 2.852 -7.080 -4.552 15 3HG1 VAL 3 HG13 VAL 3 2.020 -7.035 -2.977 16 1HG2 VAL 3 HG21 VAL 3 1.098 -4.831 -2.092 17 2HG2 VAL 3 HG22 VAL 3 1.238 -3.374 -3.115 18 3HG2 VAL 3 HG23 VAL 3 0.232 -4.718 -3.640 19 H SER 4 H SER 4 5.115 -6.870 -3.971 20 HA SER 4 HA SER 4 6.922 -5.370 -5.797 21 1HB SER 4 HB2 SER 4 7.727 -7.370 -3.641 22 2HB SER 4 HB3 SER 4 8.815 -6.466 -4.699 23 HG SER 4 HG SER 4 8.574 -5.585 -2.550 24 H ILE 5 H ILE 5 8.151 -6.771 -7.202 25 HA ILE 5 HA ILE 5 6.605 -9.045 -8.218 26 HB ILE 5 HB ILE 5 9.355 -8.030 -9.053 27 1HG1 ILE 5 HG12 ILE 5 7.900 -6.133 -9.317 28 2HG1 ILE 5 HG13 ILE 5 8.189 -6.832 -10.894 29 1HG2 ILE 5 HG21 ILE 5 8.773 -9.080 -11.242 30 2HG2 ILE 5 HG22 ILE 5 8.880 -10.251 -9.940 31 3HG2 ILE 5 HG23 ILE 5 7.286 -9.736 -10.523 32 1HD1 ILE 5 HD11 ILE 5 5.965 -7.904 -10.878 33 2HD1 ILE 5 HD12 ILE 5 5.645 -7.179 -9.280 34 3HD1 ILE 5 HD13 ILE 5 5.887 -6.148 -10.699 35 H GLN 6 H GLN 6 7.419 -11.248 -8.173 36 HA GLN 6 HA GLN 6 9.075 -11.743 -5.743 37 1HB GLN 6 HB2 GLN 6 7.129 -13.727 -6.915 38 2HB GLN 6 HB3 GLN 6 7.779 -13.613 -5.290 39 1HG GLN 6 HG2 GLN 6 5.647 -12.874 -4.900 40 2HG GLN 6 HG3 GLN 6 6.439 -11.330 -5.177 41 1HE2 GLN 6 HE22 GLN 6 5.098 -9.995 -6.488 42 2HE2 GLN 6 HE21 GLN 6 4.110 -10.629 -7.798 43 H MET 7 H MET 7 9.802 -11.616 -8.875 44 HA MET 7 HA MET 7 11.665 -13.839 -8.911 45 1HB MET 7 HB2 MET 7 10.691 -14.873 -10.955 46 2HB MET 7 HB3 MET 7 9.629 -15.020 -9.556 47 1HG MET 7 HG2 MET 7 8.435 -12.907 -10.444 48 2HG MET 7 HG3 MET 7 9.298 -13.203 -11.946 49 1HE MET 7 HE1 MET 7 5.245 -14.436 -11.246 50 2HE MET 7 HE2 MET 7 6.214 -13.474 -10.121 51 3HE MET 7 HE3 MET 7 6.108 -13.004 -11.834 52 H ALA 8 H ALA 8 13.043 -13.680 -10.877 53 HA ALA 8 HA ALA 8 13.464 -10.906 -11.720 54 1HB ALA 8 HB1 ALA 8 14.874 -13.481 -12.501 55 2HB ALA 8 HB2 ALA 8 15.412 -11.827 -12.868 56 3HB ALA 8 HB3 ALA 8 15.357 -12.386 -11.178 57 H GLY 9 H GLY 9 12.975 -9.992 -13.686 58 1HA GLY 9 HA2 GLY 9 12.589 -11.382 -16.098 59 2HA GLY 9 HA3 GLY 9 11.005 -11.250 -15.338 60 H ASN 10 H ASN 10 10.224 -9.863 -16.965 61 HA ASN 10 HA ASN 10 11.103 -7.021 -16.733 62 1HB ASN 10 HB2 ASN 10 10.779 -8.673 -19.249 63 2HB ASN 10 HB3 ASN 10 10.247 -6.997 -19.249 64 1HD2 ASN 10 HD22 ASN 10 13.144 -7.974 -17.322 65 2HD2 ASN 10 HD21 ASN 10 14.271 -7.199 -18.414 66 H LEU 11 H LEU 11 9.381 -5.619 -16.718 67 HA LEU 11 HA LEU 11 6.963 -6.853 -15.721 68 1HB LEU 11 HB2 LEU 11 8.248 -4.974 -14.653 69 2HB LEU 11 HB3 LEU 11 7.701 -3.918 -15.951 70 HG LEU 11 HG LEU 11 5.323 -4.392 -15.279 71 1HD1 LEU 11 HD11 LEU 11 5.430 -6.565 -14.205 72 2HD1 LEU 11 HD12 LEU 11 6.648 -5.994 -13.044 73 3HD1 LEU 11 HD13 LEU 11 4.980 -5.396 -12.969 74 1HD2 LEU 11 HD21 LEU 11 7.169 -3.441 -13.050 75 2HD2 LEU 11 HD22 LEU 11 6.597 -2.458 -14.426 76 3HD2 LEU 11 HD23 LEU 11 5.451 -3.039 -13.219 77 H TRP 12 H TRP 12 6.260 -7.771 -17.711 78 HA TRP 12 HA TRP 12 5.947 -6.868 -20.176 79 1HB TRP 12 HB2 TRP 12 5.224 -9.079 -19.051 80 2HB TRP 12 HB3 TRP 12 3.665 -8.325 -18.812 81 HD1 TRP 12 HD1 TRP 12 6.084 -9.080 -21.675 82 HE1 TRP 12 HE1 TRP 12 4.803 -9.807 -23.770 83 HE3 TRP 12 HE3 TRP 12 1.329 -8.466 -19.923 84 HZ2 TRP 12 HZ2 TRP 12 2.028 -10.134 -24.560 85 HZ3 TRP 12 HZ3 TRP 12 -0.620 -9.043 -21.342 86 HH2 TRP 12 HH2 TRP 12 -0.283 -9.869 -23.663 87 H LYS 13 H LYS 13 3.282 -6.334 -17.779 88 HA LYS 13 HA LYS 13 2.612 -3.760 -19.007 89 1HB LYS 13 HB2 LYS 13 0.667 -6.108 -18.873 90 2HB LYS 13 HB3 LYS 13 0.167 -4.421 -19.075 91 1HG LYS 13 HG2 LYS 13 1.517 -4.303 -21.181 92 2HG LYS 13 HG3 LYS 13 1.853 -6.039 -21.020 93 1HD LYS 13 HD2 LYS 13 -0.630 -6.459 -20.994 94 2HD LYS 13 HD3 LYS 13 -0.893 -4.751 -21.354 95 1HE LYS 13 HE2 LYS 13 0.707 -6.710 -23.075 96 2HE LYS 13 HE3 LYS 13 -0.978 -6.267 -23.356 97 1HZ LYS 13 HZ1 LYS 13 -0.259 -3.974 -23.706 98 2HZ LYS 13 HZ2 LYS 13 1.310 -4.388 -23.482 99 3HZ LYS 13 HZ3 LYS 13 0.480 -4.977 -24.752 100 H VAL 14 H VAL 14 1.039 -2.595 -17.586 101 HA VAL 14 HA VAL 14 0.883 -3.583 -14.788 102 HB VAL 14 HB VAL 14 1.975 -0.849 -15.604 103 1HG1 VAL 14 HG11 VAL 14 2.445 -0.581 -13.145 104 2HG1 VAL 14 HG12 VAL 14 0.721 -0.619 -13.509 105 3HG1 VAL 14 HG13 VAL 14 1.517 -2.058 -12.827 106 1HG2 VAL 14 HG21 VAL 14 3.695 -2.586 -15.879 107 2HG2 VAL 14 HG22 VAL 14 4.047 -1.623 -14.452 108 3HG2 VAL 14 HG23 VAL 14 3.310 -3.241 -14.272 109 H HIS 15 H HIS 15 -0.971 -2.808 -13.719 110 HA HIS 15 HA HIS 15 -2.991 -1.503 -15.489 111 1HB HIS 15 HB2 HIS 15 -3.622 -3.745 -13.577 112 2HB HIS 15 HB3 HIS 15 -4.529 -3.206 -14.985 113 HD1 HIS 15 HD1 HIS 15 -2.442 -3.618 -17.320 114 HD2 HIS 15 HD2 HIS 15 -2.783 -6.091 -13.941 115 HE1 HIS 15 HE1 HIS 15 -1.281 -5.824 -17.903 116 H VAL 16 H VAL 16 -1.366 -0.319 -13.221 117 HA VAL 16 HA VAL 16 -3.639 0.678 -11.605 118 HB VAL 16 HB VAL 16 -2.093 0.764 -9.632 119 1HG1 VAL 16 HG11 VAL 16 -3.908 -0.874 -9.745 120 2HG1 VAL 16 HG12 VAL 16 -2.826 -2.035 -10.539 121 3HG1 VAL 16 HG13 VAL 16 -2.503 -1.494 -8.870 122 1HG2 VAL 16 HG21 VAL 16 -0.444 -1.367 -11.040 123 2HG2 VAL 16 HG22 VAL 16 0.055 0.327 -10.873 124 3HG2 VAL 16 HG23 VAL 16 -0.191 -0.654 -9.430 125 H LYS 17 H LYS 17 -3.160 2.735 -10.569 126 HA LYS 17 HA LYS 17 -0.880 4.276 -11.465 127 1HB LYS 17 HB2 LYS 17 -2.222 6.184 -12.242 128 2HB LYS 17 HB3 LYS 17 -2.446 4.788 -13.290 129 1HG LYS 17 HG2 LYS 17 -4.621 4.295 -12.280 130 2HG LYS 17 HG3 LYS 17 -4.428 5.584 -11.095 131 1HD LYS 17 HD2 LYS 17 -4.578 5.973 -14.109 132 2HD LYS 17 HD3 LYS 17 -5.932 6.170 -13.005 133 1HE LYS 17 HE2 LYS 17 -3.369 7.837 -12.952 134 2HE LYS 17 HE3 LYS 17 -4.885 8.318 -13.709 135 1HZ LYS 17 HZ1 LYS 17 -4.503 7.858 -10.798 136 2HZ LYS 17 HZ2 LYS 17 -4.718 9.288 -11.546 137 3HZ LYS 17 HZ3 LYS 17 -5.939 8.214 -11.514 138 H ALA 18 H ALA 18 -0.818 6.324 -10.090 139 HA ALA 18 HA ALA 18 -1.529 5.926 -7.368 140 1HB ALA 18 HB1 ALA 18 0.186 7.551 -8.094 141 2HB ALA 18 HB2 ALA 18 -1.068 8.528 -8.898 142 3HB ALA 18 HB3 ALA 18 -1.075 8.346 -7.132 143 H GLY 19 H GLY 19 -3.394 6.323 -6.229 144 1HA GLY 19 HA2 GLY 19 -5.453 7.231 -5.729 145 2HA GLY 19 HA3 GLY 19 -5.563 7.956 -7.339 146 H ASP 20 H ASP 20 -4.706 4.837 -8.099 147 HA ASP 20 HA ASP 20 -7.437 4.003 -8.654 148 1HB ASP 20 HB2 ASP 20 -5.413 3.444 -10.083 149 2HB ASP 20 HB3 ASP 20 -4.892 2.347 -8.795 150 H GLN 21 H GLN 21 -8.149 1.768 -7.916 151 HA GLN 21 HA GLN 21 -7.489 1.299 -5.040 152 1HB GLN 21 HB2 GLN 21 -9.635 2.418 -5.227 153 2HB GLN 21 HB3 GLN 21 -10.200 1.274 -6.434 154 1HG GLN 21 HG2 GLN 21 -9.317 0.185 -3.750 155 2HG GLN 21 HG3 GLN 21 -10.813 1.102 -3.806 156 1HE2 GLN 21 HE22 GLN 21 -9.776 -2.031 -3.817 157 2HE2 GLN 21 HE21 GLN 21 -11.071 -2.736 -4.758 158 H ILE 22 H ILE 22 -7.210 -0.797 -4.460 159 HA ILE 22 HA ILE 22 -7.612 -2.902 -6.499 160 HB ILE 22 HB ILE 22 -5.491 -3.873 -6.066 161 1HG1 ILE 22 HG12 ILE 22 -5.077 -1.687 -3.990 162 2HG1 ILE 22 HG13 ILE 22 -5.151 -3.434 -3.734 163 1HG2 ILE 22 HG21 ILE 22 -4.961 -0.923 -6.591 164 2HG2 ILE 22 HG22 ILE 22 -4.006 -2.308 -7.146 165 3HG2 ILE 22 HG23 ILE 22 -5.625 -2.049 -7.788 166 1HD1 ILE 22 HD11 ILE 22 -2.948 -1.842 -5.063 167 2HD1 ILE 22 HD12 ILE 22 -2.873 -2.800 -3.568 168 3HD1 ILE 22 HD13 ILE 22 -3.026 -3.618 -5.133 169 H GLU 23 H GLU 23 -7.705 -5.052 -5.544 170 HA GLU 23 HA GLU 23 -8.543 -5.160 -2.719 171 1HB GLU 23 HB2 GLU 23 -10.558 -4.843 -4.041 172 2HB GLU 23 HB3 GLU 23 -10.107 -6.179 -5.118 173 1HG GLU 23 HG2 GLU 23 -10.297 -7.765 -3.224 174 2HG GLU 23 HG3 GLU 23 -10.654 -6.430 -2.125 175 H LYS 24 H LYS 24 -7.965 -7.217 -1.810 176 HA LYS 24 HA LYS 24 -5.668 -8.433 -2.732 177 1HB LYS 24 HB2 LYS 24 -6.700 -8.655 -0.460 178 2HB LYS 24 HB3 LYS 24 -7.877 -9.794 -1.126 179 1HG LYS 24 HG2 LYS 24 -6.015 -11.324 -1.779 180 2HG LYS 24 HG3 LYS 24 -4.849 -10.161 -1.137 181 1HD LYS 24 HD2 LYS 24 -5.988 -10.412 1.141 182 2HD LYS 24 HD3 LYS 24 -7.012 -11.652 0.411 183 1HE LYS 24 HE2 LYS 24 -5.350 -12.926 1.422 184 2HE LYS 24 HE3 LYS 24 -4.819 -12.852 -0.259 185 1HZ LYS 24 HZ1 LYS 24 -2.978 -12.416 1.188 186 2HZ LYS 24 HZ2 LYS 24 -3.317 -10.990 0.455 187 3HZ LYS 24 HZ3 LYS 24 -3.770 -11.251 2.004 188 H GLY 25 H GLY 25 -5.159 -9.650 -4.469 189 1HA GLY 25 HA2 GLY 25 -5.311 -11.504 -5.862 190 2HA GLY 25 HA3 GLY 25 -7.021 -11.702 -5.474 191 H GLN 26 H GLN 26 -6.892 -8.453 -6.184 192 HA GLN 26 HA GLN 26 -7.876 -8.677 -8.875 193 1HB GLN 26 HB2 GLN 26 -8.400 -6.860 -7.224 194 2HB GLN 26 HB3 GLN 26 -6.730 -6.286 -7.360 195 1HG GLN 26 HG2 GLN 26 -7.118 -5.804 -9.770 196 2HG GLN 26 HG3 GLN 26 -8.785 -6.370 -9.614 197 1HE2 GLN 26 HE22 GLN 26 -6.943 -3.578 -9.666 198 2HE2 GLN 26 HE21 GLN 26 -7.950 -2.532 -8.678 199 H GLU 27 H GLU 27 -6.711 -8.442 -10.816 200 HA GLU 27 HA GLU 27 -3.858 -8.944 -10.780 201 1HB GLU 27 HB2 GLU 27 -5.564 -9.751 -12.487 202 2HB GLU 27 HB3 GLU 27 -5.641 -8.096 -13.101 203 1HG GLU 27 HG2 GLU 27 -3.189 -8.222 -13.614 204 2HG GLU 27 HG3 GLU 27 -3.151 -9.860 -12.971 205 H VAL 28 H VAL 28 -2.201 -7.507 -11.141 206 HA VAL 28 HA VAL 28 -2.830 -4.589 -11.207 207 HB VAL 28 HB VAL 28 -1.284 -6.238 -9.187 208 1HG1 VAL 28 HG11 VAL 28 -1.009 -3.235 -9.552 209 2HG1 VAL 28 HG12 VAL 28 -0.459 -4.168 -8.144 210 3HG1 VAL 28 HG13 VAL 28 0.266 -4.446 -9.726 211 1HG2 VAL 28 HG21 VAL 28 -3.405 -4.055 -8.942 212 2HG2 VAL 28 HG22 VAL 28 -3.650 -5.788 -8.679 213 3HG2 VAL 28 HG23 VAL 28 -2.610 -4.873 -7.583 214 H ALA 29 H ALA 29 -0.520 -7.230 -12.036 215 HA ALA 29 HA ALA 29 0.329 -5.635 -14.285 216 1HB ALA 29 HB1 ALA 29 2.398 -6.375 -12.146 217 2HB ALA 29 HB2 ALA 29 2.767 -5.749 -13.760 218 3HB ALA 29 HB3 ALA 29 1.910 -4.731 -12.605 219 H ILE 30 H ILE 30 2.185 -6.997 -15.400 220 HA ILE 30 HA ILE 30 1.838 -9.906 -14.963 221 HB ILE 30 HB ILE 30 1.568 -8.432 -17.613 222 1HG1 ILE 30 HG12 ILE 30 -0.270 -10.511 -16.330 223 2HG1 ILE 30 HG13 ILE 30 -0.513 -8.776 -16.192 224 1HG2 ILE 30 HG21 ILE 30 1.559 -10.660 -18.723 225 2HG2 ILE 30 HG22 ILE 30 3.095 -10.371 -17.942 226 3HG2 ILE 30 HG23 ILE 30 1.906 -11.435 -17.163 227 1HD1 ILE 30 HD11 ILE 30 -0.741 -8.579 -18.649 228 2HD1 ILE 30 HD12 ILE 30 -0.639 -10.355 -18.777 229 3HD1 ILE 30 HD13 ILE 30 -1.971 -9.605 -17.892 230 H LEU 31 H LEU 31 3.736 -10.956 -15.176 231 HA LEU 31 HA LEU 31 6.241 -9.399 -15.652 232 1HB LEU 31 HB2 LEU 31 5.957 -10.134 -13.378 233 2HB LEU 31 HB3 LEU 31 5.517 -11.773 -13.865 234 HG LEU 31 HG LEU 31 7.730 -11.435 -12.787 235 1HD1 LEU 31 HD11 LEU 31 7.264 -13.452 -14.105 236 2HD1 LEU 31 HD12 LEU 31 7.948 -12.687 -15.545 237 3HD1 LEU 31 HD13 LEU 31 8.972 -12.991 -14.139 238 1HD2 LEU 31 HD21 LEU 31 8.226 -9.292 -14.044 239 2HD2 LEU 31 HD22 LEU 31 9.556 -10.440 -13.823 240 3HD2 LEU 31 HD23 LEU 31 8.733 -10.321 -15.400 241 H GLU 32 H GLU 32 7.568 -10.220 -17.270 242 HA GLU 32 HA GLU 32 6.771 -12.764 -18.611 243 1HB GLU 32 HB2 GLU 32 6.344 -10.849 -20.004 244 2HB GLU 32 HB3 GLU 32 7.967 -10.207 -19.761 245 1HG GLU 32 HG2 GLU 32 7.433 -12.928 -21.027 246 2HG GLU 32 HG3 GLU 32 7.392 -11.445 -21.965 247 H SER 33 H SER 33 8.264 -14.330 -18.418 248 HA SER 33 HA SER 33 11.075 -13.935 -18.392 249 1HB SER 33 HB2 SER 33 10.377 -13.169 -16.003 250 2HB SER 33 HB3 SER 33 9.964 -14.858 -15.702 251 HG SER 33 HG SER 33 12.129 -14.046 -15.149 252 H MET 34 H MET 34 12.099 -16.179 -17.844 253 HA MET 34 HA MET 34 12.256 -18.329 -18.591 254 1HB MET 34 HB2 MET 34 10.975 -19.889 -17.138 255 2HB MET 34 HB3 MET 34 11.835 -18.606 -16.299 256 1HG MET 34 HG2 MET 34 9.754 -17.353 -15.983 257 2HG MET 34 HG3 MET 34 8.847 -18.592 -16.852 258 1HE MET 34 HE1 MET 34 8.377 -17.229 -13.909 259 2HE MET 34 HE2 MET 34 7.212 -18.368 -14.618 260 3HE MET 34 HE3 MET 34 7.820 -18.629 -12.970 261 H LYS 35 H LYS 35 11.008 -16.953 -20.553 262 HA LYS 35 HA LYS 35 9.769 -17.066 -22.420 263 1HB LYS 35 HB2 LYS 35 9.997 -20.078 -22.069 264 2HB LYS 35 HB3 LYS 35 9.657 -19.234 -23.567 265 1HG LYS 35 HG2 LYS 35 12.261 -19.136 -21.989 266 2HG LYS 35 HG3 LYS 35 11.973 -20.002 -23.487 267 1HD LYS 35 HD2 LYS 35 11.965 -16.968 -23.165 268 2HD LYS 35 HD3 LYS 35 13.258 -17.951 -23.855 269 1HE LYS 35 HE2 LYS 35 11.713 -18.734 -25.648 270 2HE LYS 35 HE3 LYS 35 10.434 -17.708 -24.989 271 1HZ LYS 35 HZ1 LYS 35 13.013 -16.731 -26.072 272 2HZ LYS 35 HZ2 LYS 35 11.572 -16.634 -26.821 273 3HZ LYS 35 HZ3 LYS 35 11.833 -15.778 -25.461 274 H MET 36 H MET 36 8.207 -16.804 -19.974 275 HA MET 36 HA MET 36 5.567 -17.585 -21.040 276 1HB MET 36 HB2 MET 36 6.630 -18.176 -18.237 277 2HB MET 36 HB3 MET 36 4.919 -18.229 -18.672 278 1HG MET 36 HG2 MET 36 5.420 -19.961 -20.385 279 2HG MET 36 HG3 MET 36 7.091 -20.006 -19.829 280 1HE MET 36 HE1 MET 36 7.905 -20.912 -17.540 281 2HE MET 36 HE2 MET 36 6.839 -19.837 -16.605 282 3HE MET 36 HE3 MET 36 6.850 -21.579 -16.274 283 H GLU 37 H GLU 37 3.858 -16.446 -19.666 284 HA GLU 37 HA GLU 37 4.801 -13.880 -18.523 285 1HB GLU 37 HB2 GLU 37 2.242 -14.285 -20.130 286 2HB GLU 37 HB3 GLU 37 2.709 -12.847 -19.239 287 1HG GLU 37 HG2 GLU 37 3.240 -12.274 -21.415 288 2HG GLU 37 HG3 GLU 37 4.794 -12.720 -20.725 289 H ILE 38 H ILE 38 3.848 -13.437 -16.546 290 HA ILE 38 HA ILE 38 2.076 -15.501 -15.356 291 HB ILE 38 HB ILE 38 4.641 -14.361 -14.141 292 1HG1 ILE 38 HG12 ILE 38 5.119 -17.028 -14.181 293 2HG1 ILE 38 HG13 ILE 38 4.113 -16.943 -15.613 294 1HG2 ILE 38 HG21 ILE 38 2.972 -14.814 -12.424 295 2HG2 ILE 38 HG22 ILE 38 2.661 -16.435 -13.101 296 3HG2 ILE 38 HG23 ILE 38 4.218 -16.053 -12.351 297 1HD1 ILE 38 HD11 ILE 38 6.454 -16.771 -16.241 298 2HD1 ILE 38 HD12 ILE 38 5.755 -15.169 -16.508 299 3HD1 ILE 38 HD13 ILE 38 6.735 -15.481 -15.066 300 HA PRO 39 HA PRO 39 0.194 -11.559 -14.253 301 1HB PRO 39 HB2 PRO 39 -1.814 -12.392 -12.589 302 2HB PRO 39 HB3 PRO 39 -1.851 -12.630 -14.364 303 1HG PRO 39 HG2 PRO 39 -1.006 -14.622 -12.241 304 2HG PRO 39 HG3 PRO 39 -2.123 -14.880 -13.619 305 1HD PRO 39 HD2 PRO 39 0.507 -15.595 -13.724 306 2HD PRO 39 HD3 PRO 39 -0.341 -14.959 -15.166 307 H ILE 40 H ILE 40 0.158 -10.128 -12.512 308 HA ILE 40 HA ILE 40 1.318 -10.980 -9.906 309 HB ILE 40 HB ILE 40 1.792 -8.409 -11.456 310 1HG1 ILE 40 HG12 ILE 40 3.107 -10.251 -12.444 311 2HG1 ILE 40 HG13 ILE 40 4.066 -8.951 -11.779 312 1HG2 ILE 40 HG21 ILE 40 2.752 -9.264 -8.703 313 2HG2 ILE 40 HG22 ILE 40 3.440 -7.906 -9.614 314 3HG2 ILE 40 HG23 ILE 40 1.747 -7.867 -9.128 315 1HD1 ILE 40 HD11 ILE 40 4.638 -10.297 -9.807 316 2HD1 ILE 40 HD12 ILE 40 3.587 -11.620 -10.381 317 3HD1 ILE 40 HD13 ILE 40 5.036 -11.154 -11.294 318 H VAL 41 H VAL 41 0.066 -10.270 -8.211 319 HA VAL 41 HA VAL 41 -2.408 -8.757 -8.874 320 HB VAL 41 HB VAL 41 -3.502 -10.310 -7.188 321 1HG1 VAL 41 HG11 VAL 41 -3.789 -12.203 -8.765 322 2HG1 VAL 41 HG12 VAL 41 -4.003 -10.628 -9.504 323 3HG1 VAL 41 HG13 VAL 41 -2.493 -11.535 -9.785 324 1HG2 VAL 41 HG21 VAL 41 -1.096 -12.112 -7.673 325 2HG2 VAL 41 HG22 VAL 41 -1.408 -11.222 -6.160 326 3HG2 VAL 41 HG23 VAL 41 -2.539 -12.466 -6.709 327 H ALA 42 H ALA 42 -3.472 -7.818 -7.050 328 HA ALA 42 HA ALA 42 -1.825 -6.376 -5.191 329 1HB ALA 42 HB1 ALA 42 -4.043 -5.772 -4.238 330 2HB ALA 42 HB2 ALA 42 -4.058 -5.621 -6.005 331 3HB ALA 42 HB3 ALA 42 -4.807 -7.023 -5.237 332 H ASP 43 H ASP 43 -0.722 -7.468 -3.589 333 HA ASP 43 HA ASP 43 -1.500 -10.010 -2.513 334 1HB ASP 43 HB2 ASP 43 0.816 -9.174 -2.488 335 2HB ASP 43 HB3 ASP 43 0.344 -7.858 -1.405 336 H ARG 44 H ARG 44 -2.584 -6.781 -1.832 337 HA ARG 44 HA ARG 44 -4.518 -7.746 0.101 338 1HB ARG 44 HB2 ARG 44 -3.958 -5.970 1.759 339 2HB ARG 44 HB3 ARG 44 -2.752 -7.244 1.687 340 1HG ARG 44 HG2 ARG 44 -1.133 -5.898 0.654 341 2HG ARG 44 HG3 ARG 44 -2.308 -4.745 0.019 342 1HD ARG 44 HD2 ARG 44 -1.686 -5.058 2.970 343 2HD ARG 44 HD3 ARG 44 -0.948 -3.848 1.896 344 HE ARG 44 HE ARG 44 -3.610 -3.469 1.436 345 1HH1 ARG 44 HH21 ARG 44 -1.770 -3.449 4.476 346 2HH1 ARG 44 HH22 ARG 44 -2.941 -2.502 5.317 347 1HH2 ARG 44 HH11 ARG 44 -5.099 -2.287 2.472 348 2HH2 ARG 44 HH12 ARG 44 -4.860 -1.686 4.096 349 H SER 45 H SER 45 -6.203 -6.058 0.427 350 HA SER 45 HA SER 45 -6.684 -4.431 -1.886 351 1HB SER 45 HB2 SER 45 -8.004 -4.342 0.855 352 2HB SER 45 HB3 SER 45 -8.724 -3.865 -0.694 353 HG SER 45 HG SER 45 -9.318 -6.006 0.114 354 H GLY 46 H GLY 46 -6.928 -2.040 -1.887 355 1HA GLY 46 HA2 GLY 46 -6.424 -0.315 0.198 356 2HA GLY 46 HA3 GLY 46 -4.815 -0.672 -0.446 357 H ILE 47 H ILE 47 -5.107 1.770 -0.708 358 HA ILE 47 HA ILE 47 -6.083 2.382 -3.459 359 HB ILE 47 HB ILE 47 -5.487 4.225 -1.104 360 1HG1 ILE 47 HG12 ILE 47 -7.660 3.176 -0.818 361 2HG1 ILE 47 HG13 ILE 47 -7.843 4.878 -1.198 362 1HG2 ILE 47 HG21 ILE 47 -6.298 6.070 -2.601 363 2HG2 ILE 47 HG22 ILE 47 -4.761 5.367 -3.099 364 3HG2 ILE 47 HG23 ILE 47 -6.244 4.936 -3.968 365 1HD1 ILE 47 HD11 ILE 47 -8.404 4.271 -3.573 366 2HD1 ILE 47 HD12 ILE 47 -8.283 2.554 -3.117 367 3HD1 ILE 47 HD13 ILE 47 -9.523 3.580 -2.384 368 H VAL 48 H VAL 48 -4.527 2.874 -4.907 369 HA VAL 48 HA VAL 48 -1.748 2.240 -4.349 370 HB VAL 48 HB VAL 48 -3.087 3.483 -6.766 371 1HG1 VAL 48 HG11 VAL 48 -0.634 3.793 -6.799 372 2HG1 VAL 48 HG12 VAL 48 -0.385 2.075 -6.441 373 3HG1 VAL 48 HG13 VAL 48 -1.105 2.575 -7.985 374 1HG2 VAL 48 HG21 VAL 48 -3.053 1.193 -7.711 375 2HG2 VAL 48 HG22 VAL 48 -2.500 0.554 -6.149 376 3HG2 VAL 48 HG23 VAL 48 -4.101 1.299 -6.312 377 H LYS 49 H LYS 49 -0.434 3.682 -3.282 378 HA LYS 49 HA LYS 49 -1.052 6.564 -3.280 379 1HB LYS 49 HB2 LYS 49 -0.144 5.533 -1.225 380 2HB LYS 49 HB3 LYS 49 1.278 4.978 -2.099 381 1HG LYS 49 HG2 LYS 49 1.787 6.946 -0.775 382 2HG LYS 49 HG3 LYS 49 2.007 7.283 -2.482 383 1HD LYS 49 HD2 LYS 49 0.992 9.179 -1.336 384 2HD LYS 49 HD3 LYS 49 -0.141 8.527 -2.524 385 1HE LYS 49 HE2 LYS 49 -1.323 7.294 -0.714 386 2HE LYS 49 HE3 LYS 49 -0.160 7.905 0.468 387 1HZ LYS 49 HZ1 LYS 49 -2.197 9.205 0.468 388 2HZ LYS 49 HZ2 LYS 49 -0.960 10.150 -0.011 389 3HZ LYS 49 HZ3 LYS 49 -2.033 9.584 -1.108 390 H GLU 50 H GLU 50 1.416 4.231 -4.591 391 HA GLU 50 HA GLU 50 1.890 6.040 -6.844 392 1HB GLU 50 HB2 GLU 50 3.304 6.948 -4.952 393 2HB GLU 50 HB3 GLU 50 4.153 5.402 -4.883 394 1HG GLU 50 HG2 GLU 50 5.059 5.733 -7.106 395 2HG GLU 50 HG3 GLU 50 3.990 7.110 -7.403 396 H VAL 51 H VAL 51 3.213 4.974 -8.497 397 HA VAL 51 HA VAL 51 3.475 2.022 -8.167 398 HB VAL 51 HB VAL 51 2.944 3.551 -10.750 399 1HG1 VAL 51 HG11 VAL 51 2.852 0.565 -10.094 400 2HG1 VAL 51 HG12 VAL 51 2.437 1.306 -11.655 401 3HG1 VAL 51 HG13 VAL 51 4.099 1.380 -11.063 402 1HG2 VAL 51 HG21 VAL 51 0.984 1.962 -9.037 403 2HG2 VAL 51 HG22 VAL 51 0.920 3.712 -9.353 404 3HG2 VAL 51 HG23 VAL 51 0.665 2.579 -10.676 405 H LYS 52 H LYS 52 5.519 1.291 -8.444 406 HA LYS 52 HA LYS 52 7.611 3.389 -8.576 407 1HB LYS 52 HB2 LYS 52 7.705 0.488 -7.647 408 2HB LYS 52 HB3 LYS 52 9.000 1.669 -7.459 409 1HG LYS 52 HG2 LYS 52 6.273 1.753 -6.098 410 2HG LYS 52 HG3 LYS 52 7.814 1.309 -5.371 411 1HD LYS 52 HD2 LYS 52 8.679 3.598 -5.727 412 2HD LYS 52 HD3 LYS 52 7.109 4.082 -6.423 413 1HE LYS 52 HE2 LYS 52 5.955 3.537 -4.361 414 2HE LYS 52 HE3 LYS 52 7.432 2.879 -3.640 415 1HZ LYS 52 HZ1 LYS 52 8.360 5.079 -3.600 416 2HZ LYS 52 HZ2 LYS 52 7.086 5.722 -4.418 417 3HZ LYS 52 HZ3 LYS 52 6.869 5.131 -2.900 418 H LYS 53 H LYS 53 6.251 1.321 -10.847 419 HA LYS 53 HA LYS 53 8.802 1.055 -12.350 420 1HB LYS 53 HB2 LYS 53 6.759 -1.129 -11.738 421 2HB LYS 53 HB3 LYS 53 7.987 -1.263 -12.994 422 1HG LYS 53 HG2 LYS 53 8.709 -0.850 -10.075 423 2HG LYS 53 HG3 LYS 53 8.515 -2.437 -10.832 424 1HD LYS 53 HD2 LYS 53 10.216 -1.858 -12.528 425 2HD LYS 53 HD3 LYS 53 10.476 -0.284 -11.744 426 1HE LYS 53 HE2 LYS 53 11.317 -1.350 -9.730 427 2HE LYS 53 HE3 LYS 53 10.861 -2.944 -10.301 428 1HZ LYS 53 HZ1 LYS 53 12.442 -2.592 -12.185 429 2HZ LYS 53 HZ2 LYS 53 12.969 -1.221 -11.451 430 3HZ LYS 53 HZ3 LYS 53 13.121 -2.695 -10.699 431 H LYS 54 H LYS 54 8.061 0.040 -14.640 432 HA LYS 54 HA LYS 54 5.618 1.307 -15.612 433 1HB LYS 54 HB2 LYS 54 6.749 2.559 -17.373 434 2HB LYS 54 HB3 LYS 54 7.239 3.148 -15.787 435 1HG LYS 54 HG2 LYS 54 9.365 1.849 -15.960 436 2HG LYS 54 HG3 LYS 54 8.892 1.290 -17.570 437 1HD LYS 54 HD2 LYS 54 9.317 4.202 -16.773 438 2HD LYS 54 HD3 LYS 54 10.505 3.177 -17.592 439 1HE LYS 54 HE2 LYS 54 8.924 2.866 -19.496 440 2HE LYS 54 HE3 LYS 54 7.766 3.941 -18.700 441 1HZ LYS 54 HZ1 LYS 54 10.475 4.730 -19.603 442 2HZ LYS 54 HZ2 LYS 54 9.077 5.119 -20.341 443 3HZ LYS 54 HZ3 LYS 54 9.405 5.723 -18.865 444 H GLU 55 H GLU 55 5.208 0.608 -17.858 445 HA GLU 55 HA GLU 55 5.498 -2.204 -18.017 446 1HB GLU 55 HB2 GLU 55 4.680 -0.268 -20.228 447 2HB GLU 55 HB3 GLU 55 4.350 -2.008 -20.153 448 1HG GLU 55 HG2 GLU 55 3.111 -1.571 -17.975 449 2HG GLU 55 HG3 GLU 55 3.255 0.154 -18.298 450 H GLY 56 H GLY 56 7.006 -3.458 -18.915 451 1HA GLY 56 HA2 GLY 56 8.629 -4.174 -20.379 452 2HA GLY 56 HA3 GLY 56 8.802 -2.543 -21.037 453 H ASP 57 H ASP 57 9.014 -2.098 -17.688 454 HA ASP 57 HA ASP 57 11.889 -1.763 -17.850 455 1HB ASP 57 HB2 ASP 57 10.392 -0.309 -16.482 456 2HB ASP 57 HB3 ASP 57 10.115 -1.669 -15.385 457 H PHE 58 H PHE 58 13.420 -2.779 -16.373 458 HA PHE 58 HA PHE 58 13.171 -5.691 -16.190 459 1HB PHE 58 HB2 PHE 58 15.326 -4.573 -16.658 460 2HB PHE 58 HB3 PHE 58 15.213 -3.696 -15.140 461 HD1 PHE 58 HD1 PHE 58 15.814 -4.740 -13.021 462 HD2 PHE 58 HD2 PHE 58 15.778 -7.035 -16.675 463 HE1 PHE 58 HE1 PHE 58 17.096 -6.548 -11.905 464 HE2 PHE 58 HE2 PHE 58 17.045 -8.845 -15.551 465 HZ PHE 58 HZ PHE 58 17.734 -8.592 -13.177 466 H VAL 59 H VAL 59 12.886 -6.876 -14.256 467 HA VAL 59 HA VAL 59 12.456 -5.446 -11.735 468 HB VAL 59 HB VAL 59 10.345 -6.915 -11.437 469 1HG1 VAL 59 HG11 VAL 59 10.202 -4.414 -13.165 470 2HG1 VAL 59 HG12 VAL 59 8.874 -5.100 -12.216 471 3HG1 VAL 59 HG13 VAL 59 10.304 -4.492 -11.385 472 1HG2 VAL 59 HG21 VAL 59 10.461 -8.148 -13.581 473 2HG2 VAL 59 HG22 VAL 59 8.940 -7.242 -13.403 474 3HG2 VAL 59 HG23 VAL 59 10.212 -6.622 -14.462 475 H ASN 60 H ASN 60 12.282 -6.999 -9.906 476 HA ASN 60 HA ASN 60 13.627 -9.534 -10.424 477 1HB ASN 60 HB2 ASN 60 15.199 -7.294 -9.984 478 2HB ASN 60 HB3 ASN 60 15.009 -7.939 -8.352 479 1HD2 ASN 60 HD22 ASN 60 15.668 -8.978 -11.749 480 2HD2 ASN 60 HD21 ASN 60 16.824 -10.222 -11.322 481 H GLU 61 H GLU 61 14.098 -10.694 -8.333 482 HA GLU 61 HA GLU 61 11.659 -11.041 -6.885 483 1HB GLU 61 HB2 GLU 61 13.225 -12.844 -7.287 484 2HB GLU 61 HB3 GLU 61 14.524 -11.989 -6.465 485 1HG GLU 61 HG2 GLU 61 13.203 -12.133 -4.320 486 2HG GLU 61 HG3 GLU 61 11.943 -13.013 -5.182 487 H GLY 62 H GLY 62 10.854 -9.548 -5.545 488 1HA GLY 62 HA2 GLY 62 10.725 -8.424 -3.531 489 2HA GLY 62 HA3 GLY 62 12.485 -8.452 -3.355 490 H ASP 63 H ASP 63 11.627 -7.412 -6.562 491 HA ASP 63 HA ASP 63 12.487 -4.695 -5.924 492 1HB ASP 63 HB2 ASP 63 13.201 -6.091 -7.936 493 2HB ASP 63 HB3 ASP 63 11.573 -5.858 -8.581 494 H VAL 64 H VAL 64 11.053 -3.057 -5.533 495 HA VAL 64 HA VAL 64 8.357 -3.724 -5.013 496 HB VAL 64 HB VAL 64 9.544 -0.930 -5.211 497 1HG1 VAL 64 HG11 VAL 64 7.176 -2.074 -3.655 498 2HG1 VAL 64 HG12 VAL 64 7.810 -0.423 -3.471 499 3HG1 VAL 64 HG13 VAL 64 7.088 -0.923 -4.999 500 1HG2 VAL 64 HG21 VAL 64 10.961 -2.248 -3.688 501 2HG2 VAL 64 HG22 VAL 64 9.948 -1.155 -2.751 502 3HG2 VAL 64 HG23 VAL 64 9.521 -2.875 -2.855 503 H LEU 65 H LEU 65 6.457 -3.262 -6.025 504 HA LEU 65 HA LEU 65 6.571 -2.350 -8.864 505 1HB LEU 65 HB2 LEU 65 5.759 -4.627 -8.645 506 2HB LEU 65 HB3 LEU 65 4.640 -4.166 -7.367 507 HG LEU 65 HG LEU 65 3.341 -2.776 -8.964 508 1HD1 LEU 65 HD11 LEU 65 5.012 -2.115 -10.578 509 2HD1 LEU 65 HD12 LEU 65 5.330 -3.810 -11.013 510 3HD1 LEU 65 HD13 LEU 65 3.771 -3.043 -11.412 511 1HD2 LEU 65 HD21 LEU 65 2.713 -5.121 -8.585 512 2HD2 LEU 65 HD22 LEU 65 2.383 -4.618 -10.252 513 3HD2 LEU 65 HD23 LEU 65 3.788 -5.628 -9.905 514 H LEU 66 H LEU 66 4.711 -2.092 -5.724 515 HA LEU 66 HA LEU 66 4.132 0.683 -6.410 516 1HB LEU 66 HB2 LEU 66 1.773 0.600 -6.366 517 2HB LEU 66 HB3 LEU 66 2.309 -0.447 -7.655 518 HG LEU 66 HG LEU 66 1.558 -1.578 -4.915 519 1HD1 LEU 66 HD11 LEU 66 -0.338 -0.955 -7.208 520 2HD1 LEU 66 HD12 LEU 66 -0.721 -1.903 -5.758 521 3HD1 LEU 66 HD13 LEU 66 -0.310 -0.188 -5.608 522 1HD2 LEU 66 HD21 LEU 66 0.939 -3.559 -6.258 523 2HD2 LEU 66 HD22 LEU 66 1.416 -2.713 -7.743 524 3HD2 LEU 66 HD23 LEU 66 2.635 -3.135 -6.519 525 H GLU 67 H GLU 67 2.931 1.800 -4.736 526 HA GLU 67 HA GLU 67 3.373 0.718 -1.999 527 1HB GLU 67 HB2 GLU 67 5.218 2.159 -2.553 528 2HB GLU 67 HB3 GLU 67 4.139 3.405 -3.200 529 1HG GLU 67 HG2 GLU 67 3.322 3.972 -1.033 530 2HG GLU 67 HG3 GLU 67 4.039 2.534 -0.295 531 H LEU 68 H LEU 68 1.745 1.461 -0.508 532 HA LEU 68 HA LEU 68 -0.756 2.363 -1.875 533 1HB LEU 68 HB2 LEU 68 -0.473 0.347 0.383 534 2HB LEU 68 HB3 LEU 68 -1.966 0.843 -0.397 535 HG LEU 68 HG LEU 68 0.280 -0.754 -1.702 536 1HD1 LEU 68 HD11 LEU 68 -1.271 -2.619 -1.664 537 2HD1 LEU 68 HD12 LEU 68 -1.091 -1.995 -0.016 538 3HD1 LEU 68 HD13 LEU 68 -2.546 -1.606 -0.953 539 1HD2 LEU 68 HD21 LEU 68 -1.278 -1.057 -3.580 540 2HD2 LEU 68 HD22 LEU 68 -2.391 0.127 -2.861 541 3HD2 LEU 68 HD23 LEU 68 -0.757 0.609 -3.397 542 H SER 69 H SER 69 -2.212 3.589 -0.623 543 HA SER 69 HA SER 69 -1.065 5.491 1.081 544 1HB SER 69 HB2 SER 69 -3.969 4.634 0.826 545 2HB SER 69 HB3 SER 69 -3.385 6.202 1.436 546 HG SER 69 HG SER 69 -3.955 6.314 -0.775 547 H ASN 70 H ASN 70 -2.583 2.379 1.883 548 HA ASN 70 HA ASN 70 -2.756 2.780 4.721 549 1HB ASN 70 HB2 ASN 70 -3.810 0.946 3.165 550 2HB ASN 70 HB3 ASN 70 -2.286 0.090 3.396 551 1HD2 ASN 70 HD22 ASN 70 -1.774 0.480 6.180 552 2HD2 ASN 70 HD21 ASN 70 -3.101 -0.213 7.083 553 H SER 71 H SER 71 -0.023 2.113 2.569 554 HA SER 71 HA SER 71 1.688 1.099 4.714 555 1HB SER 71 HB2 SER 71 2.511 1.957 1.919 556 2HB SER 71 HB3 SER 71 3.293 0.795 2.998 557 HG SER 71 HG SER 71 1.190 -0.392 2.808 558 H THR 72 H THR 72 1.260 4.165 2.786 559 HA THR 72 HA THR 72 3.543 5.379 4.083 560 HB THR 72 HB THR 72 2.756 7.397 2.775 561 HG1 THR 72 HG1 THR 72 0.590 7.007 2.534 562 1HG2 THR 72 HG21 THR 72 2.991 4.831 1.149 563 2HG2 THR 72 HG22 THR 72 3.451 6.477 0.652 564 3HG2 THR 72 HG23 THR 72 4.369 5.656 1.915 565 H GLN 73 H GLN 73 0.019 5.589 4.512 566 HA GLN 73 HA GLN 73 -1.314 6.822 5.830 567 1HB GLN 73 HB2 GLN 73 0.727 5.918 7.894 568 2HB GLN 73 HB3 GLN 73 -0.878 6.568 8.269 569 1HG GLN 73 HG2 GLN 73 -1.973 4.717 7.114 570 2HG GLN 73 HG3 GLN 73 -0.421 4.121 6.536 571 1HE2 GLN 73 HE22 GLN 73 -0.323 2.135 7.484 572 2HE2 GLN 73 HE21 GLN 73 -0.330 1.859 9.222 Start of MODEL 7 1 1H THR 2 H1 THR 2 5.906 -3.039 -0.531 2 2H THR 2 H2 THR 2 5.657 -2.646 1.034 3 3H THR 2 H3 THR 2 5.423 -4.196 0.539 4 HA THR 2 HA THR 2 3.339 -3.016 0.876 5 HB THR 2 HB THR 2 2.834 -1.342 -1.074 6 HG1 THR 2 HG1 THR 2 4.539 -0.950 -2.242 7 1HG2 THR 2 HG21 THR 2 2.860 -0.720 1.321 8 2HG2 THR 2 HG22 THR 2 4.625 -0.500 1.245 9 3HG2 THR 2 HG23 THR 2 3.554 0.545 0.300 10 H VAL 3 H VAL 3 4.034 -2.994 -2.704 11 HA VAL 3 HA VAL 3 3.094 -5.791 -2.841 12 HB VAL 3 HB VAL 3 2.038 -3.534 -4.590 13 1HG1 VAL 3 HG11 VAL 3 0.561 -5.301 -5.542 14 2HG1 VAL 3 HG12 VAL 3 2.262 -5.661 -5.820 15 3HG1 VAL 3 HG13 VAL 3 1.387 -6.518 -4.536 16 1HG2 VAL 3 HG21 VAL 3 0.572 -5.131 -2.452 17 2HG2 VAL 3 HG22 VAL 3 0.896 -3.384 -2.456 18 3HG2 VAL 3 HG23 VAL 3 -0.207 -4.066 -3.648 19 H SER 4 H SER 4 4.517 -6.886 -4.112 20 HA SER 4 HA SER 4 6.488 -5.403 -5.770 21 1HB SER 4 HB2 SER 4 7.091 -7.456 -3.606 22 2HB SER 4 HB3 SER 4 8.274 -6.600 -4.599 23 HG SER 4 HG SER 4 7.985 -5.685 -2.489 24 H ILE 5 H ILE 5 7.642 -6.678 -7.229 25 HA ILE 5 HA ILE 5 6.240 -8.973 -8.374 26 HB ILE 5 HB ILE 5 8.992 -7.766 -8.989 27 1HG1 ILE 5 HG12 ILE 5 7.590 -7.094 -11.166 28 2HG1 ILE 5 HG13 ILE 5 6.218 -7.163 -10.076 29 1HG2 ILE 5 HG21 ILE 5 7.266 -9.679 -10.626 30 2HG2 ILE 5 HG22 ILE 5 8.829 -8.994 -11.117 31 3HG2 ILE 5 HG23 ILE 5 8.766 -10.104 -9.768 32 1HD1 ILE 5 HD11 ILE 5 8.711 -5.425 -9.718 33 2HD1 ILE 5 HD12 ILE 5 7.154 -4.889 -10.384 34 3HD1 ILE 5 HD13 ILE 5 7.265 -5.377 -8.693 35 H GLN 6 H GLN 6 7.080 -11.165 -8.221 36 HA GLN 6 HA GLN 6 8.903 -11.607 -5.910 37 1HB GLN 6 HB2 GLN 6 7.461 -13.203 -4.968 38 2HB GLN 6 HB3 GLN 6 6.606 -11.693 -5.148 39 1HG GLN 6 HG2 GLN 6 6.263 -14.153 -6.920 40 2HG GLN 6 HG3 GLN 6 5.235 -13.703 -5.568 41 1HE2 GLN 6 HE22 GLN 6 5.014 -10.768 -6.210 42 2HE2 GLN 6 HE21 GLN 6 3.995 -10.751 -7.622 43 H MET 7 H MET 7 9.435 -11.693 -8.797 44 HA MET 7 HA MET 7 11.015 -14.091 -8.794 45 1HB MET 7 HB2 MET 7 10.232 -14.963 -10.925 46 2HB MET 7 HB3 MET 7 8.914 -15.008 -9.764 47 1HG MET 7 HG2 MET 7 9.278 -12.850 -11.879 48 2HG MET 7 HG3 MET 7 8.304 -14.291 -12.097 49 1HE MET 7 HE1 MET 7 6.024 -14.800 -10.612 50 2HE MET 7 HE2 MET 7 4.927 -13.413 -10.829 51 3HE MET 7 HE3 MET 7 5.886 -13.996 -12.196 52 H ALA 8 H ALA 8 12.530 -13.938 -10.761 53 HA ALA 8 HA ALA 8 13.177 -11.120 -11.373 54 1HB ALA 8 HB1 ALA 8 14.982 -12.677 -10.746 55 2HB ALA 8 HB2 ALA 8 14.561 -13.720 -12.131 56 3HB ALA 8 HB3 ALA 8 15.179 -12.077 -12.412 57 H GLY 9 H GLY 9 12.934 -10.155 -13.415 58 1HA GLY 9 HA2 GLY 9 12.676 -11.537 -15.841 59 2HA GLY 9 HA3 GLY 9 11.039 -11.341 -15.220 60 H ASN 10 H ASN 10 10.444 -9.941 -16.923 61 HA ASN 10 HA ASN 10 11.393 -7.131 -16.612 62 1HB ASN 10 HB2 ASN 10 11.253 -8.766 -19.158 63 2HB ASN 10 HB3 ASN 10 10.768 -7.075 -19.193 64 1HD2 ASN 10 HD22 ASN 10 13.459 -8.153 -17.039 65 2HD2 ASN 10 HD21 ASN 10 14.698 -7.404 -18.021 66 H LEU 11 H LEU 11 9.676 -5.738 -16.529 67 HA LEU 11 HA LEU 11 7.159 -6.978 -15.857 68 1HB LEU 11 HB2 LEU 11 8.388 -4.949 -14.789 69 2HB LEU 11 HB3 LEU 11 7.785 -4.007 -16.136 70 HG LEU 11 HG LEU 11 6.414 -3.717 -14.165 71 1HD1 LEU 11 HD11 LEU 11 5.255 -3.671 -16.347 72 2HD1 LEU 11 HD12 LEU 11 4.863 -5.399 -16.160 73 3HD1 LEU 11 HD13 LEU 11 4.214 -4.269 -15.028 74 1HD2 LEU 11 HD21 LEU 11 5.176 -5.462 -13.063 75 2HD2 LEU 11 HD22 LEU 11 5.730 -6.690 -14.210 76 3HD2 LEU 11 HD23 LEU 11 6.880 -5.929 -13.088 77 H TRP 12 H TRP 12 5.572 -7.451 -17.333 78 HA TRP 12 HA TRP 12 5.947 -6.741 -20.118 79 1HB TRP 12 HB2 TRP 12 5.038 -8.940 -19.187 80 2HB TRP 12 HB3 TRP 12 3.548 -8.086 -18.825 81 HD1 TRP 12 HD1 TRP 12 5.808 -8.869 -21.820 82 HE1 TRP 12 HE1 TRP 12 4.419 -9.153 -23.942 83 HE3 TRP 12 HE3 TRP 12 1.195 -7.826 -19.882 84 HZ2 TRP 12 HZ2 TRP 12 1.631 -8.894 -24.722 85 HZ3 TRP 12 HZ3 TRP 12 -0.816 -7.884 -21.324 86 HH2 TRP 12 HH2 TRP 12 -0.610 -8.396 -23.748 87 H LYS 13 H LYS 13 3.227 -6.146 -17.774 88 HA LYS 13 HA LYS 13 2.866 -3.433 -18.813 89 1HB LYS 13 HB2 LYS 13 0.785 -5.642 -19.133 90 2HB LYS 13 HB3 LYS 13 0.327 -3.950 -19.011 91 1HG LYS 13 HG2 LYS 13 1.913 -3.459 -20.932 92 2HG LYS 13 HG3 LYS 13 2.057 -5.207 -21.169 93 1HD LYS 13 HD2 LYS 13 -0.375 -5.369 -21.535 94 2HD LYS 13 HD3 LYS 13 -0.563 -3.633 -21.273 95 1HE LYS 13 HE2 LYS 13 1.251 -4.817 -23.422 96 2HE LYS 13 HE3 LYS 13 -0.452 -4.450 -23.709 97 1HZ LYS 13 HZ1 LYS 13 1.017 -2.646 -24.398 98 2HZ LYS 13 HZ2 LYS 13 -0.018 -2.144 -23.249 99 3HZ LYS 13 HZ3 LYS 13 1.553 -2.410 -22.870 100 H VAL 14 H VAL 14 1.389 -2.178 -17.477 101 HA VAL 14 HA VAL 14 0.880 -3.273 -14.761 102 HB VAL 14 HB VAL 14 1.864 -0.458 -15.452 103 1HG1 VAL 14 HG11 VAL 14 1.212 -1.785 -12.779 104 2HG1 VAL 14 HG12 VAL 14 2.116 -0.272 -12.950 105 3HG1 VAL 14 HG13 VAL 14 0.439 -0.337 -13.491 106 1HG2 VAL 14 HG21 VAL 14 3.714 -2.057 -15.595 107 2HG2 VAL 14 HG22 VAL 14 3.893 -1.051 -14.163 108 3HG2 VAL 14 HG23 VAL 14 3.265 -2.705 -13.972 109 H HIS 15 H HIS 15 -1.093 -2.561 -13.902 110 HA HIS 15 HA HIS 15 -2.942 -1.229 -15.841 111 1HB HIS 15 HB2 HIS 15 -3.755 -3.270 -13.775 112 2HB HIS 15 HB3 HIS 15 -4.605 -2.782 -15.238 113 HD1 HIS 15 HD1 HIS 15 -2.368 -3.378 -17.437 114 HD2 HIS 15 HD2 HIS 15 -3.121 -5.732 -14.034 115 HE1 HIS 15 HE1 HIS 15 -1.291 -5.654 -17.874 116 H VAL 16 H VAL 16 -1.702 -1.199 -12.556 117 HA VAL 16 HA VAL 16 -3.820 0.440 -11.441 118 HB VAL 16 HB VAL 16 -2.084 0.871 -9.650 119 1HG1 VAL 16 HG11 VAL 16 -2.851 -1.988 -10.321 120 2HG1 VAL 16 HG12 VAL 16 -2.276 -1.431 -8.730 121 3HG1 VAL 16 HG13 VAL 16 -3.803 -0.820 -9.389 122 1HG2 VAL 16 HG21 VAL 16 -0.467 -1.334 -10.975 123 2HG2 VAL 16 HG22 VAL 16 -0.051 0.398 -11.060 124 3HG2 VAL 16 HG23 VAL 16 -0.104 -0.424 -9.497 125 H LYS 17 H LYS 17 -3.456 2.601 -10.606 126 HA LYS 17 HA LYS 17 -1.406 4.267 -11.762 127 1HB LYS 17 HB2 LYS 17 -2.982 5.987 -12.592 128 2HB LYS 17 HB3 LYS 17 -3.063 4.496 -13.526 129 1HG LYS 17 HG2 LYS 17 -5.154 3.849 -12.330 130 2HG LYS 17 HG3 LYS 17 -5.045 5.310 -11.347 131 1HD LYS 17 HD2 LYS 17 -6.670 5.661 -13.105 132 2HD LYS 17 HD3 LYS 17 -5.286 6.718 -13.346 133 1HE LYS 17 HE2 LYS 17 -5.969 5.871 -15.486 134 2HE LYS 17 HE3 LYS 17 -4.402 5.169 -15.094 135 1HZ LYS 17 HZ1 LYS 17 -5.944 3.537 -15.999 136 2HZ LYS 17 HZ2 LYS 17 -5.557 3.114 -14.475 137 3HZ LYS 17 HZ3 LYS 17 -7.015 3.791 -14.802 138 H ALA 18 H ALA 18 -1.443 6.398 -10.519 139 HA ALA 18 HA ALA 18 -1.818 5.994 -7.738 140 1HB ALA 18 HB1 ALA 18 -0.293 7.700 -8.654 141 2HB ALA 18 HB2 ALA 18 -1.681 8.612 -9.300 142 3HB ALA 18 HB3 ALA 18 -1.471 8.427 -7.546 143 H GLY 19 H GLY 19 -3.527 6.267 -6.388 144 1HA GLY 19 HA2 GLY 19 -5.570 6.946 -5.610 145 2HA GLY 19 HA3 GLY 19 -5.910 7.771 -7.136 146 H ASP 20 H ASP 20 -4.980 4.645 -8.044 147 HA ASP 20 HA ASP 20 -7.697 3.770 -8.524 148 1HB ASP 20 HB2 ASP 20 -5.683 3.205 -9.961 149 2HB ASP 20 HB3 ASP 20 -5.129 2.150 -8.662 150 H GLN 21 H GLN 21 -8.420 1.570 -7.736 151 HA GLN 21 HA GLN 21 -7.799 1.149 -4.837 152 1HB GLN 21 HB2 GLN 21 -10.124 1.879 -5.198 153 2HB GLN 21 HB3 GLN 21 -10.322 0.701 -6.489 154 1HG GLN 21 HG2 GLN 21 -11.486 -0.190 -4.668 155 2HG GLN 21 HG3 GLN 21 -10.035 -1.155 -4.775 156 1HE2 GLN 21 HE22 GLN 21 -8.904 -1.449 -2.781 157 2HE2 GLN 21 HE21 GLN 21 -9.177 -0.432 -1.389 158 H ILE 22 H ILE 22 -7.077 -0.873 -4.311 159 HA ILE 22 HA ILE 22 -7.423 -3.054 -6.280 160 HB ILE 22 HB ILE 22 -5.244 -3.883 -6.009 161 1HG1 ILE 22 HG12 ILE 22 -4.838 -1.812 -3.821 162 2HG1 ILE 22 HG13 ILE 22 -4.863 -3.573 -3.661 163 1HG2 ILE 22 HG21 ILE 22 -4.883 -0.881 -6.354 164 2HG2 ILE 22 HG22 ILE 22 -3.865 -2.167 -7.013 165 3HG2 ILE 22 HG23 ILE 22 -5.510 -1.971 -7.607 166 1HD1 ILE 22 HD11 ILE 22 -2.594 -2.895 -3.540 167 2HD1 ILE 22 HD12 ILE 22 -2.789 -3.626 -5.146 168 3HD1 ILE 22 HD13 ILE 22 -2.758 -1.858 -4.969 169 H GLU 23 H GLU 23 -7.305 -5.190 -5.266 170 HA GLU 23 HA GLU 23 -8.121 -5.302 -2.443 171 1HB GLU 23 HB2 GLU 23 -10.144 -5.061 -3.856 172 2HB GLU 23 HB3 GLU 23 -9.627 -6.452 -4.819 173 1HG GLU 23 HG2 GLU 23 -11.207 -7.383 -3.412 174 2HG GLU 23 HG3 GLU 23 -9.724 -7.776 -2.562 175 H LYS 24 H LYS 24 -7.249 -7.260 -1.536 176 HA LYS 24 HA LYS 24 -5.019 -8.416 -2.622 177 1HB LYS 24 HB2 LYS 24 -5.873 -8.637 -0.277 178 2HB LYS 24 HB3 LYS 24 -7.041 -9.840 -0.838 179 1HG LYS 24 HG2 LYS 24 -5.145 -11.286 -1.608 180 2HG LYS 24 HG3 LYS 24 -4.006 -10.063 -1.032 181 1HD LYS 24 HD2 LYS 24 -5.017 -10.355 1.303 182 2HD LYS 24 HD3 LYS 24 -6.003 -11.657 0.631 183 1HE LYS 24 HE2 LYS 24 -4.224 -12.831 1.557 184 2HE LYS 24 HE3 LYS 24 -3.773 -12.725 -0.146 185 1HZ LYS 24 HZ1 LYS 24 -2.360 -10.771 0.511 186 2HZ LYS 24 HZ2 LYS 24 -2.723 -11.068 2.075 187 3HZ LYS 24 HZ3 LYS 24 -1.898 -12.177 1.216 188 H GLY 25 H GLY 25 -4.595 -9.643 -4.388 189 1HA GLY 25 HA2 GLY 25 -4.814 -11.559 -5.713 190 2HA GLY 25 HA3 GLY 25 -6.510 -11.722 -5.261 191 H GLN 26 H GLN 26 -6.421 -8.499 -6.009 192 HA GLN 26 HA GLN 26 -7.515 -8.754 -8.647 193 1HB GLN 26 HB2 GLN 26 -7.928 -6.908 -6.977 194 2HB GLN 26 HB3 GLN 26 -6.272 -6.328 -7.262 195 1HG GLN 26 HG2 GLN 26 -6.843 -5.869 -9.617 196 2HG GLN 26 HG3 GLN 26 -8.467 -6.522 -9.378 197 1HE2 GLN 26 HE22 GLN 26 -6.731 -3.628 -9.472 198 2HE2 GLN 26 HE21 GLN 26 -7.775 -2.635 -8.468 199 H GLU 27 H GLU 27 -6.429 -8.705 -10.638 200 HA GLU 27 HA GLU 27 -3.537 -8.939 -10.755 201 1HB GLU 27 HB2 GLU 27 -5.130 -10.017 -12.347 202 2HB GLU 27 HB3 GLU 27 -5.629 -8.421 -12.916 203 1HG GLU 27 HG2 GLU 27 -3.260 -8.009 -13.671 204 2HG GLU 27 HG3 GLU 27 -2.843 -9.642 -13.148 205 H VAL 28 H VAL 28 -2.068 -7.291 -10.986 206 HA VAL 28 HA VAL 28 -3.056 -4.527 -11.515 207 HB VAL 28 HB VAL 28 -1.445 -3.763 -9.738 208 1HG1 VAL 28 HG11 VAL 28 -2.996 -4.143 -7.892 209 2HG1 VAL 28 HG12 VAL 28 -3.922 -3.862 -9.378 210 3HG1 VAL 28 HG13 VAL 28 -3.750 -5.503 -8.740 211 1HG2 VAL 28 HG21 VAL 28 -0.135 -5.888 -9.481 212 2HG2 VAL 28 HG22 VAL 28 -0.806 -5.280 -7.951 213 3HG2 VAL 28 HG23 VAL 28 -1.584 -6.635 -8.780 214 H ALA 29 H ALA 29 -0.539 -6.955 -12.049 215 HA ALA 29 HA ALA 29 0.296 -5.393 -14.336 216 1HB ALA 29 HB1 ALA 29 2.305 -6.107 -12.136 217 2HB ALA 29 HB2 ALA 29 2.738 -5.559 -13.757 218 3HB ALA 29 HB3 ALA 29 1.858 -4.477 -12.675 219 H ILE 30 H ILE 30 2.108 -6.779 -15.445 220 HA ILE 30 HA ILE 30 1.756 -9.697 -15.040 221 HB ILE 30 HB ILE 30 1.401 -8.163 -17.652 222 1HG1 ILE 30 HG12 ILE 30 -0.419 -10.210 -16.296 223 2HG1 ILE 30 HG13 ILE 30 -0.630 -8.469 -16.199 224 1HG2 ILE 30 HG21 ILE 30 1.664 -11.198 -17.304 225 2HG2 ILE 30 HG22 ILE 30 1.323 -10.347 -18.828 226 3HG2 ILE 30 HG23 ILE 30 2.881 -10.157 -18.065 227 1HD1 ILE 30 HD11 ILE 30 -2.160 -9.292 -17.825 228 2HD1 ILE 30 HD12 ILE 30 -0.916 -8.353 -18.669 229 3HD1 ILE 30 HD13 ILE 30 -0.890 -10.136 -18.718 230 H LEU 31 H LEU 31 3.659 -10.798 -15.525 231 HA LEU 31 HA LEU 31 6.135 -9.181 -15.969 232 1HB LEU 31 HB2 LEU 31 5.912 -9.755 -13.679 233 2HB LEU 31 HB3 LEU 31 5.390 -11.406 -14.026 234 HG LEU 31 HG LEU 31 7.623 -11.047 -12.993 235 1HD1 LEU 31 HD11 LEU 31 8.755 -12.819 -14.168 236 2HD1 LEU 31 HD12 LEU 31 7.028 -13.178 -14.039 237 3HD1 LEU 31 HD13 LEU 31 7.703 -12.633 -15.582 238 1HD2 LEU 31 HD21 LEU 31 8.209 -9.109 -14.570 239 2HD2 LEU 31 HD22 LEU 31 9.467 -10.264 -14.103 240 3HD2 LEU 31 HD23 LEU 31 8.712 -10.376 -15.706 241 H GLU 32 H GLU 32 7.509 -10.025 -17.521 242 HA GLU 32 HA GLU 32 6.736 -12.582 -18.840 243 1HB GLU 32 HB2 GLU 32 6.630 -10.562 -20.279 244 2HB GLU 32 HB3 GLU 32 8.320 -10.202 -19.899 245 1HG GLU 32 HG2 GLU 32 8.946 -12.446 -20.891 246 2HG GLU 32 HG3 GLU 32 7.255 -12.675 -21.338 247 H SER 33 H SER 33 8.126 -14.234 -18.458 248 HA SER 33 HA SER 33 10.951 -13.976 -18.268 249 1HB SER 33 HB2 SER 33 10.176 -13.125 -15.947 250 2HB SER 33 HB3 SER 33 9.620 -14.773 -15.638 251 HG SER 33 HG SER 33 11.807 -14.122 -14.957 252 H MET 34 H MET 34 11.855 -16.241 -17.727 253 HA MET 34 HA MET 34 11.932 -18.460 -18.235 254 1HB MET 34 HB2 MET 34 9.182 -18.461 -16.930 255 2HB MET 34 HB3 MET 34 10.253 -19.848 -17.089 256 1HG MET 34 HG2 MET 34 11.852 -18.949 -15.577 257 2HG MET 34 HG3 MET 34 11.108 -17.354 -15.572 258 1HE MET 34 HE1 MET 34 8.124 -17.540 -15.090 259 2HE MET 34 HE2 MET 34 8.025 -17.618 -13.320 260 3HE MET 34 HE3 MET 34 9.208 -16.546 -14.093 261 H LYS 35 H LYS 35 10.985 -16.796 -20.386 262 HA LYS 35 HA LYS 35 9.893 -16.714 -22.347 263 1HB LYS 35 HB2 LYS 35 10.168 -19.740 -22.289 264 2HB LYS 35 HB3 LYS 35 9.848 -18.746 -23.714 265 1HG LYS 35 HG2 LYS 35 12.014 -17.551 -23.354 266 2HG LYS 35 HG3 LYS 35 12.387 -18.658 -22.026 267 1HD LYS 35 HD2 LYS 35 11.910 -19.469 -24.927 268 2HD LYS 35 HD3 LYS 35 13.490 -19.284 -24.151 269 1HE LYS 35 HE2 LYS 35 12.894 -21.064 -22.512 270 2HE LYS 35 HE3 LYS 35 11.336 -21.281 -23.320 271 1HZ LYS 35 HZ1 LYS 35 12.950 -22.903 -24.070 272 2HZ LYS 35 HZ2 LYS 35 12.541 -21.943 -25.320 273 3HZ LYS 35 HZ3 LYS 35 13.980 -21.746 -24.571 274 H MET 36 H MET 36 8.192 -16.632 -20.046 275 HA MET 36 HA MET 36 5.598 -17.425 -21.213 276 1HB MET 36 HB2 MET 36 6.674 -18.082 -18.427 277 2HB MET 36 HB3 MET 36 4.954 -18.086 -18.804 278 1HG MET 36 HG2 MET 36 7.010 -19.839 -20.186 279 2HG MET 36 HG3 MET 36 5.972 -20.332 -18.854 280 1HE MET 36 HE1 MET 36 5.269 -22.439 -20.305 281 2HE MET 36 HE2 MET 36 4.580 -22.326 -21.939 282 3HE MET 36 HE3 MET 36 6.271 -21.860 -21.656 283 H GLU 37 H GLU 37 3.860 -16.373 -19.740 284 HA GLU 37 HA GLU 37 4.690 -13.707 -18.727 285 1HB GLU 37 HB2 GLU 37 2.317 -14.452 -20.477 286 2HB GLU 37 HB3 GLU 37 2.366 -12.977 -19.499 287 1HG GLU 37 HG2 GLU 37 4.210 -12.078 -20.728 288 2HG GLU 37 HG3 GLU 37 4.540 -13.620 -21.521 289 H ILE 38 H ILE 38 3.792 -13.272 -16.736 290 HA ILE 38 HA ILE 38 2.047 -15.321 -15.477 291 HB ILE 38 HB ILE 38 4.604 -14.127 -14.295 292 1HG1 ILE 38 HG12 ILE 38 5.202 -16.757 -14.356 293 2HG1 ILE 38 HG13 ILE 38 4.161 -16.731 -15.766 294 1HG2 ILE 38 HG21 ILE 38 4.255 -15.817 -12.510 295 2HG2 ILE 38 HG22 ILE 38 2.918 -14.679 -12.598 296 3HG2 ILE 38 HG23 ILE 38 2.737 -16.315 -13.278 297 1HD1 ILE 38 HD11 ILE 38 6.733 -15.160 -15.283 298 2HD1 ILE 38 HD12 ILE 38 6.468 -16.459 -16.455 299 3HD1 ILE 38 HD13 ILE 38 5.708 -14.881 -16.699 300 HA PRO 39 HA PRO 39 0.184 -11.365 -14.329 301 1HB PRO 39 HB2 PRO 39 -1.731 -12.193 -12.559 302 2HB PRO 39 HB3 PRO 39 -1.858 -12.453 -14.326 303 1HG PRO 39 HG2 PRO 39 -0.896 -14.416 -12.226 304 2HG PRO 39 HG3 PRO 39 -2.080 -14.694 -13.544 305 1HD PRO 39 HD2 PRO 39 0.548 -15.396 -13.773 306 2HD PRO 39 HD3 PRO 39 -0.380 -14.788 -15.177 307 H ILE 40 H ILE 40 0.312 -9.902 -12.606 308 HA ILE 40 HA ILE 40 1.581 -10.809 -10.067 309 HB ILE 40 HB ILE 40 1.983 -8.186 -11.532 310 1HG1 ILE 40 HG12 ILE 40 3.237 -9.932 -12.693 311 2HG1 ILE 40 HG13 ILE 40 4.270 -8.733 -11.941 312 1HG2 ILE 40 HG21 ILE 40 3.729 -7.772 -9.752 313 2HG2 ILE 40 HG22 ILE 40 2.064 -7.795 -9.152 314 3HG2 ILE 40 HG23 ILE 40 3.115 -9.196 -8.893 315 1HD1 ILE 40 HD11 ILE 40 5.130 -11.031 -11.678 316 2HD1 ILE 40 HD12 ILE 40 4.830 -10.271 -10.113 317 3HD1 ILE 40 HD13 ILE 40 3.690 -11.478 -10.752 318 H VAL 41 H VAL 41 0.295 -10.417 -8.405 319 HA VAL 41 HA VAL 41 -2.183 -8.861 -8.855 320 HB VAL 41 HB VAL 41 -3.150 -10.460 -7.142 321 1HG1 VAL 41 HG11 VAL 41 -3.736 -10.691 -9.465 322 2HG1 VAL 41 HG12 VAL 41 -2.248 -11.610 -9.813 323 3HG1 VAL 41 HG13 VAL 41 -3.517 -12.286 -8.761 324 1HG2 VAL 41 HG21 VAL 41 -0.741 -12.199 -7.813 325 2HG2 VAL 41 HG22 VAL 41 -0.986 -11.362 -6.257 326 3HG2 VAL 41 HG23 VAL 41 -2.121 -12.613 -6.784 327 H ALA 42 H ALA 42 -3.160 -7.910 -7.008 328 HA ALA 42 HA ALA 42 -1.448 -6.375 -5.332 329 1HB ALA 42 HB1 ALA 42 -4.406 -7.075 -5.143 330 2HB ALA 42 HB2 ALA 42 -3.606 -5.786 -4.227 331 3HB ALA 42 HB3 ALA 42 -3.717 -5.687 -6.001 332 H ASP 43 H ASP 43 -0.220 -7.258 -3.745 333 HA ASP 43 HA ASP 43 -0.711 -9.766 -2.470 334 1HB ASP 43 HB2 ASP 43 1.519 -8.724 -2.635 335 2HB ASP 43 HB3 ASP 43 0.993 -7.400 -1.591 336 H ARG 44 H ARG 44 -1.956 -6.557 -1.859 337 HA ARG 44 HA ARG 44 -3.726 -7.526 0.216 338 1HB ARG 44 HB2 ARG 44 -3.102 -5.828 1.861 339 2HB ARG 44 HB3 ARG 44 -1.762 -6.941 1.572 340 1HG ARG 44 HG2 ARG 44 -0.781 -5.190 -0.025 341 2HG ARG 44 HG3 ARG 44 -2.028 -4.076 0.547 342 1HD ARG 44 HD2 ARG 44 0.107 -5.425 2.257 343 2HD ARG 44 HD3 ARG 44 0.152 -3.771 1.665 344 HE ARG 44 HE ARG 44 -1.578 -3.118 3.124 345 1HH1 ARG 44 HH21 ARG 44 -0.660 -6.511 3.725 346 2HH1 ARG 44 HH22 ARG 44 -1.473 -6.582 5.244 347 1HH2 ARG 44 HH11 ARG 44 -2.584 -3.203 5.060 348 2HH2 ARG 44 HH12 ARG 44 -2.622 -4.643 6.041 349 H SER 45 H SER 45 -5.468 -5.943 0.566 350 HA SER 45 HA SER 45 -6.114 -4.392 -1.757 351 1HB SER 45 HB2 SER 45 -7.463 -4.276 0.970 352 2HB SER 45 HB3 SER 45 -8.182 -4.030 -0.622 353 HG SER 45 HG SER 45 -8.725 -6.065 -0.157 354 H GLY 46 H GLY 46 -6.544 -2.039 -1.783 355 1HA GLY 46 HA2 GLY 46 -6.251 -0.234 0.247 356 2HA GLY 46 HA3 GLY 46 -4.587 -0.456 -0.304 357 H ILE 47 H ILE 47 -5.185 1.974 -0.611 358 HA ILE 47 HA ILE 47 -6.136 2.438 -3.394 359 HB ILE 47 HB ILE 47 -5.525 4.351 -1.107 360 1HG1 ILE 47 HG12 ILE 47 -7.692 3.235 -0.830 361 2HG1 ILE 47 HG13 ILE 47 -7.867 4.953 -1.135 362 1HG2 ILE 47 HG21 ILE 47 -6.383 6.152 -2.638 363 2HG2 ILE 47 HG22 ILE 47 -4.826 5.476 -3.112 364 3HG2 ILE 47 HG23 ILE 47 -6.294 4.989 -3.980 365 1HD1 ILE 47 HD11 ILE 47 -8.503 4.479 -3.503 366 2HD1 ILE 47 HD12 ILE 47 -8.339 2.737 -3.176 367 3HD1 ILE 47 HD13 ILE 47 -9.571 3.693 -2.336 368 H VAL 48 H VAL 48 -4.639 2.947 -4.916 369 HA VAL 48 HA VAL 48 -1.845 2.365 -4.457 370 HB VAL 48 HB VAL 48 -3.290 3.606 -6.816 371 1HG1 VAL 48 HG11 VAL 48 -1.316 2.792 -8.119 372 2HG1 VAL 48 HG12 VAL 48 -0.879 4.053 -6.966 373 3HG1 VAL 48 HG13 VAL 48 -0.499 2.368 -6.600 374 1HG2 VAL 48 HG21 VAL 48 -4.218 1.420 -6.383 375 2HG2 VAL 48 HG22 VAL 48 -3.112 1.261 -7.736 376 3HG2 VAL 48 HG23 VAL 48 -2.624 0.716 -6.113 377 H LYS 49 H LYS 49 -0.490 3.750 -3.418 378 HA LYS 49 HA LYS 49 -1.029 6.651 -3.328 379 1HB LYS 49 HB2 LYS 49 -0.136 5.615 -1.323 380 2HB LYS 49 HB3 LYS 49 1.221 4.922 -2.219 381 1HG LYS 49 HG2 LYS 49 2.096 7.183 -2.676 382 2HG LYS 49 HG3 LYS 49 0.729 7.899 -1.792 383 1HD LYS 49 HD2 LYS 49 1.445 6.838 0.278 384 2HD LYS 49 HD3 LYS 49 2.659 5.877 -0.582 385 1HE LYS 49 HE2 LYS 49 3.798 8.028 -1.265 386 2HE LYS 49 HE3 LYS 49 2.674 8.900 -0.208 387 1HZ LYS 49 HZ1 LYS 49 4.560 6.776 0.651 388 2HZ LYS 49 HZ2 LYS 49 4.754 8.391 0.922 389 3HZ LYS 49 HZ3 LYS 49 3.519 7.579 1.642 390 H GLU 50 H GLU 50 1.489 4.345 -4.643 391 HA GLU 50 HA GLU 50 1.869 6.157 -6.922 392 1HB GLU 50 HB2 GLU 50 3.240 7.159 -5.054 393 2HB GLU 50 HB3 GLU 50 4.178 5.661 -4.980 394 1HG GLU 50 HG2 GLU 50 4.984 5.993 -7.245 395 2HG GLU 50 HG3 GLU 50 3.868 7.338 -7.508 396 H VAL 51 H VAL 51 2.472 4.992 -8.683 397 HA VAL 51 HA VAL 51 3.035 2.117 -8.410 398 HB VAL 51 HB VAL 51 2.761 3.879 -10.890 399 1HG1 VAL 51 HG11 VAL 51 2.267 1.773 -12.051 400 2HG1 VAL 51 HG12 VAL 51 3.885 1.725 -11.355 401 3HG1 VAL 51 HG13 VAL 51 2.554 0.848 -10.558 402 1HG2 VAL 51 HG21 VAL 51 0.456 2.904 -11.061 403 2HG2 VAL 51 HG22 VAL 51 0.660 2.209 -9.437 404 3HG2 VAL 51 HG23 VAL 51 0.635 3.970 -9.672 405 H LYS 52 H LYS 52 5.075 1.208 -8.928 406 HA LYS 52 HA LYS 52 7.331 3.178 -8.974 407 1HB LYS 52 HB2 LYS 52 7.148 0.445 -7.653 408 2HB LYS 52 HB3 LYS 52 8.523 1.535 -7.565 409 1HG LYS 52 HG2 LYS 52 5.771 2.129 -6.400 410 2HG LYS 52 HG3 LYS 52 7.147 1.472 -5.521 411 1HD LYS 52 HD2 LYS 52 8.439 3.553 -6.047 412 2HD LYS 52 HD3 LYS 52 6.960 4.238 -6.791 413 1HE LYS 52 HE2 LYS 52 5.731 3.974 -4.709 414 2HE LYS 52 HE3 LYS 52 7.083 3.115 -3.963 415 1HZ LYS 52 HZ1 LYS 52 7.094 5.973 -4.738 416 2HZ LYS 52 HZ2 LYS 52 6.966 5.343 -3.218 417 3HZ LYS 52 HZ3 LYS 52 8.366 5.162 -4.063 418 H LYS 53 H LYS 53 5.931 1.278 -11.205 419 HA LYS 53 HA LYS 53 8.480 0.670 -12.523 420 1HB LYS 53 HB2 LYS 53 6.287 -1.414 -12.071 421 2HB LYS 53 HB3 LYS 53 7.607 -1.624 -13.207 422 1HG LYS 53 HG2 LYS 53 7.955 -1.323 -10.207 423 2HG LYS 53 HG3 LYS 53 7.992 -2.835 -11.104 424 1HD LYS 53 HD2 LYS 53 9.952 -2.166 -12.361 425 2HD LYS 53 HD3 LYS 53 9.952 -0.553 -11.662 426 1HE LYS 53 HE2 LYS 53 10.317 -3.101 -10.052 427 2HE LYS 53 HE3 LYS 53 11.629 -2.094 -10.667 428 1HZ LYS 53 HZ1 LYS 53 10.702 -0.262 -9.317 429 2HZ LYS 53 HZ2 LYS 53 9.589 -1.309 -8.686 430 3HZ LYS 53 HZ3 LYS 53 11.174 -1.589 -8.424 431 H LYS 54 H LYS 54 7.851 -0.296 -14.796 432 HA LYS 54 HA LYS 54 5.580 1.024 -16.036 433 1HB LYS 54 HB2 LYS 54 6.953 2.328 -17.599 434 2HB LYS 54 HB3 LYS 54 7.222 2.865 -15.945 435 1HG LYS 54 HG2 LYS 54 9.360 1.579 -15.868 436 2HG LYS 54 HG3 LYS 54 9.086 1.030 -17.530 437 1HD LYS 54 HD2 LYS 54 9.123 3.381 -18.317 438 2HD LYS 54 HD3 LYS 54 9.411 3.930 -16.649 439 1HE LYS 54 HE2 LYS 54 11.511 2.596 -16.581 440 2HE LYS 54 HE3 LYS 54 11.221 2.049 -18.237 441 1HZ LYS 54 HZ1 LYS 54 12.761 3.906 -18.173 442 2HZ LYS 54 HZ2 LYS 54 11.411 4.358 -18.963 443 3HZ LYS 54 HZ3 LYS 54 11.677 4.865 -17.430 444 H GLU 55 H GLU 55 5.646 0.470 -18.432 445 HA GLU 55 HA GLU 55 5.935 -2.334 -18.811 446 1HB GLU 55 HB2 GLU 55 5.811 -0.102 -20.899 447 2HB GLU 55 HB3 GLU 55 5.464 -1.812 -21.174 448 1HG GLU 55 HG2 GLU 55 3.514 -1.651 -19.639 449 2HG GLU 55 HG3 GLU 55 3.859 0.043 -19.352 450 H GLY 56 H GLY 56 7.620 -3.558 -19.491 451 1HA GLY 56 HA2 GLY 56 9.483 -4.183 -20.624 452 2HA GLY 56 HA3 GLY 56 9.732 -2.522 -21.181 453 H ASP 57 H ASP 57 9.426 -2.309 -17.806 454 HA ASP 57 HA ASP 57 12.275 -1.834 -17.551 455 1HB ASP 57 HB2 ASP 57 10.481 -0.535 -16.364 456 2HB ASP 57 HB3 ASP 57 10.195 -1.946 -15.340 457 H PHE 58 H PHE 58 13.667 -2.892 -16.010 458 HA PHE 58 HA PHE 58 13.424 -5.829 -15.936 459 1HB PHE 58 HB2 PHE 58 15.619 -4.771 -16.263 460 2HB PHE 58 HB3 PHE 58 15.429 -3.855 -14.777 461 HD1 PHE 58 HD1 PHE 58 16.050 -7.238 -16.190 462 HD2 PHE 58 HD2 PHE 58 15.851 -4.859 -12.594 463 HE1 PHE 58 HE1 PHE 58 17.188 -9.043 -14.931 464 HE2 PHE 58 HE2 PHE 58 17.003 -6.665 -11.342 465 HZ PHE 58 HZ PHE 58 17.693 -8.751 -12.515 466 H VAL 59 H VAL 59 12.999 -7.038 -14.016 467 HA VAL 59 HA VAL 59 12.476 -5.584 -11.522 468 HB VAL 59 HB VAL 59 10.325 -6.899 -11.236 469 1HG1 VAL 59 HG11 VAL 59 10.410 -4.480 -11.581 470 2HG1 VAL 59 HG12 VAL 59 10.267 -4.705 -13.338 471 3HG1 VAL 59 HG13 VAL 59 8.942 -5.192 -12.263 472 1HG2 VAL 59 HG21 VAL 59 9.036 -7.509 -13.199 473 2HG2 VAL 59 HG22 VAL 59 10.366 -7.052 -14.278 474 3HG2 VAL 59 HG23 VAL 59 10.553 -8.430 -13.169 475 H ASN 60 H ASN 60 12.197 -7.082 -9.686 476 HA ASN 60 HA ASN 60 13.422 -9.697 -10.098 477 1HB ASN 60 HB2 ASN 60 15.093 -7.539 -9.560 478 2HB ASN 60 HB3 ASN 60 14.766 -8.177 -7.948 479 1HD2 ASN 60 HD22 ASN 60 15.532 -9.273 -11.303 480 2HD2 ASN 60 HD21 ASN 60 16.613 -10.563 -10.817 481 H GLU 61 H GLU 61 13.644 -10.878 -7.995 482 HA GLU 61 HA GLU 61 11.072 -11.018 -6.766 483 1HB GLU 61 HB2 GLU 61 12.508 -12.954 -7.117 484 2HB GLU 61 HB3 GLU 61 13.778 -12.266 -6.114 485 1HG GLU 61 HG2 GLU 61 12.172 -12.355 -4.149 486 2HG GLU 61 HG3 GLU 61 10.984 -13.115 -5.206 487 H GLY 62 H GLY 62 10.322 -9.459 -5.458 488 1HA GLY 62 HA2 GLY 62 10.200 -8.501 -3.311 489 2HA GLY 62 HA3 GLY 62 11.964 -8.496 -3.179 490 H ASP 63 H ASP 63 11.242 -7.443 -6.333 491 HA ASP 63 HA ASP 63 11.958 -4.700 -5.647 492 1HB ASP 63 HB2 ASP 63 12.764 -6.006 -7.671 493 2HB ASP 63 HB3 ASP 63 11.138 -5.850 -8.341 494 H VAL 64 H VAL 64 10.513 -3.021 -5.389 495 HA VAL 64 HA VAL 64 7.794 -3.691 -4.901 496 HB VAL 64 HB VAL 64 9.062 -0.928 -5.092 497 1HG1 VAL 64 HG11 VAL 64 6.574 -1.923 -3.623 498 2HG1 VAL 64 HG12 VAL 64 7.266 -0.294 -3.481 499 3HG1 VAL 64 HG13 VAL 64 6.603 -0.833 -5.024 500 1HG2 VAL 64 HG21 VAL 64 10.340 -2.275 -3.479 501 2HG2 VAL 64 HG22 VAL 64 9.325 -1.127 -2.611 502 3HG2 VAL 64 HG23 VAL 64 8.835 -2.833 -2.717 503 H LEU 65 H LEU 65 6.034 -3.605 -6.153 504 HA LEU 65 HA LEU 65 6.193 -2.614 -8.939 505 1HB LEU 65 HB2 LEU 65 5.087 -4.800 -8.606 506 2HB LEU 65 HB3 LEU 65 4.033 -4.106 -7.384 507 HG LEU 65 HG LEU 65 3.001 -2.624 -9.124 508 1HD1 LEU 65 HD11 LEU 65 4.769 -4.164 -11.067 509 2HD1 LEU 65 HD12 LEU 65 3.416 -3.095 -11.514 510 3HD1 LEU 65 HD13 LEU 65 4.828 -2.419 -10.716 511 1HD2 LEU 65 HD21 LEU 65 2.041 -4.843 -8.550 512 2HD2 LEU 65 HD22 LEU 65 1.709 -4.347 -10.214 513 3HD2 LEU 65 HD23 LEU 65 2.971 -5.558 -9.883 514 H LEU 66 H LEU 66 4.448 -2.073 -5.778 515 HA LEU 66 HA LEU 66 4.191 0.723 -6.495 516 1HB LEU 66 HB2 LEU 66 1.843 0.966 -6.414 517 2HB LEU 66 HB3 LEU 66 2.255 -0.091 -7.739 518 HG LEU 66 HG LEU 66 1.376 -1.280 -5.077 519 1HD1 LEU 66 HD11 LEU 66 -0.949 -1.213 -5.981 520 2HD1 LEU 66 HD12 LEU 66 -0.289 0.371 -5.555 521 3HD1 LEU 66 HD13 LEU 66 -0.396 -0.118 -7.259 522 1HD2 LEU 66 HD21 LEU 66 0.430 -3.041 -6.545 523 2HD2 LEU 66 HD22 LEU 66 0.994 -2.170 -7.981 524 3HD2 LEU 66 HD23 LEU 66 2.160 -2.858 -6.826 525 H GLU 67 H GLU 67 3.143 2.005 -4.850 526 HA GLU 67 HA GLU 67 3.474 0.956 -2.088 527 1HB GLU 67 HB2 GLU 67 5.199 2.599 -2.904 528 2HB GLU 67 HB3 GLU 67 3.901 3.783 -3.142 529 1HG GLU 67 HG2 GLU 67 3.384 3.546 -0.668 530 2HG GLU 67 HG3 GLU 67 4.805 2.504 -0.530 531 H LEU 68 H LEU 68 1.843 1.749 -0.587 532 HA LEU 68 HA LEU 68 -0.721 2.514 -1.913 533 1HB LEU 68 HB2 LEU 68 -0.268 0.499 0.326 534 2HB LEU 68 HB3 LEU 68 -1.824 0.959 -0.353 535 HG LEU 68 HG LEU 68 0.376 -0.579 -1.794 536 1HD1 LEU 68 HD11 LEU 68 -2.403 -1.422 -0.860 537 2HD1 LEU 68 HD12 LEU 68 -1.224 -2.438 -1.704 538 3HD1 LEU 68 HD13 LEU 68 -0.872 -1.859 -0.068 539 1HD2 LEU 68 HD21 LEU 68 -2.384 0.236 -2.795 540 2HD2 LEU 68 HD22 LEU 68 -0.808 0.824 -3.389 541 3HD2 LEU 68 HD23 LEU 68 -1.237 -0.867 -3.599 542 H SER 69 H SER 69 -2.195 3.644 -0.658 543 HA SER 69 HA SER 69 -1.209 5.236 1.575 544 1HB SER 69 HB2 SER 69 -4.004 5.012 0.395 545 2HB SER 69 HB3 SER 69 -3.363 6.330 1.393 546 HG SER 69 HG SER 69 -3.321 6.880 -0.808 547 H ASN 70 H ASN 70 -0.921 2.606 2.310 548 HA ASN 70 HA ASN 70 -3.173 1.192 3.243 549 1HB ASN 70 HB2 ASN 70 -0.934 0.202 2.852 550 2HB ASN 70 HB3 ASN 70 -0.294 1.070 4.253 551 1HD2 ASN 70 HD22 ASN 70 -1.035 0.389 6.446 552 2HD2 ASN 70 HD21 ASN 70 -1.704 -1.208 6.642 553 H SER 71 H SER 71 -1.201 3.638 4.893 554 HA SER 71 HA SER 71 -2.961 3.549 7.287 555 1HB SER 71 HB2 SER 71 0.074 3.777 7.354 556 2HB SER 71 HB3 SER 71 -1.030 3.585 8.724 557 HG SER 71 HG SER 71 -0.014 1.635 8.218 558 H THR 72 H THR 72 -2.974 5.584 8.461 559 HA THR 72 HA THR 72 -2.969 7.931 6.954 560 HB THR 72 HB THR 72 -2.521 7.748 9.959 561 HG1 THR 72 HG1 THR 72 -4.669 7.314 10.190 562 1HG2 THR 72 HG21 THR 72 -4.173 9.659 8.235 563 2HG2 THR 72 HG22 THR 72 -4.048 9.704 10.009 564 3HG2 THR 72 HG23 THR 72 -2.622 10.035 9.017 565 H GLN 73 H GLN 73 -1.423 9.499 6.509 566 HA GLN 73 HA GLN 73 1.221 9.530 7.659 567 1HB GLN 73 HB2 GLN 73 2.379 8.963 5.548 568 2HB GLN 73 HB3 GLN 73 1.478 7.597 6.189 569 1HG GLN 73 HG2 GLN 73 -0.400 8.239 4.518 570 2HG GLN 73 HG3 GLN 73 0.787 9.319 3.782 571 1HE2 GLN 73 HE22 GLN 73 -0.137 5.974 4.379 572 2HE2 GLN 73 HE21 GLN 73 1.007 5.242 3.248 Start of MODEL 8 1 1H THR 2 H1 THR 2 2.718 -2.122 1.110 2 2H THR 2 H2 THR 2 4.230 -2.590 1.538 3 3H THR 2 H3 THR 2 3.888 -0.996 1.403 4 HA THR 2 HA THR 2 3.607 -1.192 -0.963 5 HB THR 2 HB THR 2 5.979 -2.203 -1.472 6 HG1 THR 2 HG1 THR 2 7.285 -2.424 0.279 7 1HG2 THR 2 HG21 THR 2 5.566 0.206 -1.438 8 2HG2 THR 2 HG22 THR 2 5.685 0.233 0.340 9 3HG2 THR 2 HG23 THR 2 7.100 -0.170 -0.651 10 H VAL 3 H VAL 3 4.006 -2.618 -2.919 11 HA VAL 3 HA VAL 3 3.595 -5.506 -2.408 12 HB VAL 3 HB VAL 3 2.170 -3.970 -4.602 13 1HG1 VAL 3 HG11 VAL 3 2.606 -6.338 -5.144 14 2HG1 VAL 3 HG12 VAL 3 1.849 -6.832 -3.612 15 3HG1 VAL 3 HG13 VAL 3 0.885 -6.065 -4.899 16 1HG2 VAL 3 HG21 VAL 3 1.057 -3.302 -2.550 17 2HG2 VAL 3 HG22 VAL 3 0.030 -4.438 -3.423 18 3HG2 VAL 3 HG23 VAL 3 0.958 -4.995 -2.009 19 H SER 4 H SER 4 4.793 -6.745 -3.960 20 HA SER 4 HA SER 4 6.775 -5.257 -5.619 21 1HB SER 4 HB2 SER 4 7.317 -7.412 -3.539 22 2HB SER 4 HB3 SER 4 8.536 -6.555 -4.486 23 HG SER 4 HG SER 4 8.258 -5.731 -2.326 24 H ILE 5 H ILE 5 8.038 -6.646 -6.989 25 HA ILE 5 HA ILE 5 6.530 -8.913 -8.123 26 HB ILE 5 HB ILE 5 9.273 -7.824 -8.928 27 1HG1 ILE 5 HG12 ILE 5 7.746 -6.992 -10.976 28 2HG1 ILE 5 HG13 ILE 5 6.492 -6.925 -9.750 29 1HG2 ILE 5 HG21 ILE 5 8.790 -8.980 -11.067 30 2HG2 ILE 5 HG22 ILE 5 8.793 -10.107 -9.733 31 3HG2 ILE 5 HG23 ILE 5 7.243 -9.563 -10.408 32 1HD1 ILE 5 HD11 ILE 5 7.683 -4.765 -10.163 33 2HD1 ILE 5 HD12 ILE 5 7.847 -5.279 -8.483 34 3HD1 ILE 5 HD13 ILE 5 9.198 -5.499 -9.602 35 H GLN 6 H GLN 6 7.503 -11.058 -8.080 36 HA GLN 6 HA GLN 6 9.292 -11.553 -5.751 37 1HB GLN 6 HB2 GLN 6 7.810 -13.271 -4.998 38 2HB GLN 6 HB3 GLN 6 6.924 -11.765 -5.141 39 1HG GLN 6 HG2 GLN 6 6.797 -14.088 -7.124 40 2HG GLN 6 HG3 GLN 6 5.615 -13.735 -5.872 41 1HE2 GLN 6 HE22 GLN 6 4.199 -11.832 -6.134 42 2HE2 GLN 6 HE21 GLN 6 4.030 -11.094 -7.707 43 H MET 7 H MET 7 9.628 -11.619 -8.847 44 HA MET 7 HA MET 7 11.339 -13.937 -8.892 45 1HB MET 7 HB2 MET 7 10.328 -14.918 -10.944 46 2HB MET 7 HB3 MET 7 9.275 -15.061 -9.535 47 1HG MET 7 HG2 MET 7 7.986 -13.089 -10.302 48 2HG MET 7 HG3 MET 7 8.962 -13.037 -11.770 49 1HE MET 7 HE1 MET 7 5.918 -13.030 -11.926 50 2HE MET 7 HE2 MET 7 5.052 -14.578 -11.886 51 3HE MET 7 HE3 MET 7 5.732 -13.912 -10.393 52 H ALA 8 H ALA 8 12.740 -13.813 -10.840 53 HA ALA 8 HA ALA 8 13.244 -11.046 -11.658 54 1HB ALA 8 HB1 ALA 8 15.093 -12.585 -11.109 55 2HB ALA 8 HB2 ALA 8 14.591 -13.658 -12.441 56 3HB ALA 8 HB3 ALA 8 15.181 -12.019 -12.794 57 H GLY 9 H GLY 9 12.818 -10.112 -13.644 58 1HA GLY 9 HA2 GLY 9 12.456 -11.498 -16.058 59 2HA GLY 9 HA3 GLY 9 10.855 -11.337 -15.340 60 H ASN 10 H ASN 10 10.165 -9.946 -17.013 61 HA ASN 10 HA ASN 10 11.080 -7.116 -16.734 62 1HB ASN 10 HB2 ASN 10 10.725 -8.731 -19.273 63 2HB ASN 10 HB3 ASN 10 10.271 -7.031 -19.250 64 1HD2 ASN 10 HD22 ASN 10 13.090 -8.110 -17.284 65 2HD2 ASN 10 HD21 ASN 10 14.268 -7.397 -18.365 66 H LEU 11 H LEU 11 9.381 -5.711 -16.606 67 HA LEU 11 HA LEU 11 6.924 -6.931 -15.699 68 1HB LEU 11 HB2 LEU 11 8.245 -5.120 -14.552 69 2HB LEU 11 HB3 LEU 11 7.725 -4.009 -15.814 70 HG LEU 11 HG LEU 11 5.325 -4.494 -15.150 71 1HD1 LEU 11 HD11 LEU 11 5.469 -6.676 -14.076 72 2HD1 LEU 11 HD12 LEU 11 6.673 -6.079 -12.914 73 3HD1 LEU 11 HD13 LEU 11 5.000 -5.503 -12.846 74 1HD2 LEU 11 HD21 LEU 11 5.481 -3.140 -13.102 75 2HD2 LEU 11 HD22 LEU 11 7.203 -3.540 -12.948 76 3HD2 LEU 11 HD23 LEU 11 6.618 -2.561 -14.320 77 H TRP 12 H TRP 12 6.377 -7.744 -17.834 78 HA TRP 12 HA TRP 12 6.011 -6.791 -20.222 79 1HB TRP 12 HB2 TRP 12 5.237 -9.003 -19.166 80 2HB TRP 12 HB3 TRP 12 3.699 -8.218 -18.873 81 HD1 TRP 12 HD1 TRP 12 6.051 -8.999 -21.777 82 HE1 TRP 12 HE1 TRP 12 4.733 -9.638 -23.868 83 HE3 TRP 12 HE3 TRP 12 1.335 -8.218 -19.984 84 HZ2 TRP 12 HZ2 TRP 12 1.942 -9.842 -24.648 85 HZ3 TRP 12 HZ3 TRP 12 -0.642 -8.707 -21.394 86 HH2 TRP 12 HH2 TRP 12 -0.353 -9.511 -23.728 87 H LYS 13 H LYS 13 3.334 -6.220 -17.847 88 HA LYS 13 HA LYS 13 2.759 -3.610 -19.049 89 1HB LYS 13 HB2 LYS 13 0.727 -5.887 -18.962 90 2HB LYS 13 HB3 LYS 13 0.287 -4.182 -19.131 91 1HG LYS 13 HG2 LYS 13 1.677 -4.071 -21.226 92 2HG LYS 13 HG3 LYS 13 1.932 -5.820 -21.097 93 1HD LYS 13 HD2 LYS 13 -0.570 -6.133 -21.145 94 2HD LYS 13 HD3 LYS 13 -0.735 -4.386 -21.429 95 1HE LYS 13 HE2 LYS 13 0.696 -4.614 -23.472 96 2HE LYS 13 HE3 LYS 13 0.796 -6.358 -23.192 97 1HZ LYS 13 HZ1 LYS 13 -1.616 -6.470 -23.495 98 2HZ LYS 13 HZ2 LYS 13 -1.699 -4.858 -23.758 99 3HZ LYS 13 HZ3 LYS 13 -0.909 -5.815 -24.809 100 H VAL 14 H VAL 14 1.250 -2.391 -17.619 101 HA VAL 14 HA VAL 14 0.959 -3.438 -14.859 102 HB VAL 14 HB VAL 14 2.182 -0.713 -15.504 103 1HG1 VAL 14 HG11 VAL 14 1.672 -2.107 -12.821 104 2HG1 VAL 14 HG12 VAL 14 2.599 -0.613 -13.028 105 3HG1 VAL 14 HG13 VAL 14 0.880 -0.628 -13.416 106 1HG2 VAL 14 HG21 VAL 14 3.870 -2.455 -15.892 107 2HG2 VAL 14 HG22 VAL 14 4.225 -1.590 -14.402 108 3HG2 VAL 14 HG23 VAL 14 3.466 -3.205 -14.330 109 H HIS 15 H HIS 15 -0.942 -2.688 -13.917 110 HA HIS 15 HA HIS 15 -2.734 -1.172 -15.770 111 1HB HIS 15 HB2 HIS 15 -3.661 -3.229 -13.782 112 2HB HIS 15 HB3 HIS 15 -4.438 -2.688 -15.266 113 HD1 HIS 15 HD1 HIS 15 -2.292 -3.388 -17.460 114 HD2 HIS 15 HD2 HIS 15 -2.956 -5.655 -13.983 115 HE1 HIS 15 HE1 HIS 15 -1.209 -5.672 -17.858 116 H VAL 16 H VAL 16 -1.499 -1.318 -12.480 117 HA VAL 16 HA VAL 16 -3.571 0.377 -11.350 118 HB VAL 16 HB VAL 16 -1.960 0.624 -9.472 119 1HG1 VAL 16 HG11 VAL 16 -3.680 -1.113 -9.481 120 2HG1 VAL 16 HG12 VAL 16 -2.581 -2.230 -10.309 121 3HG1 VAL 16 HG13 VAL 16 -2.215 -1.663 -8.660 122 1HG2 VAL 16 HG21 VAL 16 -0.221 -1.427 -10.898 123 2HG2 VAL 16 HG22 VAL 16 0.164 0.304 -10.761 124 3HG2 VAL 16 HG23 VAL 16 0.034 -0.681 -9.304 125 H LYS 17 H LYS 17 -3.195 2.515 -10.517 126 HA LYS 17 HA LYS 17 -0.993 4.104 -11.484 127 1HB LYS 17 HB2 LYS 17 -2.418 5.881 -12.446 128 2HB LYS 17 HB3 LYS 17 -2.500 4.398 -13.393 129 1HG LYS 17 HG2 LYS 17 -4.696 3.844 -12.384 130 2HG LYS 17 HG3 LYS 17 -4.615 5.304 -11.378 131 1HD LYS 17 HD2 LYS 17 -4.574 6.710 -13.420 132 2HD LYS 17 HD3 LYS 17 -4.659 5.245 -14.426 133 1HE LYS 17 HE2 LYS 17 -6.827 4.649 -13.363 134 2HE LYS 17 HE3 LYS 17 -6.743 6.105 -12.364 135 1HZ LYS 17 HZ1 LYS 17 -8.136 6.442 -14.303 136 2HZ LYS 17 HZ2 LYS 17 -6.843 7.427 -14.398 137 3HZ LYS 17 HZ3 LYS 17 -6.920 6.079 -15.323 138 H ALA 18 H ALA 18 -1.038 6.218 -10.215 139 HA ALA 18 HA ALA 18 -1.787 5.865 -7.500 140 1HB ALA 18 HB1 ALA 18 -1.318 8.449 -9.055 141 2HB ALA 18 HB2 ALA 18 -1.356 8.288 -7.288 142 3HB ALA 18 HB3 ALA 18 -0.075 7.486 -8.216 143 H GLY 19 H GLY 19 -3.696 6.136 -6.431 144 1HA GLY 19 HA2 GLY 19 -5.781 7.025 -5.960 145 2HA GLY 19 HA3 GLY 19 -5.899 7.715 -7.585 146 H ASP 20 H ASP 20 -4.895 4.633 -8.281 147 HA ASP 20 HA ASP 20 -7.560 3.624 -8.843 148 1HB ASP 20 HB2 ASP 20 -5.487 3.101 -10.209 149 2HB ASP 20 HB3 ASP 20 -4.916 2.124 -8.855 150 H GLN 21 H GLN 21 -8.197 1.416 -8.009 151 HA GLN 21 HA GLN 21 -7.556 1.087 -5.110 152 1HB GLN 21 HB2 GLN 21 -9.742 2.117 -5.349 153 2HB GLN 21 HB3 GLN 21 -10.253 0.916 -6.524 154 1HG GLN 21 HG2 GLN 21 -9.357 -0.044 -3.794 155 2HG GLN 21 HG3 GLN 21 -10.895 0.794 -3.907 156 1HE2 GLN 21 HE22 GLN 21 -9.699 -2.282 -3.790 157 2HE2 GLN 21 HE21 GLN 21 -10.938 -3.084 -4.728 158 H ILE 22 H ILE 22 -7.177 -0.975 -4.467 159 HA ILE 22 HA ILE 22 -7.492 -3.151 -6.447 160 HB ILE 22 HB ILE 22 -5.343 -4.028 -5.994 161 1HG1 ILE 22 HG12 ILE 22 -5.017 -1.807 -3.946 162 2HG1 ILE 22 HG13 ILE 22 -5.022 -3.555 -3.679 163 1HG2 ILE 22 HG21 ILE 22 -5.541 -2.244 -7.747 164 2HG2 ILE 22 HG22 ILE 22 -4.925 -1.069 -6.570 165 3HG2 ILE 22 HG23 ILE 22 -3.915 -2.426 -7.095 166 1HD1 ILE 22 HD11 ILE 22 -2.875 -1.884 -5.000 167 2HD1 ILE 22 HD12 ILE 22 -2.772 -2.831 -3.501 168 3HD1 ILE 22 HD13 ILE 22 -2.884 -3.662 -5.065 169 H GLU 23 H GLU 23 -7.552 -5.259 -5.464 170 HA GLU 23 HA GLU 23 -8.317 -5.362 -2.624 171 1HB GLU 23 HB2 GLU 23 -10.384 -5.161 -3.905 172 2HB GLU 23 HB3 GLU 23 -9.896 -6.499 -4.962 173 1HG GLU 23 HG2 GLU 23 -9.947 -8.042 -3.018 174 2HG GLU 23 HG3 GLU 23 -10.369 -6.698 -1.953 175 H LYS 24 H LYS 24 -7.569 -7.375 -1.710 176 HA LYS 24 HA LYS 24 -5.262 -8.459 -2.786 177 1HB LYS 24 HB2 LYS 24 -6.041 -8.691 -0.442 178 2HB LYS 24 HB3 LYS 24 -7.243 -9.884 -0.952 179 1HG LYS 24 HG2 LYS 24 -5.498 -11.426 -1.680 180 2HG LYS 24 HG3 LYS 24 -4.248 -10.197 -1.433 181 1HD LYS 24 HD2 LYS 24 -4.766 -10.185 1.012 182 2HD LYS 24 HD3 LYS 24 -5.974 -11.463 0.744 183 1HE LYS 24 HE2 LYS 24 -4.191 -12.943 -0.165 184 2HE LYS 24 HE3 LYS 24 -2.998 -11.660 0.084 185 1HZ LYS 24 HZ1 LYS 24 -3.421 -11.811 2.464 186 2HZ LYS 24 HZ2 LYS 24 -4.531 -12.992 2.242 187 3HZ LYS 24 HZ3 LYS 24 -2.965 -13.263 1.885 188 H GLY 25 H GLY 25 -4.795 -9.722 -4.503 189 1HA GLY 25 HA2 GLY 25 -4.983 -11.614 -5.854 190 2HA GLY 25 HA3 GLY 25 -6.678 -11.814 -5.404 191 H GLN 26 H GLN 26 -6.651 -8.588 -6.118 192 HA GLN 26 HA GLN 26 -7.677 -8.845 -8.798 193 1HB GLN 26 HB2 GLN 26 -8.258 -7.058 -7.116 194 2HB GLN 26 HB3 GLN 26 -6.627 -6.395 -7.308 195 1HG GLN 26 HG2 GLN 26 -7.131 -5.984 -9.728 196 2HG GLN 26 HG3 GLN 26 -8.768 -6.592 -9.475 197 1HE2 GLN 26 HE22 GLN 26 -6.958 -3.759 -9.618 198 2HE2 GLN 26 HE21 GLN 26 -7.953 -2.721 -8.608 199 H GLU 27 H GLU 27 -6.573 -8.451 -10.758 200 HA GLU 27 HA GLU 27 -3.719 -8.866 -10.828 201 1HB GLU 27 HB2 GLU 27 -5.428 -9.593 -12.544 202 2HB GLU 27 HB3 GLU 27 -5.590 -7.900 -13.029 203 1HG GLU 27 HG2 GLU 27 -3.181 -7.873 -13.659 204 2HG GLU 27 HG3 GLU 27 -3.009 -9.531 -13.087 205 H VAL 28 H VAL 28 -2.101 -7.408 -11.275 206 HA VAL 28 HA VAL 28 -2.698 -4.490 -11.041 207 HB VAL 28 HB VAL 28 -0.961 -6.338 -9.372 208 1HG1 VAL 28 HG11 VAL 28 0.532 -4.465 -9.993 209 2HG1 VAL 28 HG12 VAL 28 -0.657 -3.320 -9.358 210 3HG1 VAL 28 HG13 VAL 28 0.123 -4.497 -8.282 211 1HG2 VAL 28 HG21 VAL 28 -2.980 -4.167 -8.662 212 2HG2 VAL 28 HG22 VAL 28 -3.233 -5.912 -8.546 213 3HG2 VAL 28 HG23 VAL 28 -2.048 -5.123 -7.495 214 H ALA 29 H ALA 29 -0.429 -7.090 -12.101 215 HA ALA 29 HA ALA 29 0.366 -5.482 -14.376 216 1HB ALA 29 HB1 ALA 29 2.438 -6.251 -12.246 217 2HB ALA 29 HB2 ALA 29 2.810 -5.614 -13.850 218 3HB ALA 29 HB3 ALA 29 1.955 -4.602 -12.684 219 H ILE 30 H ILE 30 2.228 -6.876 -15.493 220 HA ILE 30 HA ILE 30 1.798 -9.777 -15.096 221 HB ILE 30 HB ILE 30 1.542 -8.262 -17.724 222 1HG1 ILE 30 HG12 ILE 30 -0.350 -10.248 -16.375 223 2HG1 ILE 30 HG13 ILE 30 -0.528 -8.501 -16.310 224 1HG2 ILE 30 HG21 ILE 30 2.983 -10.252 -18.110 225 2HG2 ILE 30 HG22 ILE 30 1.771 -11.283 -17.315 226 3HG2 ILE 30 HG23 ILE 30 1.422 -10.477 -18.859 227 1HD1 ILE 30 HD11 ILE 30 -0.775 -10.192 -18.813 228 2HD1 ILE 30 HD12 ILE 30 -2.049 -9.329 -17.945 229 3HD1 ILE 30 HD13 ILE 30 -0.783 -8.408 -18.774 230 H LEU 31 H LEU 31 3.652 -10.913 -15.485 231 HA LEU 31 HA LEU 31 6.196 -9.386 -15.839 232 1HB LEU 31 HB2 LEU 31 5.806 -10.014 -13.565 233 2HB LEU 31 HB3 LEU 31 5.336 -11.660 -13.993 234 HG LEU 31 HG LEU 31 7.499 -11.389 -12.844 235 1HD1 LEU 31 HD11 LEU 31 7.898 -12.634 -15.575 236 2HD1 LEU 31 HD12 LEU 31 8.741 -13.007 -14.066 237 3HD1 LEU 31 HD13 LEU 31 7.018 -13.384 -14.239 238 1HD2 LEU 31 HD21 LEU 31 8.625 -10.292 -15.423 239 2HD2 LEU 31 HD22 LEU 31 8.122 -9.267 -14.065 240 3HD2 LEU 31 HD23 LEU 31 9.412 -10.458 -13.831 241 H GLU 32 H GLU 32 7.429 -10.131 -17.502 242 HA GLU 32 HA GLU 32 6.718 -12.674 -18.869 243 1HB GLU 32 HB2 GLU 32 6.715 -10.642 -20.265 244 2HB GLU 32 HB3 GLU 32 8.365 -10.265 -19.757 245 1HG GLU 32 HG2 GLU 32 9.113 -12.452 -20.780 246 2HG GLU 32 HG3 GLU 32 7.465 -12.709 -21.347 247 H SER 33 H SER 33 8.067 -14.363 -18.457 248 HA SER 33 HA SER 33 10.884 -14.168 -18.246 249 1HB SER 33 HB2 SER 33 10.167 -13.335 -15.913 250 2HB SER 33 HB3 SER 33 9.533 -14.959 -15.622 251 HG SER 33 HG SER 33 11.782 -14.309 -14.997 252 H MET 34 H MET 34 11.732 -16.469 -17.727 253 HA MET 34 HA MET 34 11.763 -18.674 -18.300 254 1HB MET 34 HB2 MET 34 9.014 -18.640 -16.994 255 2HB MET 34 HB3 MET 34 10.043 -20.054 -17.199 256 1HG MET 34 HG2 MET 34 11.682 -19.236 -15.676 257 2HG MET 34 HG3 MET 34 10.966 -17.629 -15.610 258 1HE MET 34 HE1 MET 34 7.904 -17.910 -13.336 259 2HE MET 34 HE2 MET 34 9.094 -16.838 -14.100 260 3HE MET 34 HE3 MET 34 7.976 -17.788 -15.105 261 H LYS 35 H LYS 35 10.877 -16.943 -20.413 262 HA LYS 35 HA LYS 35 9.824 -16.797 -22.389 263 1HB LYS 35 HB2 LYS 35 10.027 -19.829 -22.382 264 2HB LYS 35 HB3 LYS 35 9.759 -18.802 -23.796 265 1HG LYS 35 HG2 LYS 35 11.945 -17.665 -23.368 266 2HG LYS 35 HG3 LYS 35 12.264 -18.804 -22.053 267 1HD LYS 35 HD2 LYS 35 11.830 -19.553 -24.978 268 2HD LYS 35 HD3 LYS 35 13.397 -19.416 -24.167 269 1HE LYS 35 HE2 LYS 35 12.726 -21.211 -22.572 270 2HE LYS 35 HE3 LYS 35 11.182 -21.378 -23.416 271 1HZ LYS 35 HZ1 LYS 35 12.775 -23.024 -24.163 272 2HZ LYS 35 HZ2 LYS 35 12.414 -22.032 -25.403 273 3HZ LYS 35 HZ3 LYS 35 13.841 -21.882 -24.620 274 H MET 36 H MET 36 8.072 -16.733 -20.112 275 HA MET 36 HA MET 36 5.490 -17.388 -21.387 276 1HB MET 36 HB2 MET 36 6.423 -18.156 -18.576 277 2HB MET 36 HB3 MET 36 4.726 -18.102 -19.040 278 1HG MET 36 HG2 MET 36 6.803 -19.885 -20.352 279 2HG MET 36 HG3 MET 36 5.681 -20.376 -19.088 280 1HE MET 36 HE1 MET 36 6.090 -21.849 -21.910 281 2HE MET 36 HE2 MET 36 5.004 -22.432 -20.627 282 3HE MET 36 HE3 MET 36 4.404 -22.263 -22.292 283 H GLU 37 H GLU 37 3.740 -16.272 -19.931 284 HA GLU 37 HA GLU 37 4.758 -13.780 -18.698 285 1HB GLU 37 HB2 GLU 37 2.218 -13.981 -20.367 286 2HB GLU 37 HB3 GLU 37 2.770 -12.599 -19.434 287 1HG GLU 37 HG2 GLU 37 3.381 -12.000 -21.574 288 2HG GLU 37 HG3 GLU 37 4.888 -12.602 -20.899 289 H ILE 38 H ILE 38 3.802 -13.369 -16.728 290 HA ILE 38 HA ILE 38 1.878 -15.364 -15.665 291 HB ILE 38 HB ILE 38 4.417 -14.398 -14.264 292 1HG1 ILE 38 HG12 ILE 38 4.886 -17.040 -14.482 293 2HG1 ILE 38 HG13 ILE 38 3.928 -16.878 -15.941 294 1HG2 ILE 38 HG21 ILE 38 3.813 -16.243 -12.666 295 2HG2 ILE 38 HG22 ILE 38 2.589 -14.984 -12.732 296 3HG2 ILE 38 HG23 ILE 38 2.324 -16.525 -13.581 297 1HD1 ILE 38 HD11 ILE 38 6.526 -15.434 -15.235 298 2HD1 ILE 38 HD12 ILE 38 6.308 -16.712 -16.440 299 3HD1 ILE 38 HD13 ILE 38 5.613 -15.115 -16.721 300 HA PRO 39 HA PRO 39 -0.004 -11.450 -14.351 301 1HB PRO 39 HB2 PRO 39 -1.290 -13.219 -12.277 302 2HB PRO 39 HB3 PRO 39 -2.046 -11.994 -13.338 303 1HG PRO 39 HG2 PRO 39 -2.288 -14.650 -13.861 304 2HG PRO 39 HG3 PRO 39 -2.021 -13.478 -15.194 305 1HD PRO 39 HD2 PRO 39 -0.004 -15.285 -13.850 306 2HD PRO 39 HD3 PRO 39 -0.210 -14.897 -15.587 307 H ILE 40 H ILE 40 0.209 -10.003 -12.645 308 HA ILE 40 HA ILE 40 1.514 -10.863 -10.112 309 HB ILE 40 HB ILE 40 1.903 -8.284 -11.667 310 1HG1 ILE 40 HG12 ILE 40 3.234 -10.109 -12.659 311 2HG1 ILE 40 HG13 ILE 40 4.196 -8.802 -11.996 312 1HG2 ILE 40 HG21 ILE 40 2.904 -9.100 -8.917 313 2HG2 ILE 40 HG22 ILE 40 3.605 -7.770 -9.852 314 3HG2 ILE 40 HG23 ILE 40 1.910 -7.697 -9.355 315 1HD1 ILE 40 HD11 ILE 40 3.728 -11.480 -10.613 316 2HD1 ILE 40 HD12 ILE 40 5.194 -10.979 -11.474 317 3HD1 ILE 40 HD13 ILE 40 4.732 -10.143 -9.996 318 H VAL 41 H VAL 41 0.273 -10.276 -8.393 319 HA VAL 41 HA VAL 41 -2.231 -8.762 -8.916 320 HB VAL 41 HB VAL 41 -3.234 -10.435 -7.257 321 1HG1 VAL 41 HG11 VAL 41 -2.371 -11.428 -10.003 322 2HG1 VAL 41 HG12 VAL 41 -3.599 -12.200 -8.970 323 3HG1 VAL 41 HG13 VAL 41 -3.872 -10.572 -9.560 324 1HG2 VAL 41 HG21 VAL 41 -0.873 -12.191 -8.053 325 2HG2 VAL 41 HG22 VAL 41 -1.058 -11.418 -6.455 326 3HG2 VAL 41 HG23 VAL 41 -2.240 -12.613 -7.010 327 H ALA 42 H ALA 42 -3.244 -7.875 -7.038 328 HA ALA 42 HA ALA 42 -1.545 -6.453 -5.248 329 1HB ALA 42 HB1 ALA 42 -3.809 -5.728 -5.988 330 2HB ALA 42 HB2 ALA 42 -4.521 -7.110 -5.142 331 3HB ALA 42 HB3 ALA 42 -3.710 -5.833 -4.221 332 H ASP 43 H ASP 43 -0.448 -7.363 -3.569 333 HA ASP 43 HA ASP 43 -1.072 -9.921 -2.410 334 1HB ASP 43 HB2 ASP 43 1.200 -8.972 -2.477 335 2HB ASP 43 HB3 ASP 43 0.693 -7.644 -1.428 336 H ARG 44 H ARG 44 -2.329 -6.737 -1.860 337 HA ARG 44 HA ARG 44 -4.104 -7.662 0.249 338 1HB ARG 44 HB2 ARG 44 -3.564 -5.740 1.720 339 2HB ARG 44 HB3 ARG 44 -2.290 -6.947 1.682 340 1HG ARG 44 HG2 ARG 44 -0.827 -5.588 0.433 341 2HG ARG 44 HG3 ARG 44 -2.113 -4.531 -0.158 342 1HD ARG 44 HD2 ARG 44 -1.316 -4.654 2.769 343 2HD ARG 44 HD3 ARG 44 -0.604 -3.543 1.585 344 HE ARG 44 HE ARG 44 -3.525 -3.506 1.596 345 1HH1 ARG 44 HH21 ARG 44 -0.670 -1.960 3.063 346 2HH1 ARG 44 HH22 ARG 44 -1.473 -0.442 3.273 347 1HH2 ARG 44 HH11 ARG 44 -4.587 -1.654 2.051 348 2HH2 ARG 44 HH12 ARG 44 -3.840 -0.340 2.936 349 H SER 45 H SER 45 -5.856 -6.077 0.552 350 HA SER 45 HA SER 45 -6.504 -4.529 -1.811 351 1HB SER 45 HB2 SER 45 -7.790 -4.522 0.945 352 2HB SER 45 HB3 SER 45 -8.558 -4.075 -0.591 353 HG SER 45 HG SER 45 -9.047 -6.240 0.176 354 H GLY 46 H GLY 46 -6.824 -2.176 -1.853 355 1HA GLY 46 HA2 GLY 46 -6.418 -0.381 0.203 356 2HA GLY 46 HA3 GLY 46 -4.796 -0.677 -0.438 357 H ILE 47 H ILE 47 -5.185 1.741 -0.774 358 HA ILE 47 HA ILE 47 -6.188 2.223 -3.541 359 HB ILE 47 HB ILE 47 -5.722 4.180 -1.251 360 1HG1 ILE 47 HG12 ILE 47 -7.825 2.999 -0.921 361 2HG1 ILE 47 HG13 ILE 47 -8.111 4.676 -1.350 362 1HG2 ILE 47 HG21 ILE 47 -5.078 5.278 -3.309 363 2HG2 ILE 47 HG22 ILE 47 -6.546 4.731 -4.134 364 3HG2 ILE 47 HG23 ILE 47 -6.646 5.912 -2.809 365 1HD1 ILE 47 HD11 ILE 47 -8.403 2.280 -3.208 366 2HD1 ILE 47 HD12 ILE 47 -9.710 3.231 -2.490 367 3HD1 ILE 47 HD13 ILE 47 -8.646 3.973 -3.699 368 H VAL 48 H VAL 48 -4.660 2.849 -4.985 369 HA VAL 48 HA VAL 48 -1.869 2.308 -4.384 370 HB VAL 48 HB VAL 48 -3.235 3.403 -6.853 371 1HG1 VAL 48 HG11 VAL 48 -1.206 2.548 -8.034 372 2HG1 VAL 48 HG12 VAL 48 -0.794 3.825 -6.887 373 3HG1 VAL 48 HG13 VAL 48 -0.473 2.133 -6.470 374 1HG2 VAL 48 HG21 VAL 48 -4.149 1.195 -6.295 375 2HG2 VAL 48 HG22 VAL 48 -3.097 1.070 -7.688 376 3HG2 VAL 48 HG23 VAL 48 -2.517 0.536 -6.093 377 H LYS 49 H LYS 49 -0.592 3.786 -3.395 378 HA LYS 49 HA LYS 49 -1.233 6.672 -3.445 379 1HB LYS 49 HB2 LYS 49 -0.458 5.707 -1.366 380 2HB LYS 49 HB3 LYS 49 0.977 5.029 -2.143 381 1HG LYS 49 HG2 LYS 49 1.815 7.325 -2.575 382 2HG LYS 49 HG3 LYS 49 0.382 7.996 -1.761 383 1HD LYS 49 HD2 LYS 49 1.023 6.917 0.342 384 2HD LYS 49 HD3 LYS 49 2.316 6.021 -0.475 385 1HE LYS 49 HE2 LYS 49 3.365 8.258 -1.077 386 2HE LYS 49 HE3 LYS 49 2.190 9.028 0.000 387 1HZ LYS 49 HZ1 LYS 49 4.310 8.540 1.101 388 2HZ LYS 49 HZ2 LYS 49 3.107 7.701 1.816 389 3HZ LYS 49 HZ3 LYS 49 4.143 6.936 0.791 390 H GLU 50 H GLU 50 1.302 4.330 -4.620 391 HA GLU 50 HA GLU 50 1.912 6.148 -6.844 392 1HB GLU 50 HB2 GLU 50 3.231 6.984 -4.820 393 2HB GLU 50 HB3 GLU 50 4.085 5.438 -4.809 394 1HG GLU 50 HG2 GLU 50 5.035 5.892 -7.002 395 2HG GLU 50 HG3 GLU 50 3.996 7.305 -7.217 396 H VAL 51 H VAL 51 3.359 5.059 -8.418 397 HA VAL 51 HA VAL 51 3.535 2.105 -8.063 398 HB VAL 51 HB VAL 51 3.060 3.589 -10.680 399 1HG1 VAL 51 HG11 VAL 51 2.901 0.620 -9.963 400 2HG1 VAL 51 HG12 VAL 51 2.509 1.332 -11.539 401 3HG1 VAL 51 HG13 VAL 51 4.171 1.389 -10.942 402 1HG2 VAL 51 HG21 VAL 51 1.053 2.084 -8.943 403 2HG2 VAL 51 HG22 VAL 51 1.016 3.819 -9.331 404 3HG2 VAL 51 HG23 VAL 51 0.758 2.638 -10.609 405 H LYS 52 H LYS 52 5.546 1.279 -8.461 406 HA LYS 52 HA LYS 52 7.727 3.301 -8.546 407 1HB LYS 52 HB2 LYS 52 7.700 0.432 -7.527 408 2HB LYS 52 HB3 LYS 52 9.006 1.593 -7.316 409 1HG LYS 52 HG2 LYS 52 6.243 1.742 -6.044 410 2HG LYS 52 HG3 LYS 52 7.759 1.291 -5.271 411 1HD LYS 52 HD2 LYS 52 8.652 3.588 -5.731 412 2HD LYS 52 HD3 LYS 52 7.034 4.053 -6.335 413 1HE LYS 52 HE2 LYS 52 6.014 3.541 -4.219 414 2HE LYS 52 HE3 LYS 52 7.506 2.827 -3.590 415 1HZ LYS 52 HZ1 LYS 52 7.104 5.027 -2.754 416 2HZ LYS 52 HZ2 LYS 52 8.506 5.013 -3.616 417 3HZ LYS 52 HZ3 LYS 52 7.150 5.693 -4.261 418 H LYS 53 H LYS 53 6.346 1.427 -10.870 419 HA LYS 53 HA LYS 53 8.893 0.980 -12.288 420 1HB LYS 53 HB2 LYS 53 6.779 -1.174 -11.824 421 2HB LYS 53 HB3 LYS 53 8.112 -1.311 -12.969 422 1HG LYS 53 HG2 LYS 53 8.485 -1.048 -9.972 423 2HG LYS 53 HG3 LYS 53 8.482 -2.564 -10.868 424 1HD LYS 53 HD2 LYS 53 10.404 -1.867 -12.214 425 2HD LYS 53 HD3 LYS 53 10.455 -0.292 -11.423 426 1HE LYS 53 HE2 LYS 53 10.817 -2.964 -9.997 427 2HE LYS 53 HE3 LYS 53 12.129 -1.927 -10.552 428 1HZ LYS 53 HZ1 LYS 53 11.711 -1.593 -8.272 429 2HZ LYS 53 HZ2 LYS 53 11.258 -0.193 -9.045 430 3HZ LYS 53 HZ3 LYS 53 10.128 -1.276 -8.484 431 H LYS 54 H LYS 54 8.105 -0.060 -14.576 432 HA LYS 54 HA LYS 54 5.777 1.350 -15.617 433 1HB LYS 54 HB2 LYS 54 7.090 2.554 -17.333 434 2HB LYS 54 HB3 LYS 54 7.447 3.120 -15.704 435 1HG LYS 54 HG2 LYS 54 9.531 1.703 -15.709 436 2HG LYS 54 HG3 LYS 54 9.187 1.273 -17.398 437 1HD LYS 54 HD2 LYS 54 9.318 3.638 -18.045 438 2HD LYS 54 HD3 LYS 54 9.607 4.119 -16.371 439 1HE LYS 54 HE2 LYS 54 11.427 2.281 -18.001 440 2HE LYS 54 HE3 LYS 54 11.663 4.019 -17.814 441 1HZ LYS 54 HZ1 LYS 54 11.808 2.005 -15.632 442 2HZ LYS 54 HZ2 LYS 54 13.024 2.890 -16.253 443 3HZ LYS 54 HZ3 LYS 54 11.861 3.638 -15.396 444 H GLU 55 H GLU 55 5.472 0.704 -17.934 445 HA GLU 55 HA GLU 55 5.553 -2.134 -17.979 446 1HB GLU 55 HB2 GLU 55 4.896 -0.232 -20.271 447 2HB GLU 55 HB3 GLU 55 4.448 -1.942 -20.135 448 1HG GLU 55 HG2 GLU 55 3.236 -1.318 -17.970 449 2HG GLU 55 HG3 GLU 55 3.472 0.373 -18.402 450 H GLY 56 H GLY 56 6.908 -3.547 -18.896 451 1HA GLY 56 HA2 GLY 56 8.508 -4.454 -20.251 452 2HA GLY 56 HA3 GLY 56 8.764 -2.889 -21.035 453 H ASP 57 H ASP 57 9.028 -2.322 -17.687 454 HA ASP 57 HA ASP 57 11.888 -1.979 -17.914 455 1HB ASP 57 HB2 ASP 57 10.164 -0.631 -16.538 456 2HB ASP 57 HB3 ASP 57 10.319 -1.896 -15.320 457 H PHE 58 H PHE 58 13.451 -2.958 -16.376 458 HA PHE 58 HA PHE 58 13.189 -5.875 -16.151 459 1HB PHE 58 HB2 PHE 58 15.359 -4.860 -16.666 460 2HB PHE 58 HB3 PHE 58 15.269 -3.861 -15.223 461 HD1 PHE 58 HD1 PHE 58 15.696 -7.360 -16.451 462 HD2 PHE 58 HD2 PHE 58 15.921 -4.708 -13.053 463 HE1 PHE 58 HE1 PHE 58 16.934 -9.091 -15.181 464 HE2 PHE 58 HE2 PHE 58 17.165 -6.442 -11.789 465 HZ PHE 58 HZ PHE 58 17.703 -8.623 -12.861 466 H VAL 59 H VAL 59 12.856 -7.012 -14.208 467 HA VAL 59 HA VAL 59 12.497 -5.539 -11.698 468 HB VAL 59 HB VAL 59 10.327 -6.871 -11.344 469 1HG1 VAL 59 HG11 VAL 59 10.237 -4.523 -13.271 470 2HG1 VAL 59 HG12 VAL 59 8.935 -5.082 -12.209 471 3HG1 VAL 59 HG13 VAL 59 10.427 -4.434 -11.502 472 1HG2 VAL 59 HG21 VAL 59 8.925 -7.307 -13.279 473 2HG2 VAL 59 HG22 VAL 59 10.216 -6.814 -14.386 474 3HG2 VAL 59 HG23 VAL 59 10.416 -8.270 -13.385 475 H ASN 60 H ASN 60 12.264 -7.065 -9.848 476 HA ASN 60 HA ASN 60 13.480 -9.670 -10.348 477 1HB ASN 60 HB2 ASN 60 15.161 -7.499 -9.923 478 2HB ASN 60 HB3 ASN 60 14.949 -8.133 -8.291 479 1HD2 ASN 60 HD22 ASN 60 15.535 -9.206 -11.689 480 2HD2 ASN 60 HD21 ASN 60 16.641 -10.497 -11.269 481 H GLU 61 H GLU 61 13.876 -10.856 -8.282 482 HA GLU 61 HA GLU 61 11.438 -11.062 -6.821 483 1HB GLU 61 HB2 GLU 61 12.898 -12.955 -7.248 484 2HB GLU 61 HB3 GLU 61 14.238 -12.190 -6.405 485 1HG GLU 61 HG2 GLU 61 12.887 -12.282 -4.274 486 2HG GLU 61 HG3 GLU 61 11.592 -13.082 -5.161 487 H GLY 62 H GLY 62 10.728 -9.544 -5.440 488 1HA GLY 62 HA2 GLY 62 10.708 -8.535 -3.353 489 2HA GLY 62 HA3 GLY 62 12.474 -8.594 -3.260 490 H ASP 63 H ASP 63 11.612 -7.451 -6.392 491 HA ASP 63 HA ASP 63 12.470 -4.753 -5.689 492 1HB ASP 63 HB2 ASP 63 13.058 -6.081 -7.815 493 2HB ASP 63 HB3 ASP 63 11.412 -5.764 -8.356 494 H VAL 64 H VAL 64 11.059 -3.012 -5.362 495 HA VAL 64 HA VAL 64 8.347 -3.701 -4.742 496 HB VAL 64 HB VAL 64 9.580 -0.919 -4.883 497 1HG1 VAL 64 HG11 VAL 64 7.115 -0.888 -4.659 498 2HG1 VAL 64 HG12 VAL 64 7.207 -2.047 -3.325 499 3HG1 VAL 64 HG13 VAL 64 7.864 -0.404 -3.139 500 1HG2 VAL 64 HG21 VAL 64 9.990 -1.209 -2.430 501 2HG2 VAL 64 HG22 VAL 64 9.529 -2.919 -2.574 502 3HG2 VAL 64 HG23 VAL 64 10.977 -2.299 -3.400 503 H LEU 65 H LEU 65 6.430 -3.173 -5.767 504 HA LEU 65 HA LEU 65 6.631 -2.275 -8.604 505 1HB LEU 65 HB2 LEU 65 5.792 -4.569 -8.316 506 2HB LEU 65 HB3 LEU 65 4.582 -4.021 -7.174 507 HG LEU 65 HG LEU 65 3.388 -2.793 -8.915 508 1HD1 LEU 65 HD11 LEU 65 4.049 -2.965 -11.293 509 2HD1 LEU 65 HD12 LEU 65 5.188 -2.007 -10.356 510 3HD1 LEU 65 HD13 LEU 65 5.604 -3.683 -10.797 511 1HD2 LEU 65 HD21 LEU 65 4.192 -5.584 -9.824 512 2HD2 LEU 65 HD22 LEU 65 2.930 -5.205 -8.625 513 3HD2 LEU 65 HD23 LEU 65 2.730 -4.713 -10.316 514 H LEU 66 H LEU 66 4.718 -1.924 -5.513 515 HA LEU 66 HA LEU 66 4.181 0.827 -6.281 516 1HB LEU 66 HB2 LEU 66 1.802 0.777 -6.267 517 2HB LEU 66 HB3 LEU 66 2.377 -0.238 -7.560 518 HG LEU 66 HG LEU 66 1.620 -1.502 -4.896 519 1HD1 LEU 66 HD11 LEU 66 -0.705 -1.683 -5.686 520 2HD1 LEU 66 HD12 LEU 66 -0.232 0.001 -5.406 521 3HD1 LEU 66 HD13 LEU 66 -0.334 -0.623 -7.062 522 1HD2 LEU 66 HD21 LEU 66 2.571 -2.958 -6.651 523 2HD2 LEU 66 HD22 LEU 66 0.864 -3.334 -6.398 524 3HD2 LEU 66 HD23 LEU 66 1.355 -2.380 -7.811 525 H GLU 67 H GLU 67 2.835 1.958 -4.667 526 HA GLU 67 HA GLU 67 3.271 0.981 -1.898 527 1HB GLU 67 HB2 GLU 67 5.047 2.586 -2.657 528 2HB GLU 67 HB3 GLU 67 3.791 3.798 -2.962 529 1HG GLU 67 HG2 GLU 67 3.168 3.639 -0.523 530 2HG GLU 67 HG3 GLU 67 4.523 2.527 -0.293 531 H LEU 68 H LEU 68 1.621 1.771 -0.443 532 HA LEU 68 HA LEU 68 -0.903 2.511 -1.846 533 1HB LEU 68 HB2 LEU 68 -0.523 0.597 0.489 534 2HB LEU 68 HB3 LEU 68 -2.051 1.011 -0.279 535 HG LEU 68 HG LEU 68 0.247 -0.510 -1.586 536 1HD1 LEU 68 HD11 LEU 68 -0.962 -1.816 0.086 537 2HD1 LEU 68 HD12 LEU 68 -2.512 -1.450 -0.711 538 3HD1 LEU 68 HD13 LEU 68 -1.281 -2.424 -1.544 539 1HD2 LEU 68 HD21 LEU 68 -0.904 0.772 -3.287 540 2HD2 LEU 68 HD22 LEU 68 -1.321 -0.928 -3.435 541 3HD2 LEU 68 HD23 LEU 68 -2.492 0.197 -2.712 542 H SER 69 H SER 69 -2.464 3.620 -0.622 543 HA SER 69 HA SER 69 -1.352 5.813 0.698 544 1HB SER 69 HB2 SER 69 -4.259 4.956 0.529 545 2HB SER 69 HB3 SER 69 -3.650 6.604 0.792 546 HG SER 69 HG SER 69 -4.090 6.372 -1.375 547 H ASN 70 H ASN 70 -1.997 2.847 2.273 548 HA ASN 70 HA ASN 70 -1.572 4.176 4.813 549 1HB ASN 70 HB2 ASN 70 -3.442 3.628 5.954 550 2HB ASN 70 HB3 ASN 70 -4.206 3.830 4.391 551 1HD2 ASN 70 HD22 ASN 70 -4.244 1.874 7.029 552 2HD2 ASN 70 HD21 ASN 70 -4.533 0.311 6.290 553 H SER 71 H SER 71 -0.899 2.613 6.487 554 HA SER 71 HA SER 71 1.125 1.060 5.488 555 1HB SER 71 HB2 SER 71 -0.108 0.774 8.248 556 2HB SER 71 HB3 SER 71 1.585 0.534 7.781 557 HG SER 71 HG SER 71 1.234 2.582 8.754 558 H THR 72 H THR 72 -2.063 -0.199 6.702 559 HA THR 72 HA THR 72 -1.352 -2.872 5.624 560 HB THR 72 HB THR 72 -2.376 -2.531 8.461 561 HG1 THR 72 HG1 THR 72 -0.337 -2.582 9.244 562 1HG2 THR 72 HG21 THR 72 -0.808 -4.760 7.072 563 2HG2 THR 72 HG22 THR 72 -1.332 -4.769 8.771 564 3HG2 THR 72 HG23 THR 72 -2.537 -4.793 7.482 565 H GLN 73 H GLN 73 -3.176 -4.149 5.121 566 HA GLN 73 HA GLN 73 -5.662 -2.843 4.582 567 1HB GLN 73 HB2 GLN 73 -4.809 -4.799 3.342 568 2HB GLN 73 HB3 GLN 73 -4.976 -5.813 4.785 569 1HG GLN 73 HG2 GLN 73 -7.424 -5.423 4.758 570 2HG GLN 73 HG3 GLN 73 -7.256 -4.407 3.322 571 1HE2 GLN 73 HE22 GLN 73 -8.862 -6.866 3.577 572 2HE2 GLN 73 HE21 GLN 73 -8.226 -7.977 2.388 Start of MODEL 9 1 1H THR 2 H1 THR 2 3.525 -2.623 1.631 2 2H THR 2 H2 THR 2 3.663 -0.990 1.539 3 3H THR 2 H3 THR 2 2.364 -1.756 0.863 4 HA THR 2 HA THR 2 3.836 -1.129 -0.873 5 HB THR 2 HB THR 2 5.961 -2.672 0.670 6 HG1 THR 2 HG1 THR 2 6.728 -0.679 1.230 7 1HG2 THR 2 HG21 THR 2 6.156 -0.859 -1.782 8 2HG2 THR 2 HG22 THR 2 7.536 -1.518 -0.878 9 3HG2 THR 2 HG23 THR 2 6.460 -2.616 -1.745 10 H VAL 3 H VAL 3 4.063 -2.479 -2.767 11 HA VAL 3 HA VAL 3 3.634 -5.397 -2.383 12 HB VAL 3 HB VAL 3 2.338 -3.686 -4.533 13 1HG1 VAL 3 HG11 VAL 3 1.062 -5.745 -5.084 14 2HG1 VAL 3 HG12 VAL 3 2.791 -5.989 -5.299 15 3HG1 VAL 3 HG13 VAL 3 1.987 -6.636 -3.851 16 1HG2 VAL 3 HG21 VAL 3 0.150 -4.278 -3.497 17 2HG2 VAL 3 HG22 VAL 3 1.026 -4.958 -2.104 18 3HG2 VAL 3 HG23 VAL 3 1.140 -3.222 -2.485 19 H SER 4 H SER 4 4.840 -6.617 -3.882 20 HA SER 4 HA SER 4 6.901 -5.234 -5.509 21 1HB SER 4 HB2 SER 4 7.401 -7.286 -3.315 22 2HB SER 4 HB3 SER 4 8.631 -6.511 -4.320 23 HG SER 4 HG SER 4 8.393 -5.552 -2.220 24 H ILE 5 H ILE 5 8.194 -6.823 -6.711 25 HA ILE 5 HA ILE 5 6.581 -9.042 -7.809 26 HB ILE 5 HB ILE 5 9.260 -7.807 -8.603 27 1HG1 ILE 5 HG12 ILE 5 7.453 -6.205 -8.993 28 2HG1 ILE 5 HG13 ILE 5 8.076 -6.817 -10.503 29 1HG2 ILE 5 HG21 ILE 5 8.916 -9.020 -10.781 30 2HG2 ILE 5 HG22 ILE 5 9.241 -10.052 -9.404 31 3HG2 ILE 5 HG23 ILE 5 7.581 -9.914 -10.029 32 1HD1 ILE 5 HD11 ILE 5 5.493 -7.763 -9.213 33 2HD1 ILE 5 HD12 ILE 5 5.635 -6.628 -10.560 34 3HD1 ILE 5 HD13 ILE 5 6.136 -8.302 -10.784 35 H GLN 6 H GLN 6 7.606 -11.191 -7.945 36 HA GLN 6 HA GLN 6 9.515 -11.816 -5.762 37 1HB GLN 6 HB2 GLN 6 8.012 -13.717 -5.097 38 2HB GLN 6 HB3 GLN 6 7.503 -12.116 -4.636 39 1HG GLN 6 HG2 GLN 6 6.383 -13.375 -7.166 40 2HG GLN 6 HG3 GLN 6 5.767 -13.838 -5.587 41 1HE2 GLN 6 HE22 GLN 6 5.128 -11.689 -8.095 42 2HE2 GLN 6 HE21 GLN 6 4.377 -10.411 -7.158 43 H MET 7 H MET 7 9.768 -11.692 -8.735 44 HA MET 7 HA MET 7 11.201 -14.168 -9.067 45 1HB MET 7 HB2 MET 7 10.132 -14.742 -11.226 46 2HB MET 7 HB3 MET 7 9.046 -14.996 -9.871 47 1HG MET 7 HG2 MET 7 8.971 -12.490 -11.590 48 2HG MET 7 HG3 MET 7 8.101 -13.957 -11.995 49 1HE MET 7 HE1 MET 7 5.644 -13.605 -11.933 50 2HE MET 7 HE2 MET 7 6.020 -14.908 -10.778 51 3HE MET 7 HE3 MET 7 4.821 -13.660 -10.364 52 H ALA 8 H ALA 8 12.658 -13.947 -10.962 53 HA ALA 8 HA ALA 8 13.277 -11.138 -11.629 54 1HB ALA 8 HB1 ALA 8 15.098 -12.700 -11.085 55 2HB ALA 8 HB2 ALA 8 14.611 -13.743 -12.449 56 3HB ALA 8 HB3 ALA 8 15.218 -12.099 -12.757 57 H GLY 9 H GLY 9 12.801 -10.141 -13.575 58 1HA GLY 9 HA2 GLY 9 12.516 -11.465 -16.037 59 2HA GLY 9 HA3 GLY 9 10.901 -11.346 -15.348 60 H ASN 10 H ASN 10 10.210 -9.907 -16.982 61 HA ASN 10 HA ASN 10 11.089 -7.074 -16.616 62 1HB ASN 10 HB2 ASN 10 10.842 -8.634 -19.202 63 2HB ASN 10 HB3 ASN 10 10.323 -6.953 -19.157 64 1HD2 ASN 10 HD22 ASN 10 13.136 -8.014 -17.164 65 2HD2 ASN 10 HD21 ASN 10 14.311 -7.217 -18.186 66 H LEU 11 H LEU 11 9.345 -5.698 -16.503 67 HA LEU 11 HA LEU 11 6.908 -7.026 -15.699 68 1HB LEU 11 HB2 LEU 11 8.176 -5.197 -14.478 69 2HB LEU 11 HB3 LEU 11 7.588 -4.069 -15.685 70 HG LEU 11 HG LEU 11 5.229 -4.682 -15.034 71 1HD1 LEU 11 HD11 LEU 11 6.624 -6.343 -12.885 72 2HD1 LEU 11 HD12 LEU 11 4.923 -5.844 -12.813 73 3HD1 LEU 11 HD13 LEU 11 5.459 -6.921 -14.096 74 1HD2 LEU 11 HD21 LEU 11 7.064 -3.782 -12.765 75 2HD2 LEU 11 HD22 LEU 11 6.438 -2.758 -14.082 76 3HD2 LEU 11 HD23 LEU 11 5.326 -3.451 -12.902 77 H TRP 12 H TRP 12 6.451 -7.770 -17.884 78 HA TRP 12 HA TRP 12 6.093 -6.778 -20.238 79 1HB TRP 12 HB2 TRP 12 5.285 -9.007 -19.311 80 2HB TRP 12 HB3 TRP 12 3.767 -8.220 -18.932 81 HD1 TRP 12 HD1 TRP 12 6.002 -9.007 -21.921 82 HE1 TRP 12 HE1 TRP 12 4.609 -9.352 -24.034 83 HE3 TRP 12 HE3 TRP 12 1.401 -7.861 -20.022 84 HZ2 TRP 12 HZ2 TRP 12 1.813 -9.208 -24.792 85 HZ3 TRP 12 HZ3 TRP 12 -0.619 -8.007 -21.447 86 HH2 TRP 12 HH2 TRP 12 -0.427 -8.673 -23.833 87 H LYS 13 H LYS 13 3.348 -6.255 -17.927 88 HA LYS 13 HA LYS 13 2.994 -3.561 -18.970 89 1HB LYS 13 HB2 LYS 13 0.819 -5.689 -19.228 90 2HB LYS 13 HB3 LYS 13 0.450 -3.967 -19.132 91 1HG LYS 13 HG2 LYS 13 2.035 -3.599 -21.076 92 2HG LYS 13 HG3 LYS 13 2.087 -5.349 -21.288 93 1HD LYS 13 HD2 LYS 13 -0.273 -5.453 -21.758 94 2HD LYS 13 HD3 LYS 13 -0.518 -3.755 -21.325 95 1HE LYS 13 HE2 LYS 13 1.400 -4.609 -23.530 96 2HE LYS 13 HE3 LYS 13 -0.321 -4.363 -23.846 97 1HZ LYS 13 HZ1 LYS 13 1.080 -2.380 -24.270 98 2HZ LYS 13 HZ2 LYS 13 -0.133 -2.094 -23.226 99 3HZ LYS 13 HZ3 LYS 13 1.392 -2.232 -22.663 100 H VAL 14 H VAL 14 1.437 -2.335 -17.577 101 HA VAL 14 HA VAL 14 0.956 -3.463 -14.895 102 HB VAL 14 HB VAL 14 2.231 -0.729 -15.394 103 1HG1 VAL 14 HG11 VAL 14 0.824 -0.684 -13.392 104 2HG1 VAL 14 HG12 VAL 14 1.539 -2.205 -12.803 105 3HG1 VAL 14 HG13 VAL 14 2.511 -0.730 -12.892 106 1HG2 VAL 14 HG21 VAL 14 4.207 -1.659 -14.192 107 2HG2 VAL 14 HG22 VAL 14 3.444 -3.270 -14.261 108 3HG2 VAL 14 HG23 VAL 14 3.944 -2.435 -15.750 109 H HIS 15 H HIS 15 -0.961 -2.597 -14.015 110 HA HIS 15 HA HIS 15 -2.631 -1.057 -15.963 111 1HB HIS 15 HB2 HIS 15 -3.692 -3.104 -14.028 112 2HB HIS 15 HB3 HIS 15 -4.397 -2.536 -15.537 113 HD1 HIS 15 HD1 HIS 15 -2.211 -3.276 -17.660 114 HD2 HIS 15 HD2 HIS 15 -3.009 -5.544 -14.211 115 HE1 HIS 15 HE1 HIS 15 -1.166 -5.579 -18.043 116 H VAL 16 H VAL 16 -1.646 -1.385 -12.582 117 HA VAL 16 HA VAL 16 -3.645 0.384 -11.492 118 HB VAL 16 HB VAL 16 -2.010 0.590 -9.604 119 1HG1 VAL 16 HG11 VAL 16 -3.784 -1.099 -9.607 120 2HG1 VAL 16 HG12 VAL 16 -2.719 -2.242 -10.444 121 3HG1 VAL 16 HG13 VAL 16 -2.327 -1.687 -8.797 122 1HG2 VAL 16 HG21 VAL 16 -0.059 -0.798 -9.472 123 2HG2 VAL 16 HG22 VAL 16 -0.352 -1.488 -11.081 124 3HG2 VAL 16 HG23 VAL 16 0.083 0.225 -10.902 125 H LYS 17 H LYS 17 -3.236 2.503 -10.638 126 HA LYS 17 HA LYS 17 -1.121 4.146 -11.716 127 1HB LYS 17 HB2 LYS 17 -2.734 5.770 -12.762 128 2HB LYS 17 HB3 LYS 17 -2.557 4.247 -13.622 129 1HG LYS 17 HG2 LYS 17 -4.729 3.458 -12.496 130 2HG LYS 17 HG3 LYS 17 -4.891 5.090 -11.850 131 1HD LYS 17 HD2 LYS 17 -6.258 4.881 -13.830 132 2HD LYS 17 HD3 LYS 17 -4.929 5.980 -14.170 133 1HE LYS 17 HE2 LYS 17 -5.285 4.565 -16.085 134 2HE LYS 17 HE3 LYS 17 -3.720 4.170 -15.384 135 1HZ LYS 17 HZ1 LYS 17 -6.194 2.592 -14.917 136 2HZ LYS 17 HZ2 LYS 17 -5.078 2.231 -16.040 137 3HZ LYS 17 HZ3 LYS 17 -4.672 2.146 -14.475 138 H ALA 18 H ALA 18 -1.194 6.278 -10.540 139 HA ALA 18 HA ALA 18 -1.797 5.950 -7.800 140 1HB ALA 18 HB1 ALA 18 -0.153 7.587 -8.630 141 2HB ALA 18 HB2 ALA 18 -1.460 8.536 -9.383 142 3HB ALA 18 HB3 ALA 18 -1.378 8.373 -7.617 143 H GLY 19 H GLY 19 -3.627 6.197 -6.607 144 1HA GLY 19 HA2 GLY 19 -5.694 7.037 -5.997 145 2HA GLY 19 HA3 GLY 19 -5.908 7.775 -7.589 146 H ASP 20 H ASP 20 -4.949 4.691 -8.397 147 HA ASP 20 HA ASP 20 -7.627 3.675 -8.849 148 1HB ASP 20 HB2 ASP 20 -5.563 3.118 -10.253 149 2HB ASP 20 HB3 ASP 20 -4.994 2.158 -8.898 150 H GLN 21 H GLN 21 -8.205 1.432 -7.946 151 HA GLN 21 HA GLN 21 -7.428 1.165 -5.076 152 1HB GLN 21 HB2 GLN 21 -9.601 2.228 -5.181 153 2HB GLN 21 HB3 GLN 21 -10.212 1.024 -6.305 154 1HG GLN 21 HG2 GLN 21 -9.150 0.074 -3.633 155 2HG GLN 21 HG3 GLN 21 -10.676 0.941 -3.649 156 1HE2 GLN 21 HE22 GLN 21 -9.541 -2.156 -3.575 157 2HE2 GLN 21 HE21 GLN 21 -10.856 -2.943 -4.417 158 H ILE 22 H ILE 22 -7.041 -0.883 -4.421 159 HA ILE 22 HA ILE 22 -7.493 -3.094 -6.332 160 HB ILE 22 HB ILE 22 -5.324 -3.978 -5.983 161 1HG1 ILE 22 HG12 ILE 22 -4.844 -1.701 -4.024 162 2HG1 ILE 22 HG13 ILE 22 -4.878 -3.435 -3.688 163 1HG2 ILE 22 HG21 ILE 22 -5.617 -2.222 -7.757 164 2HG2 ILE 22 HG22 ILE 22 -4.918 -1.033 -6.639 165 3HG2 ILE 22 HG23 ILE 22 -3.957 -2.412 -7.200 166 1HD1 ILE 22 HD11 ILE 22 -2.832 -3.638 -5.224 167 2HD1 ILE 22 HD12 ILE 22 -2.771 -1.865 -5.181 168 3HD1 ILE 22 HD13 ILE 22 -2.605 -2.800 -3.681 169 H GLU 23 H GLU 23 -7.462 -5.187 -5.301 170 HA GLU 23 HA GLU 23 -8.060 -5.242 -2.421 171 1HB GLU 23 HB2 GLU 23 -10.200 -5.068 -3.575 172 2HB GLU 23 HB3 GLU 23 -9.774 -6.421 -4.641 173 1HG GLU 23 HG2 GLU 23 -9.719 -7.942 -2.687 174 2HG GLU 23 HG3 GLU 23 -10.048 -6.586 -1.605 175 H LYS 24 H LYS 24 -7.321 -7.268 -1.527 176 HA LYS 24 HA LYS 24 -5.049 -8.404 -2.607 177 1HB LYS 24 HB2 LYS 24 -5.908 -8.640 -0.264 178 2HB LYS 24 HB3 LYS 24 -7.088 -9.827 -0.835 179 1HG LYS 24 HG2 LYS 24 -5.218 -11.294 -1.606 180 2HG LYS 24 HG3 LYS 24 -4.057 -10.084 -1.048 181 1HD LYS 24 HD2 LYS 24 -5.050 -10.355 1.300 182 2HD LYS 24 HD3 LYS 24 -6.050 -11.654 0.642 183 1HE LYS 24 HE2 LYS 24 -4.268 -12.835 1.557 184 2HE LYS 24 HE3 LYS 24 -3.837 -12.741 -0.152 185 1HZ LYS 24 HZ1 LYS 24 -2.405 -10.793 0.478 186 2HZ LYS 24 HZ2 LYS 24 -2.750 -11.080 2.048 187 3HZ LYS 24 HZ3 LYS 24 -1.942 -12.199 1.185 188 H GLY 25 H GLY 25 -4.628 -9.622 -4.379 189 1HA GLY 25 HA2 GLY 25 -4.831 -11.488 -5.749 190 2HA GLY 25 HA3 GLY 25 -6.496 -11.739 -5.225 191 H GLN 26 H GLN 26 -6.544 -8.495 -5.961 192 HA GLN 26 HA GLN 26 -7.691 -8.796 -8.593 193 1HB GLN 26 HB2 GLN 26 -8.219 -6.993 -6.903 194 2HB GLN 26 HB3 GLN 26 -6.607 -6.314 -7.183 195 1HG GLN 26 HG2 GLN 26 -7.227 -5.951 -9.583 196 2HG GLN 26 HG3 GLN 26 -8.841 -6.583 -9.246 197 1HE2 GLN 26 HE22 GLN 26 -7.085 -3.725 -9.518 198 2HE2 GLN 26 HE21 GLN 26 -8.050 -2.683 -8.483 199 H GLU 27 H GLU 27 -6.669 -8.405 -10.601 200 HA GLU 27 HA GLU 27 -3.825 -8.822 -10.787 201 1HB GLU 27 HB2 GLU 27 -5.562 -9.534 -12.456 202 2HB GLU 27 HB3 GLU 27 -5.798 -7.837 -12.892 203 1HG GLU 27 HG2 GLU 27 -3.428 -7.711 -13.633 204 2HG GLU 27 HG3 GLU 27 -3.170 -9.379 -13.115 205 H VAL 28 H VAL 28 -2.217 -7.378 -11.309 206 HA VAL 28 HA VAL 28 -2.773 -4.455 -11.071 207 HB VAL 28 HB VAL 28 -0.950 -6.284 -9.467 208 1HG1 VAL 28 HG11 VAL 28 0.490 -4.385 -10.172 209 2HG1 VAL 28 HG12 VAL 28 -0.690 -3.262 -9.481 210 3HG1 VAL 28 HG13 VAL 28 0.163 -4.414 -8.438 211 1HG2 VAL 28 HG21 VAL 28 -3.184 -5.874 -8.534 212 2HG2 VAL 28 HG22 VAL 28 -1.963 -5.055 -7.549 213 3HG2 VAL 28 HG23 VAL 28 -2.963 -4.128 -8.683 214 H ALA 29 H ALA 29 -0.584 -7.098 -12.202 215 HA ALA 29 HA ALA 29 0.279 -5.473 -14.454 216 1HB ALA 29 HB1 ALA 29 2.257 -6.288 -12.253 217 2HB ALA 29 HB2 ALA 29 2.711 -5.659 -13.843 218 3HB ALA 29 HB3 ALA 29 1.824 -4.636 -12.710 219 H ILE 30 H ILE 30 2.161 -6.863 -15.539 220 HA ILE 30 HA ILE 30 1.704 -9.770 -15.237 221 HB ILE 30 HB ILE 30 1.515 -8.172 -17.822 222 1HG1 ILE 30 HG12 ILE 30 -0.436 -10.168 -16.574 223 2HG1 ILE 30 HG13 ILE 30 -0.595 -8.420 -16.483 224 1HG2 ILE 30 HG21 ILE 30 1.650 -11.214 -17.525 225 2HG2 ILE 30 HG22 ILE 30 1.421 -10.324 -19.046 226 3HG2 ILE 30 HG23 ILE 30 2.943 -10.204 -18.201 227 1HD1 ILE 30 HD11 ILE 30 -0.788 -8.280 -18.946 228 2HD1 ILE 30 HD12 ILE 30 -0.789 -10.063 -19.022 229 3HD1 ILE 30 HD13 ILE 30 -2.080 -9.208 -18.170 230 H LEU 31 H LEU 31 3.580 -10.888 -15.593 231 HA LEU 31 HA LEU 31 6.126 -9.354 -15.905 232 1HB LEU 31 HB2 LEU 31 5.754 -10.033 -13.647 233 2HB LEU 31 HB3 LEU 31 5.277 -11.675 -14.107 234 HG LEU 31 HG LEU 31 7.452 -11.328 -12.947 235 1HD1 LEU 31 HD11 LEU 31 7.674 -12.785 -15.601 236 2HD1 LEU 31 HD12 LEU 31 8.683 -13.014 -14.162 237 3HD1 LEU 31 HD13 LEU 31 6.960 -13.416 -14.108 238 1HD2 LEU 31 HD21 LEU 31 8.610 -10.462 -15.586 239 2HD2 LEU 31 HD22 LEU 31 8.091 -9.301 -14.349 240 3HD2 LEU 31 HD23 LEU 31 9.353 -10.485 -13.971 241 H GLU 32 H GLU 32 7.460 -10.131 -17.502 242 HA GLU 32 HA GLU 32 6.728 -12.649 -18.917 243 1HB GLU 32 HB2 GLU 32 6.687 -10.630 -20.328 244 2HB GLU 32 HB3 GLU 32 8.330 -10.216 -19.821 245 1HG GLU 32 HG2 GLU 32 9.119 -12.398 -20.831 246 2HG GLU 32 HG3 GLU 32 7.476 -12.685 -21.399 247 H SER 33 H SER 33 8.119 -14.318 -18.563 248 HA SER 33 HA SER 33 10.933 -14.036 -18.326 249 1HB SER 33 HB2 SER 33 10.130 -13.311 -15.960 250 2HB SER 33 HB3 SER 33 9.614 -14.986 -15.741 251 HG SER 33 HG SER 33 11.820 -14.227 -15.086 252 H MET 34 H MET 34 11.834 -16.333 -17.777 253 HA MET 34 HA MET 34 11.971 -18.462 -18.582 254 1HB MET 34 HB2 MET 34 10.567 -20.014 -17.256 255 2HB MET 34 HB3 MET 34 11.376 -18.761 -16.327 256 1HG MET 34 HG2 MET 34 9.271 -17.475 -16.194 257 2HG MET 34 HG3 MET 34 8.431 -18.748 -17.085 258 1HE MET 34 HE1 MET 34 7.197 -18.650 -13.261 259 2HE MET 34 HE2 MET 34 7.836 -17.277 -14.186 260 3HE MET 34 HE3 MET 34 6.695 -18.409 -14.947 261 H LYS 35 H LYS 35 10.907 -16.995 -20.593 262 HA LYS 35 HA LYS 35 9.778 -17.008 -22.529 263 1HB LYS 35 HB2 LYS 35 9.962 -20.032 -22.259 264 2HB LYS 35 HB3 LYS 35 9.644 -19.132 -23.745 265 1HG LYS 35 HG2 LYS 35 11.857 -18.009 -23.546 266 2HG LYS 35 HG3 LYS 35 12.207 -18.980 -22.102 267 1HD LYS 35 HD2 LYS 35 11.979 -21.058 -23.435 268 2HD LYS 35 HD3 LYS 35 11.639 -20.087 -24.886 269 1HE LYS 35 HE2 LYS 35 13.857 -18.987 -24.662 270 2HE LYS 35 HE3 LYS 35 14.196 -19.954 -23.222 271 1HZ LYS 35 HZ1 LYS 35 15.209 -20.912 -25.188 272 2HZ LYS 35 HZ2 LYS 35 14.088 -21.941 -24.612 273 3HZ LYS 35 HZ3 LYS 35 13.775 -21.046 -25.944 274 H MET 36 H MET 36 8.086 -16.731 -20.204 275 HA MET 36 HA MET 36 5.479 -17.423 -21.403 276 1HB MET 36 HB2 MET 36 6.388 -18.054 -18.549 277 2HB MET 36 HB3 MET 36 4.702 -18.059 -19.071 278 1HG MET 36 HG2 MET 36 5.202 -19.837 -20.712 279 2HG MET 36 HG3 MET 36 6.876 -19.878 -20.149 280 1HE MET 36 HE1 MET 36 6.794 -22.446 -19.744 281 2HE MET 36 HE2 MET 36 5.522 -23.268 -18.814 282 3HE MET 36 HE3 MET 36 5.121 -22.469 -20.350 283 H GLU 37 H GLU 37 3.749 -16.247 -20.069 284 HA GLU 37 HA GLU 37 4.719 -13.724 -18.862 285 1HB GLU 37 HB2 GLU 37 2.212 -14.009 -20.572 286 2HB GLU 37 HB3 GLU 37 2.707 -12.600 -19.645 287 1HG GLU 37 HG2 GLU 37 3.360 -12.015 -21.780 288 2HG GLU 37 HG3 GLU 37 4.861 -12.575 -21.060 289 H ILE 38 H ILE 38 3.728 -13.319 -16.904 290 HA ILE 38 HA ILE 38 1.864 -15.369 -15.828 291 HB ILE 38 HB ILE 38 4.395 -14.273 -14.497 292 1HG1 ILE 38 HG12 ILE 38 4.903 -16.927 -14.634 293 2HG1 ILE 38 HG13 ILE 38 3.948 -16.800 -16.096 294 1HG2 ILE 38 HG21 ILE 38 2.599 -14.873 -12.903 295 2HG2 ILE 38 HG22 ILE 38 2.495 -16.495 -13.625 296 3HG2 ILE 38 HG23 ILE 38 3.966 -15.973 -12.776 297 1HD1 ILE 38 HD11 ILE 38 6.331 -16.594 -16.598 298 2HD1 ILE 38 HD12 ILE 38 5.598 -15.013 -16.897 299 3HD1 ILE 38 HD13 ILE 38 6.519 -15.298 -15.410 300 HA PRO 39 HA PRO 39 -0.017 -11.462 -14.585 301 1HB PRO 39 HB2 PRO 39 -1.936 -12.340 -12.830 302 2HB PRO 39 HB3 PRO 39 -2.066 -12.530 -14.607 303 1HG PRO 39 HG2 PRO 39 -1.112 -14.572 -12.579 304 2HG PRO 39 HG3 PRO 39 -2.287 -14.802 -13.915 305 1HD PRO 39 HD2 PRO 39 0.337 -15.505 -14.150 306 2HD PRO 39 HD3 PRO 39 -0.571 -14.834 -15.537 307 H ILE 40 H ILE 40 0.057 -10.040 -12.839 308 HA ILE 40 HA ILE 40 1.322 -10.936 -10.292 309 HB ILE 40 HB ILE 40 1.767 -8.416 -11.918 310 1HG1 ILE 40 HG12 ILE 40 3.071 -10.274 -12.824 311 2HG1 ILE 40 HG13 ILE 40 4.064 -8.987 -12.170 312 1HG2 ILE 40 HG21 ILE 40 1.718 -7.778 -9.588 313 2HG2 ILE 40 HG22 ILE 40 2.852 -9.076 -9.160 314 3HG2 ILE 40 HG23 ILE 40 3.366 -7.720 -10.194 315 1HD1 ILE 40 HD11 ILE 40 3.478 -11.618 -10.738 316 2HD1 ILE 40 HD12 ILE 40 4.958 -11.210 -11.622 317 3HD1 ILE 40 HD13 ILE 40 4.550 -10.321 -10.153 318 H VAL 41 H VAL 41 0.222 -10.236 -8.530 319 HA VAL 41 HA VAL 41 -2.281 -8.697 -8.966 320 HB VAL 41 HB VAL 41 -3.245 -10.288 -7.230 321 1HG1 VAL 41 HG11 VAL 41 -2.456 -11.456 -9.928 322 2HG1 VAL 41 HG12 VAL 41 -3.683 -12.127 -8.828 323 3HG1 VAL 41 HG13 VAL 41 -3.924 -10.533 -9.518 324 1HG2 VAL 41 HG21 VAL 41 -1.074 -11.242 -6.412 325 2HG2 VAL 41 HG22 VAL 41 -2.261 -12.461 -6.894 326 3HG2 VAL 41 HG23 VAL 41 -0.905 -12.091 -7.971 327 H ALA 42 H ALA 42 -3.189 -7.787 -7.051 328 HA ALA 42 HA ALA 42 -1.434 -6.333 -5.344 329 1HB ALA 42 HB1 ALA 42 -3.574 -5.758 -4.227 330 2HB ALA 42 HB2 ALA 42 -3.747 -5.658 -5.990 331 3HB ALA 42 HB3 ALA 42 -4.391 -7.054 -5.117 332 H ASP 43 H ASP 43 -0.217 -7.275 -3.760 333 HA ASP 43 HA ASP 43 -0.780 -9.809 -2.536 334 1HB ASP 43 HB2 ASP 43 1.481 -8.849 -2.658 335 2HB ASP 43 HB3 ASP 43 0.983 -7.498 -1.634 336 H ARG 44 H ARG 44 -1.995 -6.593 -1.925 337 HA ARG 44 HA ARG 44 -3.768 -7.555 0.159 338 1HB ARG 44 HB2 ARG 44 -3.155 -5.704 1.723 339 2HB ARG 44 HB3 ARG 44 -1.924 -6.952 1.613 340 1HG ARG 44 HG2 ARG 44 -0.414 -5.605 0.435 341 2HG ARG 44 HG3 ARG 44 -1.659 -4.512 -0.169 342 1HD ARG 44 HD2 ARG 44 -0.878 -4.677 2.755 343 2HD ARG 44 HD3 ARG 44 -0.181 -3.533 1.586 344 HE ARG 44 HE ARG 44 -2.948 -3.268 1.318 345 1HH1 ARG 44 HH21 ARG 44 -0.636 -2.692 3.958 346 2HH1 ARG 44 HH22 ARG 44 -1.603 -1.469 4.697 347 1HH2 ARG 44 HH11 ARG 44 -4.197 -1.757 2.253 348 2HH2 ARG 44 HH12 ARG 44 -3.720 -0.906 3.696 349 H SER 45 H SER 45 -5.456 -5.897 0.582 350 HA SER 45 HA SER 45 -6.181 -4.381 -1.743 351 1HB SER 45 HB2 SER 45 -7.303 -4.291 1.083 352 2HB SER 45 HB3 SER 45 -8.162 -3.893 -0.418 353 HG SER 45 HG SER 45 -8.569 -6.044 0.476 354 H GLY 46 H GLY 46 -6.603 -2.024 -1.780 355 1HA GLY 46 HA2 GLY 46 -6.234 -0.181 0.180 356 2HA GLY 46 HA3 GLY 46 -4.584 -0.416 -0.409 357 H ILE 47 H ILE 47 -5.143 1.983 -0.778 358 HA ILE 47 HA ILE 47 -6.166 2.424 -3.546 359 HB ILE 47 HB ILE 47 -5.444 4.361 -1.295 360 1HG1 ILE 47 HG12 ILE 47 -7.591 3.313 -0.838 361 2HG1 ILE 47 HG13 ILE 47 -7.810 4.997 -1.275 362 1HG2 ILE 47 HG21 ILE 47 -6.374 4.955 -4.135 363 2HG2 ILE 47 HG22 ILE 47 -6.365 6.141 -2.811 364 3HG2 ILE 47 HG23 ILE 47 -4.849 5.434 -3.367 365 1HD1 ILE 47 HD11 ILE 47 -9.545 3.640 -2.312 366 2HD1 ILE 47 HD12 ILE 47 -8.500 4.289 -3.588 367 3HD1 ILE 47 HD13 ILE 47 -8.339 2.594 -3.074 368 H VAL 48 H VAL 48 -4.651 2.934 -5.090 369 HA VAL 48 HA VAL 48 -1.856 2.325 -4.598 370 HB VAL 48 HB VAL 48 -3.306 3.496 -6.993 371 1HG1 VAL 48 HG11 VAL 48 -1.333 2.691 -8.280 372 2HG1 VAL 48 HG12 VAL 48 -0.884 3.957 -7.134 373 3HG1 VAL 48 HG13 VAL 48 -0.513 2.268 -6.762 374 1HG2 VAL 48 HG21 VAL 48 -3.170 1.178 -7.875 375 2HG2 VAL 48 HG22 VAL 48 -2.529 0.624 -6.312 376 3HG2 VAL 48 HG23 VAL 48 -4.172 1.271 -6.442 377 H LYS 49 H LYS 49 -0.751 3.764 -3.285 378 HA LYS 49 HA LYS 49 -1.255 6.635 -3.343 379 1HB LYS 49 HB2 LYS 49 -0.369 5.444 -1.334 380 2HB LYS 49 HB3 LYS 49 1.123 5.081 -2.215 381 1HG LYS 49 HG2 LYS 49 1.521 7.544 -2.477 382 2HG LYS 49 HG3 LYS 49 0.046 7.848 -1.536 383 1HD LYS 49 HD2 LYS 49 1.079 6.600 0.397 384 2HD LYS 49 HD3 LYS 49 2.523 6.342 -0.582 385 1HE LYS 49 HE2 LYS 49 2.985 8.167 0.881 386 2HE LYS 49 HE3 LYS 49 2.856 8.804 -0.759 387 1HZ LYS 49 HZ1 LYS 49 0.619 9.579 -0.204 388 2HZ LYS 49 HZ2 LYS 49 0.730 8.953 1.307 389 3HZ LYS 49 HZ3 LYS 49 1.695 10.182 0.856 390 H GLU 50 H GLU 50 1.345 4.399 -4.597 391 HA GLU 50 HA GLU 50 1.675 6.136 -6.923 392 1HB GLU 50 HB2 GLU 50 2.987 7.326 -5.142 393 2HB GLU 50 HB3 GLU 50 3.971 5.878 -4.916 394 1HG GLU 50 HG2 GLU 50 4.849 6.058 -7.170 395 2HG GLU 50 HG3 GLU 50 3.684 7.320 -7.588 396 H VAL 51 H VAL 51 2.468 4.935 -8.634 397 HA VAL 51 HA VAL 51 3.201 2.112 -8.152 398 HB VAL 51 HB VAL 51 2.888 3.584 -10.805 399 1HG1 VAL 51 HG11 VAL 51 4.057 1.397 -10.953 400 2HG1 VAL 51 HG12 VAL 51 2.717 0.612 -10.088 401 3HG1 VAL 51 HG13 VAL 51 2.459 1.316 -11.696 402 1HG2 VAL 51 HG21 VAL 51 0.770 2.039 -9.248 403 2HG2 VAL 51 HG22 VAL 51 0.727 3.774 -9.639 404 3HG2 VAL 51 HG23 VAL 51 0.615 2.589 -10.933 405 H LYS 52 H LYS 52 5.310 1.351 -8.546 406 HA LYS 52 HA LYS 52 7.382 3.510 -8.644 407 1HB LYS 52 HB2 LYS 52 7.437 0.778 -7.312 408 2HB LYS 52 HB3 LYS 52 8.702 1.997 -7.206 409 1HG LYS 52 HG2 LYS 52 5.880 2.317 -6.091 410 2HG LYS 52 HG3 LYS 52 7.296 1.827 -5.176 411 1HD LYS 52 HD2 LYS 52 8.368 4.014 -5.633 412 2HD LYS 52 HD3 LYS 52 6.905 4.536 -6.519 413 1HE LYS 52 HE2 LYS 52 5.526 4.206 -4.543 414 2HE LYS 52 HE3 LYS 52 6.883 3.507 -3.651 415 1HZ LYS 52 HZ1 LYS 52 6.729 6.327 -4.551 416 2HZ LYS 52 HZ2 LYS 52 6.453 5.768 -3.023 417 3HZ LYS 52 HZ3 LYS 52 7.957 5.659 -3.681 418 H LYS 53 H LYS 53 6.126 1.537 -10.824 419 HA LYS 53 HA LYS 53 8.651 0.898 -12.194 420 1HB LYS 53 HB2 LYS 53 6.457 -1.110 -11.474 421 2HB LYS 53 HB3 LYS 53 7.652 -1.397 -12.731 422 1HG LYS 53 HG2 LYS 53 8.399 -0.959 -9.819 423 2HG LYS 53 HG3 LYS 53 8.157 -2.538 -10.581 424 1HD LYS 53 HD2 LYS 53 9.896 -2.027 -12.254 425 2HD LYS 53 HD3 LYS 53 10.200 -0.461 -11.476 426 1HE LYS 53 HE2 LYS 53 10.987 -1.553 -9.446 427 2HE LYS 53 HE3 LYS 53 10.541 -3.138 -10.052 428 1HZ LYS 53 HZ1 LYS 53 12.632 -1.373 -11.184 429 2HZ LYS 53 HZ2 LYS 53 12.827 -2.841 -10.430 430 3HZ LYS 53 HZ3 LYS 53 12.143 -2.755 -11.909 431 H LYS 54 H LYS 54 7.844 -0.156 -14.462 432 HA LYS 54 HA LYS 54 5.405 1.117 -15.439 433 1HB LYS 54 HB2 LYS 54 6.470 2.335 -17.225 434 2HB LYS 54 HB3 LYS 54 7.136 2.915 -15.702 435 1HG LYS 54 HG2 LYS 54 9.207 1.674 -16.052 436 2HG LYS 54 HG3 LYS 54 8.524 0.818 -17.431 437 1HD LYS 54 HD2 LYS 54 8.234 3.199 -18.505 438 2HD LYS 54 HD3 LYS 54 9.374 3.706 -17.252 439 1HE LYS 54 HE2 LYS 54 10.724 3.195 -19.135 440 2HE LYS 54 HE3 LYS 54 10.908 1.811 -18.053 441 1HZ LYS 54 HZ1 LYS 54 9.189 0.663 -19.463 442 2HZ LYS 54 HZ2 LYS 54 9.200 1.946 -20.473 443 3HZ LYS 54 HZ3 LYS 54 10.548 1.056 -20.293 444 H GLU 55 H GLU 55 5.190 0.502 -17.848 445 HA GLU 55 HA GLU 55 5.321 -2.303 -18.207 446 1HB GLU 55 HB2 GLU 55 5.281 -0.124 -20.352 447 2HB GLU 55 HB3 GLU 55 4.794 -1.805 -20.559 448 1HG GLU 55 HG2 GLU 55 2.883 -1.430 -19.003 449 2HG GLU 55 HG3 GLU 55 3.387 0.241 -18.787 450 H GLY 56 H GLY 56 6.879 -3.622 -18.920 451 1HA GLY 56 HA2 GLY 56 8.693 -4.434 -20.009 452 2HA GLY 56 HA3 GLY 56 8.892 -2.868 -20.810 453 H ASP 57 H ASP 57 8.943 -2.309 -17.418 454 HA ASP 57 HA ASP 57 11.812 -1.845 -17.497 455 1HB ASP 57 HB2 ASP 57 10.251 -0.450 -16.149 456 2HB ASP 57 HB3 ASP 57 9.960 -1.835 -15.088 457 H PHE 58 H PHE 58 13.358 -2.868 -16.048 458 HA PHE 58 HA PHE 58 13.149 -5.782 -15.929 459 1HB PHE 58 HB2 PHE 58 15.299 -4.638 -16.316 460 2HB PHE 58 HB3 PHE 58 15.134 -3.783 -14.789 461 HD1 PHE 58 HD1 PHE 58 15.776 -7.099 -16.351 462 HD2 PHE 58 HD2 PHE 58 15.692 -4.847 -12.670 463 HE1 PHE 58 HE1 PHE 58 17.031 -8.909 -15.213 464 HE2 PHE 58 HE2 PHE 58 16.960 -6.657 -11.540 465 HZ PHE 58 HZ PHE 58 17.652 -8.679 -12.817 466 H VAL 59 H VAL 59 12.789 -7.026 -14.056 467 HA VAL 59 HA VAL 59 12.347 -5.670 -11.496 468 HB VAL 59 HB VAL 59 10.243 -7.089 -11.205 469 1HG1 VAL 59 HG11 VAL 59 8.774 -5.313 -12.044 470 2HG1 VAL 59 HG12 VAL 59 10.211 -4.668 -11.253 471 3HG1 VAL 59 HG13 VAL 59 10.091 -4.662 -13.031 472 1HG2 VAL 59 HG21 VAL 59 8.852 -7.516 -13.151 473 2HG2 VAL 59 HG22 VAL 59 10.115 -6.925 -14.243 474 3HG2 VAL 59 HG23 VAL 59 10.381 -8.409 -13.298 475 H ASN 60 H ASN 60 12.179 -7.251 -9.710 476 HA ASN 60 HA ASN 60 13.472 -9.798 -10.274 477 1HB ASN 60 HB2 ASN 60 15.107 -7.604 -9.817 478 2HB ASN 60 HB3 ASN 60 14.905 -8.253 -8.189 479 1HD2 ASN 60 HD22 ASN 60 15.515 -9.291 -11.589 480 2HD2 ASN 60 HD21 ASN 60 16.649 -10.564 -11.180 481 H GLU 61 H GLU 61 13.892 -11.016 -8.234 482 HA GLU 61 HA GLU 61 11.466 -11.234 -6.742 483 1HB GLU 61 HB2 GLU 61 12.918 -13.127 -7.279 484 2HB GLU 61 HB3 GLU 61 14.249 -12.423 -6.369 485 1HG GLU 61 HG2 GLU 61 12.802 -12.580 -4.284 486 2HG GLU 61 HG3 GLU 61 11.558 -13.358 -5.263 487 H GLY 62 H GLY 62 10.828 -9.662 -5.379 488 1HA GLY 62 HA2 GLY 62 10.884 -8.653 -3.279 489 2HA GLY 62 HA3 GLY 62 12.651 -8.704 -3.256 490 H ASP 63 H ASP 63 11.640 -7.600 -6.374 491 HA ASP 63 HA ASP 63 12.576 -4.913 -5.731 492 1HB ASP 63 HB2 ASP 63 13.137 -6.290 -7.812 493 2HB ASP 63 HB3 ASP 63 11.484 -6.000 -8.356 494 H VAL 64 H VAL 64 11.229 -3.144 -5.458 495 HA VAL 64 HA VAL 64 8.525 -3.613 -4.720 496 HB VAL 64 HB VAL 64 10.018 -1.007 -5.249 497 1HG1 VAL 64 HG11 VAL 64 8.314 -0.019 -3.672 498 2HG1 VAL 64 HG12 VAL 64 7.636 -0.520 -5.221 499 3HG1 VAL 64 HG13 VAL 64 7.394 -1.538 -3.791 500 1HG2 VAL 64 HG21 VAL 64 10.282 -0.966 -2.769 501 2HG2 VAL 64 HG22 VAL 64 9.538 -2.576 -2.671 502 3HG2 VAL 64 HG23 VAL 64 11.103 -2.351 -3.480 503 H LEU 65 H LEU 65 6.581 -2.937 -5.665 504 HA LEU 65 HA LEU 65 6.625 -2.450 -8.611 505 1HB LEU 65 HB2 LEU 65 5.872 -4.713 -8.038 506 2HB LEU 65 HB3 LEU 65 4.717 -4.069 -6.876 507 HG LEU 65 HG LEU 65 3.463 -2.957 -8.724 508 1HD1 LEU 65 HD11 LEU 65 5.475 -4.366 -10.507 509 2HD1 LEU 65 HD12 LEU 65 3.921 -3.689 -11.053 510 3HD1 LEU 65 HD13 LEU 65 5.156 -2.624 -10.388 511 1HD2 LEU 65 HD21 LEU 65 2.604 -5.129 -9.692 512 2HD2 LEU 65 HD22 LEU 65 3.947 -5.950 -8.872 513 3HD2 LEU 65 HD23 LEU 65 2.717 -5.105 -7.923 514 H LEU 66 H LEU 66 4.773 -1.913 -5.504 515 HA LEU 66 HA LEU 66 4.362 0.825 -6.301 516 1HB LEU 66 HB2 LEU 66 2.011 0.952 -6.366 517 2HB LEU 66 HB3 LEU 66 2.528 -0.140 -7.625 518 HG LEU 66 HG LEU 66 1.551 -1.244 -4.956 519 1HD1 LEU 66 HD11 LEU 66 -0.137 -0.269 -7.297 520 2HD1 LEU 66 HD12 LEU 66 -0.724 -1.320 -5.995 521 3HD1 LEU 66 HD13 LEU 66 -0.159 0.317 -5.625 522 1HD2 LEU 66 HD21 LEU 66 1.379 -2.272 -7.830 523 2HD2 LEU 66 HD22 LEU 66 2.528 -2.838 -6.602 524 3HD2 LEU 66 HD23 LEU 66 0.800 -3.118 -6.380 525 H GLU 67 H GLU 67 3.048 2.034 -4.713 526 HA GLU 67 HA GLU 67 3.383 1.034 -1.933 527 1HB GLU 67 HB2 GLU 67 5.140 2.624 -2.585 528 2HB GLU 67 HB3 GLU 67 3.918 3.788 -3.130 529 1HG GLU 67 HG2 GLU 67 3.118 4.072 -0.841 530 2HG GLU 67 HG3 GLU 67 4.180 2.776 -0.276 531 H LEU 68 H LEU 68 1.686 1.750 -0.507 532 HA LEU 68 HA LEU 68 -0.824 2.479 -1.936 533 1HB LEU 68 HB2 LEU 68 -0.451 0.443 0.292 534 2HB LEU 68 HB3 LEU 68 -1.975 0.865 -0.472 535 HG LEU 68 HG LEU 68 0.345 -0.570 -1.814 536 1HD1 LEU 68 HD11 LEU 68 -1.182 -2.486 -1.834 537 2HD1 LEU 68 HD12 LEU 68 -0.936 -1.917 -0.178 538 3HD1 LEU 68 HD13 LEU 68 -2.444 -1.529 -1.035 539 1HD2 LEU 68 HD21 LEU 68 -1.192 -0.884 -3.702 540 2HD2 LEU 68 HD22 LEU 68 -2.391 0.182 -2.932 541 3HD2 LEU 68 HD23 LEU 68 -0.809 0.814 -3.455 542 H SER 69 H SER 69 -2.555 3.112 -0.562 543 HA SER 69 HA SER 69 -1.983 4.147 2.118 544 1HB SER 69 HB2 SER 69 -3.108 5.748 -0.216 545 2HB SER 69 HB3 SER 69 -3.493 6.160 1.463 546 HG SER 69 HG SER 69 -1.667 7.281 0.597 547 H ASN 70 H ASN 70 -4.207 4.742 3.114 548 HA ASN 70 HA ASN 70 -6.565 3.395 2.103 549 1HB ASN 70 HB2 ASN 70 -5.439 1.512 3.266 550 2HB ASN 70 HB3 ASN 70 -5.183 2.518 4.690 551 1HD2 ASN 70 HD22 ASN 70 -6.662 2.118 6.320 552 2HD2 ASN 70 HD21 ASN 70 -8.302 1.555 6.054 553 H SER 71 H SER 71 -8.427 4.095 3.630 554 HA SER 71 HA SER 71 -8.399 6.802 4.129 555 1HB SER 71 HB2 SER 71 -10.148 4.773 5.561 556 2HB SER 71 HB3 SER 71 -10.562 6.435 5.101 557 HG SER 71 HG SER 71 -11.433 4.893 3.646 558 H THR 72 H THR 72 -6.977 4.401 6.205 559 HA THR 72 HA THR 72 -7.145 5.771 8.715 560 HB THR 72 HB THR 72 -5.160 4.096 9.125 561 HG1 THR 72 HG1 THR 72 -4.529 3.463 7.158 562 1HG2 THR 72 HG21 THR 72 -6.731 2.191 9.245 563 2HG2 THR 72 HG22 THR 72 -7.450 3.672 9.897 564 3HG2 THR 72 HG23 THR 72 -7.923 3.098 8.284 565 H GLN 73 H GLN 73 -5.391 6.610 5.858 566 HA GLN 73 HA GLN 73 -3.733 8.473 7.407 567 1HB GLN 73 HB2 GLN 73 -1.701 7.939 6.191 568 2HB GLN 73 HB3 GLN 73 -2.261 6.548 7.104 569 1HG GLN 73 HG2 GLN 73 -3.136 5.518 5.015 570 2HG GLN 73 HG3 GLN 73 -2.627 6.940 4.099 571 1HE2 GLN 73 HE22 GLN 73 -0.924 6.091 2.776 572 2HE2 GLN 73 HE21 GLN 73 0.451 5.263 3.448 Start of MODEL 10 1 1H THR 2 H1 THR 2 2.915 -2.673 1.246 2 2H THR 2 H2 THR 2 2.592 -1.101 0.887 3 3H THR 2 H3 THR 2 1.750 -2.318 0.148 4 HA THR 2 HA THR 2 3.349 -1.429 -1.375 5 HB THR 2 HB THR 2 5.340 -2.110 0.824 6 HG1 THR 2 HG1 THR 2 5.447 0.096 1.016 7 1HG2 THR 2 HG21 THR 2 5.793 -0.734 -1.865 8 2HG2 THR 2 HG22 THR 2 6.990 -0.927 -0.569 9 3HG2 THR 2 HG23 THR 2 6.385 -2.355 -1.415 10 H VAL 3 H VAL 3 4.010 -2.846 -3.028 11 HA VAL 3 HA VAL 3 4.191 -5.723 -2.357 12 HB VAL 3 HB VAL 3 2.463 -4.786 -4.649 13 1HG1 VAL 3 HG11 VAL 3 1.456 -7.038 -4.416 14 2HG1 VAL 3 HG12 VAL 3 3.189 -7.128 -4.702 15 3HG1 VAL 3 HG13 VAL 3 2.554 -7.377 -3.058 16 1HG2 VAL 3 HG21 VAL 3 0.419 -5.220 -3.313 17 2HG2 VAL 3 HG22 VAL 3 1.420 -5.341 -1.848 18 3HG2 VAL 3 HG23 VAL 3 1.299 -3.808 -2.752 19 H SER 4 H SER 4 5.356 -6.896 -3.912 20 HA SER 4 HA SER 4 7.066 -5.358 -5.794 21 1HB SER 4 HB2 SER 4 7.969 -7.342 -3.657 22 2HB SER 4 HB3 SER 4 9.011 -6.402 -4.730 23 HG SER 4 HG SER 4 8.789 -5.545 -2.568 24 H ILE 5 H ILE 5 8.296 -6.778 -7.220 25 HA ILE 5 HA ILE 5 6.708 -9.027 -8.204 26 HB ILE 5 HB ILE 5 9.499 -8.159 -9.055 27 1HG1 ILE 5 HG12 ILE 5 8.186 -6.152 -9.282 28 2HG1 ILE 5 HG13 ILE 5 8.427 -6.858 -10.863 29 1HG2 ILE 5 HG21 ILE 5 8.839 -9.154 -11.235 30 2HG2 ILE 5 HG22 ILE 5 8.817 -10.340 -9.943 31 3HG2 ILE 5 HG23 ILE 5 7.289 -9.669 -10.534 32 1HD1 ILE 5 HD11 ILE 5 6.189 -5.983 -10.663 33 2HD1 ILE 5 HD12 ILE 5 6.138 -7.732 -10.897 34 3HD1 ILE 5 HD13 ILE 5 5.853 -7.037 -9.278 35 H GLN 6 H GLN 6 7.386 -11.251 -8.075 36 HA GLN 6 HA GLN 6 9.107 -11.775 -5.703 37 1HB GLN 6 HB2 GLN 6 7.133 -13.732 -6.887 38 2HB GLN 6 HB3 GLN 6 7.813 -13.666 -5.272 39 1HG GLN 6 HG2 GLN 6 5.697 -12.917 -4.826 40 2HG GLN 6 HG3 GLN 6 6.500 -11.373 -5.081 41 1HE2 GLN 6 HE22 GLN 6 5.227 -9.984 -6.399 42 2HE2 GLN 6 HE21 GLN 6 4.172 -10.579 -7.674 43 H MET 7 H MET 7 9.827 -11.599 -8.816 44 HA MET 7 HA MET 7 11.647 -13.856 -8.933 45 1HB MET 7 HB2 MET 7 10.628 -14.802 -11.000 46 2HB MET 7 HB3 MET 7 9.579 -14.971 -9.593 47 1HG MET 7 HG2 MET 7 8.395 -12.836 -10.382 48 2HG MET 7 HG3 MET 7 9.256 -13.043 -11.902 49 1HE MET 7 HE1 MET 7 6.145 -13.420 -10.121 50 2HE MET 7 HE2 MET 7 6.118 -12.816 -11.795 51 3HE MET 7 HE3 MET 7 5.205 -14.272 -11.359 52 H ALA 8 H ALA 8 12.994 -13.674 -10.926 53 HA ALA 8 HA ALA 8 13.436 -10.878 -11.703 54 1HB ALA 8 HB1 ALA 8 15.340 -12.381 -11.201 55 2HB ALA 8 HB2 ALA 8 14.835 -13.451 -12.534 56 3HB ALA 8 HB3 ALA 8 15.382 -11.798 -12.883 57 H GLY 9 H GLY 9 12.993 -9.951 -13.698 58 1HA GLY 9 HA2 GLY 9 12.613 -11.340 -16.101 59 2HA GLY 9 HA3 GLY 9 11.018 -11.202 -15.366 60 H ASN 10 H ASN 10 10.276 -9.816 -17.017 61 HA ASN 10 HA ASN 10 11.059 -6.949 -16.711 62 1HB ASN 10 HB2 ASN 10 10.987 -8.573 -19.284 63 2HB ASN 10 HB3 ASN 10 10.411 -6.913 -19.284 64 1HD2 ASN 10 HD22 ASN 10 13.247 -7.960 -17.284 65 2HD2 ASN 10 HD21 ASN 10 14.403 -7.107 -18.286 66 H LEU 11 H LEU 11 9.315 -5.659 -16.702 67 HA LEU 11 HA LEU 11 6.777 -6.916 -16.131 68 1HB LEU 11 HB2 LEU 11 7.886 -4.125 -16.289 69 2HB LEU 11 HB3 LEU 11 6.147 -4.327 -16.375 70 HG LEU 11 HG LEU 11 7.820 -5.596 -14.173 71 1HD1 LEU 11 HD11 LEU 11 6.339 -2.941 -14.154 72 2HD1 LEU 11 HD12 LEU 11 7.121 -3.715 -12.752 73 3HD1 LEU 11 HD13 LEU 11 8.100 -3.177 -14.129 74 1HD2 LEU 11 HD21 LEU 11 5.575 -5.553 -12.963 75 2HD2 LEU 11 HD22 LEU 11 4.835 -5.125 -14.520 76 3HD2 LEU 11 HD23 LEU 11 5.659 -6.678 -14.316 77 H TRP 12 H TRP 12 5.361 -7.639 -17.564 78 HA TRP 12 HA TRP 12 5.639 -7.153 -20.417 79 1HB TRP 12 HB2 TRP 12 4.802 -9.283 -19.257 80 2HB TRP 12 HB3 TRP 12 3.321 -8.414 -18.899 81 HD1 TRP 12 HD1 TRP 12 5.440 -9.368 -21.946 82 HE1 TRP 12 HE1 TRP 12 3.939 -9.976 -23.922 83 HE3 TRP 12 HE3 TRP 12 0.908 -8.362 -19.816 84 HZ2 TRP 12 HZ2 TRP 12 1.090 -10.060 -24.490 85 HZ3 TRP 12 HZ3 TRP 12 -1.190 -8.765 -21.073 86 HH2 TRP 12 HH2 TRP 12 -1.112 -9.606 -23.412 87 H LYS 13 H LYS 13 3.189 -6.369 -17.883 88 HA LYS 13 HA LYS 13 2.634 -3.751 -19.080 89 1HB LYS 13 HB2 LYS 13 0.546 -5.963 -18.771 90 2HB LYS 13 HB3 LYS 13 0.130 -4.253 -18.903 91 1HG LYS 13 HG2 LYS 13 1.305 -4.187 -21.132 92 2HG LYS 13 HG3 LYS 13 1.517 -5.945 -21.014 93 1HD LYS 13 HD2 LYS 13 -0.979 -6.184 -20.806 94 2HD LYS 13 HD3 LYS 13 -1.126 -4.433 -21.081 95 1HE LYS 13 HE2 LYS 13 0.081 -4.708 -23.259 96 2HE LYS 13 HE3 LYS 13 0.158 -6.454 -22.982 97 1HZ LYS 13 HZ1 LYS 13 -2.337 -4.881 -23.295 98 2HZ LYS 13 HZ2 LYS 13 -1.689 -5.866 -24.416 99 3HZ LYS 13 HZ3 LYS 13 -2.275 -6.495 -23.033 100 H VAL 14 H VAL 14 1.307 -2.473 -17.528 101 HA VAL 14 HA VAL 14 1.034 -3.516 -14.789 102 HB VAL 14 HB VAL 14 2.314 -0.833 -15.515 103 1HG1 VAL 14 HG11 VAL 14 2.584 -0.556 -13.046 104 2HG1 VAL 14 HG12 VAL 14 0.892 -0.581 -13.532 105 3HG1 VAL 14 HG13 VAL 14 1.620 -2.025 -12.786 106 1HG2 VAL 14 HG21 VAL 14 3.509 -3.241 -14.077 107 2HG2 VAL 14 HG22 VAL 14 3.969 -2.654 -15.693 108 3HG2 VAL 14 HG23 VAL 14 4.291 -1.659 -14.274 109 H HIS 15 H HIS 15 -0.949 -2.789 -13.950 110 HA HIS 15 HA HIS 15 -2.673 -1.391 -15.948 111 1HB HIS 15 HB2 HIS 15 -3.613 -3.226 -13.748 112 2HB HIS 15 HB3 HIS 15 -4.426 -2.798 -15.250 113 HD1 HIS 15 HD1 HIS 15 -2.304 -3.696 -17.417 114 HD2 HIS 15 HD2 HIS 15 -3.069 -5.713 -13.808 115 HE1 HIS 15 HE1 HIS 15 -1.367 -6.060 -17.687 116 H VAL 16 H VAL 16 -1.507 -1.232 -12.647 117 HA VAL 16 HA VAL 16 -3.615 0.521 -11.672 118 HB VAL 16 HB VAL 16 -2.048 0.771 -9.731 119 1HG1 VAL 16 HG11 VAL 16 -2.743 -2.080 -10.532 120 2HG1 VAL 16 HG12 VAL 16 -2.400 -1.491 -8.885 121 3HG1 VAL 16 HG13 VAL 16 -3.824 -0.908 -9.757 122 1HG2 VAL 16 HG21 VAL 16 -0.083 -0.570 -9.498 123 2HG2 VAL 16 HG22 VAL 16 -0.334 -1.369 -11.060 124 3HG2 VAL 16 HG23 VAL 16 0.097 0.355 -10.984 125 H LYS 17 H LYS 17 -3.115 2.630 -10.744 126 HA LYS 17 HA LYS 17 -0.860 4.128 -11.740 127 1HB LYS 17 HB2 LYS 17 -2.212 6.025 -12.546 128 2HB LYS 17 HB3 LYS 17 -2.441 4.595 -13.550 129 1HG LYS 17 HG2 LYS 17 -4.612 4.140 -12.446 130 2HG LYS 17 HG3 LYS 17 -4.384 5.554 -11.395 131 1HD LYS 17 HD2 LYS 17 -4.351 7.029 -13.386 132 2HD LYS 17 HD3 LYS 17 -4.586 5.613 -14.436 133 1HE LYS 17 HE2 LYS 17 -6.734 5.121 -13.282 134 2HE LYS 17 HE3 LYS 17 -6.500 6.529 -12.238 135 1HZ LYS 17 HZ1 LYS 17 -6.828 6.630 -15.182 136 2HZ LYS 17 HZ2 LYS 17 -7.963 7.032 -14.088 137 3HZ LYS 17 HZ3 LYS 17 -6.612 7.931 -14.216 138 H ALA 18 H ALA 18 -0.617 6.063 -10.299 139 HA ALA 18 HA ALA 18 -1.422 5.546 -7.602 140 1HB ALA 18 HB1 ALA 18 0.589 6.841 -8.205 141 2HB ALA 18 HB2 ALA 18 -0.437 8.136 -8.872 142 3HB ALA 18 HB3 ALA 18 -0.489 7.765 -7.134 143 H GLY 19 H GLY 19 -3.258 6.090 -6.512 144 1HA GLY 19 HA2 GLY 19 -5.184 7.331 -6.029 145 2HA GLY 19 HA3 GLY 19 -5.207 8.001 -7.665 146 H ASP 20 H ASP 20 -4.611 4.848 -8.371 147 HA ASP 20 HA ASP 20 -7.385 4.118 -8.856 148 1HB ASP 20 HB2 ASP 20 -5.395 3.428 -10.280 149 2HB ASP 20 HB3 ASP 20 -4.894 2.374 -8.956 150 H GLN 21 H GLN 21 -8.113 1.866 -8.015 151 HA GLN 21 HA GLN 21 -7.311 1.412 -5.181 152 1HB GLN 21 HB2 GLN 21 -9.403 2.640 -5.154 153 2HB GLN 21 HB3 GLN 21 -10.129 1.562 -6.333 154 1HG GLN 21 HG2 GLN 21 -9.091 0.307 -3.790 155 2HG GLN 21 HG3 GLN 21 -10.494 1.351 -3.644 156 1HE2 GLN 21 HE22 GLN 21 -9.741 -1.854 -3.903 157 2HE2 GLN 21 HE21 GLN 21 -11.194 -2.401 -4.713 158 H ILE 22 H ILE 22 -7.110 -0.715 -4.650 159 HA ILE 22 HA ILE 22 -7.713 -2.764 -6.719 160 HB ILE 22 HB ILE 22 -5.609 -3.836 -6.327 161 1HG1 ILE 22 HG12 ILE 22 -5.054 -1.661 -4.265 162 2HG1 ILE 22 HG13 ILE 22 -5.219 -3.398 -3.988 163 1HG2 ILE 22 HG21 ILE 22 -5.725 -2.005 -8.038 164 2HG2 ILE 22 HG22 ILE 22 -5.013 -0.898 -6.847 165 3HG2 ILE 22 HG23 ILE 22 -4.097 -2.299 -7.416 166 1HD1 ILE 22 HD11 ILE 22 -3.149 -3.695 -5.473 167 2HD1 ILE 22 HD12 ILE 22 -2.964 -1.933 -5.363 168 3HD1 ILE 22 HD13 ILE 22 -2.913 -2.932 -3.893 169 H GLU 23 H GLU 23 -7.755 -4.950 -5.766 170 HA GLU 23 HA GLU 23 -8.620 -5.052 -2.942 171 1HB GLU 23 HB2 GLU 23 -10.599 -4.824 -4.356 172 2HB GLU 23 HB3 GLU 23 -10.067 -6.191 -5.365 173 1HG GLU 23 HG2 GLU 23 -10.284 -7.706 -3.418 174 2HG GLU 23 HG3 GLU 23 -10.709 -6.342 -2.381 175 H LYS 24 H LYS 24 -7.921 -6.988 -1.941 176 HA LYS 24 HA LYS 24 -5.627 -8.221 -2.820 177 1HB LYS 24 HB2 LYS 24 -6.582 -8.331 -0.527 178 2HB LYS 24 HB3 LYS 24 -7.795 -9.489 -1.083 179 1HG LYS 24 HG2 LYS 24 -6.078 -11.133 -1.625 180 2HG LYS 24 HG3 LYS 24 -4.793 -9.953 -1.337 181 1HD LYS 24 HD2 LYS 24 -5.466 -9.830 1.066 182 2HD LYS 24 HD3 LYS 24 -6.718 -11.057 0.758 183 1HE LYS 24 HE2 LYS 24 -4.953 -12.649 0.011 184 2HE LYS 24 HE3 LYS 24 -3.718 -11.418 0.313 185 1HZ LYS 24 HZ1 LYS 24 -4.314 -11.482 2.659 186 2HZ LYS 24 HZ2 LYS 24 -5.464 -12.615 2.386 187 3HZ LYS 24 HZ3 LYS 24 -3.893 -12.970 2.151 188 H GLY 25 H GLY 25 -5.063 -9.685 -4.337 189 1HA GLY 25 HA2 GLY 25 -5.212 -11.611 -5.603 190 2HA GLY 25 HA3 GLY 25 -6.925 -11.779 -5.205 191 H GLN 26 H GLN 26 -6.883 -8.624 -6.175 192 HA GLN 26 HA GLN 26 -7.737 -9.115 -8.902 193 1HB GLN 26 HB2 GLN 26 -8.425 -7.151 -7.396 194 2HB GLN 26 HB3 GLN 26 -6.777 -6.537 -7.588 195 1HG GLN 26 HG2 GLN 26 -7.377 -6.732 -10.194 196 2HG GLN 26 HG3 GLN 26 -9.026 -6.697 -9.595 197 1HE2 GLN 26 HE22 GLN 26 -6.098 -4.878 -10.163 198 2HE2 GLN 26 HE21 GLN 26 -6.714 -3.311 -9.651 199 H GLU 27 H GLU 27 -6.438 -8.832 -10.796 200 HA GLU 27 HA GLU 27 -3.557 -8.991 -10.493 201 1HB GLU 27 HB2 GLU 27 -3.422 -9.144 -12.793 202 2HB GLU 27 HB3 GLU 27 -4.867 -10.046 -12.379 203 1HG GLU 27 HG2 GLU 27 -4.722 -7.223 -13.515 204 2HG GLU 27 HG3 GLU 27 -5.104 -8.688 -14.415 205 H VAL 28 H VAL 28 -2.074 -7.456 -11.155 206 HA VAL 28 HA VAL 28 -2.892 -4.593 -11.060 207 HB VAL 28 HB VAL 28 -1.160 -6.248 -9.185 208 1HG1 VAL 28 HG11 VAL 28 -0.353 -4.173 -8.140 209 2HG1 VAL 28 HG12 VAL 28 0.299 -4.432 -9.763 210 3HG1 VAL 28 HG13 VAL 28 -0.992 -3.249 -9.522 211 1HG2 VAL 28 HG21 VAL 28 -2.425 -4.987 -7.452 212 2HG2 VAL 28 HG22 VAL 28 -3.341 -4.165 -8.733 213 3HG2 VAL 28 HG23 VAL 28 -3.494 -5.915 -8.503 214 H ALA 29 H ALA 29 -0.426 -7.096 -11.903 215 HA ALA 29 HA ALA 29 0.282 -5.522 -14.237 216 1HB ALA 29 HB1 ALA 29 2.409 -6.197 -12.134 217 2HB ALA 29 HB2 ALA 29 2.727 -5.563 -13.749 218 3HB ALA 29 HB3 ALA 29 1.864 -4.564 -12.575 219 H ILE 30 H ILE 30 2.170 -6.904 -15.370 220 HA ILE 30 HA ILE 30 1.821 -9.797 -14.877 221 HB ILE 30 HB ILE 30 1.372 -8.387 -17.543 222 1HG1 ILE 30 HG12 ILE 30 -0.419 -10.338 -16.018 223 2HG1 ILE 30 HG13 ILE 30 -0.614 -8.594 -16.007 224 1HG2 ILE 30 HG21 ILE 30 2.819 -10.422 -17.866 225 2HG2 ILE 30 HG22 ILE 30 1.595 -11.396 -17.028 226 3HG2 ILE 30 HG23 ILE 30 1.242 -10.625 -18.590 227 1HD1 ILE 30 HD11 ILE 30 -2.211 -9.525 -17.517 228 2HD1 ILE 30 HD12 ILE 30 -1.027 -8.592 -18.443 229 3HD1 ILE 30 HD13 ILE 30 -0.964 -10.375 -18.434 230 H LEU 31 H LEU 31 3.699 -10.870 -15.216 231 HA LEU 31 HA LEU 31 6.173 -9.299 -15.797 232 1HB LEU 31 HB2 LEU 31 5.949 -9.923 -13.498 233 2HB LEU 31 HB3 LEU 31 5.473 -11.582 -13.887 234 HG LEU 31 HG LEU 31 7.698 -11.231 -12.873 235 1HD1 LEU 31 HD11 LEU 31 8.882 -12.881 -14.128 236 2HD1 LEU 31 HD12 LEU 31 7.162 -13.292 -14.103 237 3HD1 LEU 31 HD13 LEU 31 7.885 -12.610 -15.563 238 1HD2 LEU 31 HD21 LEU 31 8.680 -10.274 -15.562 239 2HD2 LEU 31 HD22 LEU 31 8.204 -9.154 -14.273 240 3HD2 LEU 31 HD23 LEU 31 9.521 -10.306 -13.992 241 H GLU 32 H GLU 32 7.352 -10.040 -17.522 242 HA GLU 32 HA GLU 32 6.663 -12.653 -18.771 243 1HB GLU 32 HB2 GLU 32 6.515 -10.669 -20.243 244 2HB GLU 32 HB3 GLU 32 8.178 -10.228 -19.838 245 1HG GLU 32 HG2 GLU 32 8.937 -12.435 -20.804 246 2HG GLU 32 HG3 GLU 32 7.270 -12.763 -21.272 247 H SER 33 H SER 33 8.110 -14.273 -18.403 248 HA SER 33 HA SER 33 10.923 -13.933 -18.354 249 1HB SER 33 HB2 SER 33 10.259 -13.098 -15.984 250 2HB SER 33 HB3 SER 33 9.795 -14.769 -15.644 251 HG SER 33 HG SER 33 11.988 -14.004 -15.117 252 H MET 34 H MET 34 11.909 -16.177 -17.745 253 HA MET 34 HA MET 34 12.046 -18.340 -18.444 254 1HB MET 34 HB2 MET 34 10.787 -19.854 -16.957 255 2HB MET 34 HB3 MET 34 11.588 -18.523 -16.138 256 1HG MET 34 HG2 MET 34 9.444 -17.319 -15.941 257 2HG MET 34 HG3 MET 34 8.611 -18.656 -16.742 258 1HE MET 34 HE1 MET 34 6.940 -18.382 -14.545 259 2HE MET 34 HE2 MET 34 7.536 -18.510 -12.878 260 3HE MET 34 HE3 MET 34 8.035 -17.141 -13.892 261 H LYS 35 H LYS 35 10.801 -16.997 -20.454 262 HA LYS 35 HA LYS 35 9.532 -17.135 -22.298 263 1HB LYS 35 HB2 LYS 35 9.840 -20.136 -21.907 264 2HB LYS 35 HB3 LYS 35 9.379 -19.320 -23.403 265 1HG LYS 35 HG2 LYS 35 11.560 -18.119 -23.428 266 2HG LYS 35 HG3 LYS 35 12.052 -19.008 -21.972 267 1HD LYS 35 HD2 LYS 35 11.796 -21.154 -23.186 268 2HD LYS 35 HD3 LYS 35 11.313 -20.266 -24.650 269 1HE LYS 35 HE2 LYS 35 13.503 -19.088 -24.650 270 2HE LYS 35 HE3 LYS 35 13.984 -19.972 -23.197 271 1HZ LYS 35 HZ1 LYS 35 13.840 -22.028 -24.481 272 2HZ LYS 35 HZ2 LYS 35 13.396 -21.209 -25.825 273 3HZ LYS 35 HZ3 LYS 35 14.879 -20.992 -25.189 274 H MET 36 H MET 36 8.018 -16.779 -19.883 275 HA MET 36 HA MET 36 5.347 -17.625 -20.813 276 1HB MET 36 HB2 MET 36 6.520 -18.042 -18.019 277 2HB MET 36 HB3 MET 36 4.794 -18.120 -18.381 278 1HG MET 36 HG2 MET 36 5.189 -19.992 -19.940 279 2HG MET 36 HG3 MET 36 6.910 -19.953 -19.548 280 1HE MET 36 HE1 MET 36 6.960 -22.485 -18.967 281 2HE MET 36 HE2 MET 36 5.814 -23.279 -17.865 282 3HE MET 36 HE3 MET 36 5.239 -22.598 -19.404 283 H GLU 37 H GLU 37 3.693 -16.401 -19.426 284 HA GLU 37 HA GLU 37 4.688 -13.809 -18.422 285 1HB GLU 37 HB2 GLU 37 2.113 -14.174 -20.011 286 2HB GLU 37 HB3 GLU 37 2.661 -12.717 -19.197 287 1HG GLU 37 HG2 GLU 37 3.205 -12.274 -21.393 288 2HG GLU 37 HG3 GLU 37 4.740 -12.788 -20.710 289 H ILE 38 H ILE 38 3.799 -13.331 -16.427 290 HA ILE 38 HA ILE 38 1.896 -15.279 -15.226 291 HB ILE 38 HB ILE 38 4.500 -14.250 -13.984 292 1HG1 ILE 38 HG12 ILE 38 4.913 -16.918 -14.054 293 2HG1 ILE 38 HG13 ILE 38 3.918 -16.806 -15.493 294 1HG2 ILE 38 HG21 ILE 38 2.777 -14.685 -12.311 295 2HG2 ILE 38 HG22 ILE 38 2.437 -16.284 -13.019 296 3HG2 ILE 38 HG23 ILE 38 3.989 -15.953 -12.229 297 1HD1 ILE 38 HD11 ILE 38 6.290 -16.684 -16.070 298 2HD1 ILE 38 HD12 ILE 38 5.601 -15.091 -16.391 299 3HD1 ILE 38 HD13 ILE 38 6.552 -15.365 -14.922 300 HA PRO 39 HA PRO 39 0.297 -11.206 -14.075 301 1HB PRO 39 HB2 PRO 39 -1.760 -11.935 -12.393 302 2HB PRO 39 HB3 PRO 39 -1.854 -11.984 -14.182 303 1HG PRO 39 HG2 PRO 39 -1.295 -14.247 -12.266 304 2HG PRO 39 HG3 PRO 39 -2.356 -14.236 -13.711 305 1HD PRO 39 HD2 PRO 39 0.206 -15.258 -13.726 306 2HD PRO 39 HD3 PRO 39 -0.520 -14.482 -15.167 307 H ILE 40 H ILE 40 0.354 -9.856 -12.326 308 HA ILE 40 HA ILE 40 1.525 -10.808 -9.758 309 HB ILE 40 HB ILE 40 1.908 -8.149 -11.187 310 1HG1 ILE 40 HG12 ILE 40 3.195 -9.876 -12.368 311 2HG1 ILE 40 HG13 ILE 40 4.187 -8.654 -11.618 312 1HG2 ILE 40 HG21 ILE 40 3.628 -7.750 -9.376 313 2HG2 ILE 40 HG22 ILE 40 1.952 -7.774 -8.825 314 3HG2 ILE 40 HG23 ILE 40 2.992 -9.179 -8.541 315 1HD1 ILE 40 HD11 ILE 40 5.163 -10.883 -11.353 316 2HD1 ILE 40 HD12 ILE 40 4.778 -10.198 -9.776 317 3HD1 ILE 40 HD13 ILE 40 3.724 -11.450 -10.486 318 H VAL 41 H VAL 41 0.219 -10.266 -8.063 319 HA VAL 41 HA VAL 41 -2.307 -8.829 -8.682 320 HB VAL 41 HB VAL 41 -3.277 -10.433 -6.956 321 1HG1 VAL 41 HG11 VAL 41 -3.778 -10.775 -9.284 322 2HG1 VAL 41 HG12 VAL 41 -2.230 -11.614 -9.561 323 3HG1 VAL 41 HG13 VAL 41 -3.489 -12.332 -8.528 324 1HG2 VAL 41 HG21 VAL 41 -0.780 -12.101 -7.493 325 2HG2 VAL 41 HG22 VAL 41 -1.094 -11.216 -5.977 326 3HG2 VAL 41 HG23 VAL 41 -2.171 -12.523 -6.484 327 H ALA 42 H ALA 42 -3.404 -7.883 -6.915 328 HA ALA 42 HA ALA 42 -1.854 -6.326 -5.073 329 1HB ALA 42 HB1 ALA 42 -4.087 -5.790 -4.137 330 2HB ALA 42 HB2 ALA 42 -4.139 -5.721 -5.915 331 3HB ALA 42 HB3 ALA 42 -4.796 -7.123 -5.068 332 H ASP 43 H ASP 43 -0.748 -7.246 -3.382 333 HA ASP 43 HA ASP 43 -1.382 -9.778 -2.180 334 1HB ASP 43 HB2 ASP 43 0.864 -8.819 -2.122 335 2HB ASP 43 HB3 ASP 43 0.282 -7.431 -1.195 336 H ARG 44 H ARG 44 -2.573 -6.516 -1.654 337 HA ARG 44 HA ARG 44 -4.618 -7.460 0.149 338 1HB ARG 44 HB2 ARG 44 -4.146 -5.849 1.946 339 2HB ARG 44 HB3 ARG 44 -2.884 -7.068 1.786 340 1HG ARG 44 HG2 ARG 44 -1.600 -5.277 0.377 341 2HG ARG 44 HG3 ARG 44 -2.746 -4.119 1.056 342 1HD ARG 44 HD2 ARG 44 -0.945 -5.990 2.682 343 2HD ARG 44 HD3 ARG 44 -0.545 -4.333 2.260 344 HE ARG 44 HE ARG 44 -2.050 -3.471 3.751 345 1HH1 ARG 44 HH21 ARG 44 -2.218 -7.023 3.887 346 2HH1 ARG 44 HH22 ARG 44 -3.126 -7.054 5.353 347 1HH2 ARG 44 HH11 ARG 44 -3.196 -3.510 5.702 348 2HH2 ARG 44 HH12 ARG 44 -3.691 -5.009 6.409 349 H SER 45 H SER 45 -6.353 -5.868 0.289 350 HA SER 45 HA SER 45 -6.688 -4.253 -2.031 351 1HB SER 45 HB2 SER 45 -8.216 -4.100 0.600 352 2HB SER 45 HB3 SER 45 -8.820 -3.734 -1.022 353 HG SER 45 HG SER 45 -9.403 -5.847 -0.125 354 H GLY 46 H GLY 46 -6.971 -1.868 -2.091 355 1HA GLY 46 HA2 GLY 46 -6.760 -0.087 -0.029 356 2HA GLY 46 HA3 GLY 46 -5.066 -0.418 -0.411 357 H ILE 47 H ILE 47 -5.472 2.060 -0.766 358 HA ILE 47 HA ILE 47 -6.218 2.631 -3.588 359 HB ILE 47 HB ILE 47 -5.280 4.466 -1.337 360 1HG1 ILE 47 HG12 ILE 47 -7.527 3.711 -0.824 361 2HG1 ILE 47 HG13 ILE 47 -7.558 5.393 -1.322 362 1HG2 ILE 47 HG21 ILE 47 -6.174 5.138 -4.165 363 2HG2 ILE 47 HG22 ILE 47 -5.983 6.324 -2.855 364 3HG2 ILE 47 HG23 ILE 47 -4.585 5.421 -3.432 365 1HD1 ILE 47 HD11 ILE 47 -8.380 2.997 -3.016 366 2HD1 ILE 47 HD12 ILE 47 -9.448 4.209 -2.294 367 3HD1 ILE 47 HD13 ILE 47 -8.348 4.678 -3.604 368 H VAL 48 H VAL 48 -4.602 2.950 -5.056 369 HA VAL 48 HA VAL 48 -1.880 2.100 -4.465 370 HB VAL 48 HB VAL 48 -3.096 3.415 -6.925 371 1HG1 VAL 48 HG11 VAL 48 -1.170 2.434 -8.109 372 2HG1 VAL 48 HG12 VAL 48 -0.608 3.550 -6.858 373 3HG1 VAL 48 HG13 VAL 48 -0.517 1.806 -6.579 374 1HG2 VAL 48 HG21 VAL 48 -2.687 0.460 -6.285 375 2HG2 VAL 48 HG22 VAL 48 -4.245 1.294 -6.469 376 3HG2 VAL 48 HG23 VAL 48 -3.184 1.124 -7.857 377 H LYS 49 H LYS 49 -0.745 3.448 -3.137 378 HA LYS 49 HA LYS 49 -1.230 6.329 -3.080 379 1HB LYS 49 HB2 LYS 49 -0.627 5.065 -1.029 380 2HB LYS 49 HB3 LYS 49 0.910 4.594 -1.755 381 1HG LYS 49 HG2 LYS 49 1.236 6.384 -0.165 382 2HG LYS 49 HG3 LYS 49 1.649 6.945 -1.786 383 1HD LYS 49 HD2 LYS 49 -0.508 8.149 -1.941 384 2HD LYS 49 HD3 LYS 49 -0.993 7.503 -0.354 385 1HE LYS 49 HE2 LYS 49 0.949 8.651 0.692 386 2HE LYS 49 HE3 LYS 49 1.434 9.281 -0.887 387 1HZ LYS 49 HZ1 LYS 49 -0.654 10.516 -0.963 388 2HZ LYS 49 HZ2 LYS 49 -1.105 9.932 0.497 389 3HZ LYS 49 HZ3 LYS 49 0.187 10.914 0.372 390 H GLU 50 H GLU 50 1.245 4.035 -4.399 391 HA GLU 50 HA GLU 50 1.933 6.028 -6.408 392 1HB GLU 50 HB2 GLU 50 3.335 6.577 -4.306 393 2HB GLU 50 HB3 GLU 50 4.182 5.055 -4.589 394 1HG GLU 50 HG2 GLU 50 4.988 5.851 -6.747 395 2HG GLU 50 HG3 GLU 50 3.936 7.269 -6.671 396 H VAL 51 H VAL 51 3.491 5.039 -8.030 397 HA VAL 51 HA VAL 51 3.558 2.072 -7.985 398 HB VAL 51 HB VAL 51 3.031 3.742 -10.482 399 1HG1 VAL 51 HG11 VAL 51 2.409 1.545 -11.462 400 2HG1 VAL 51 HG12 VAL 51 4.080 1.531 -10.891 401 3HG1 VAL 51 HG13 VAL 51 2.809 0.738 -9.933 402 1HG2 VAL 51 HG21 VAL 51 1.022 3.954 -9.092 403 2HG2 VAL 51 HG22 VAL 51 0.706 2.834 -10.421 404 3HG2 VAL 51 HG23 VAL 51 1.031 2.194 -8.794 405 H LYS 52 H LYS 52 5.563 1.307 -8.487 406 HA LYS 52 HA LYS 52 7.711 3.366 -8.528 407 1HB LYS 52 HB2 LYS 52 7.774 0.412 -7.795 408 2HB LYS 52 HB3 LYS 52 9.070 1.574 -7.526 409 1HG LYS 52 HG2 LYS 52 6.359 1.523 -6.131 410 2HG LYS 52 HG3 LYS 52 7.917 1.039 -5.471 411 1HD LYS 52 HD2 LYS 52 8.747 3.369 -5.664 412 2HD LYS 52 HD3 LYS 52 7.134 3.879 -6.234 413 1HE LYS 52 HE2 LYS 52 6.097 3.136 -4.186 414 2HE LYS 52 HE3 LYS 52 7.601 2.404 -3.609 415 1HZ LYS 52 HZ1 LYS 52 7.212 5.312 -4.049 416 2HZ LYS 52 HZ2 LYS 52 7.112 4.549 -2.596 417 3HZ LYS 52 HZ3 LYS 52 8.547 4.594 -3.403 418 H LYS 53 H LYS 53 6.231 1.448 -10.838 419 HA LYS 53 HA LYS 53 8.699 1.066 -12.440 420 1HB LYS 53 HB2 LYS 53 6.655 -1.070 -11.684 421 2HB LYS 53 HB3 LYS 53 7.839 -1.257 -12.960 422 1HG LYS 53 HG2 LYS 53 8.636 -0.804 -10.067 423 2HG LYS 53 HG3 LYS 53 8.427 -2.395 -10.811 424 1HD LYS 53 HD2 LYS 53 10.093 -1.836 -12.539 425 2HD LYS 53 HD3 LYS 53 10.363 -0.251 -11.783 426 1HE LYS 53 HE2 LYS 53 11.246 -1.289 -9.769 427 2HE LYS 53 HE3 LYS 53 10.809 -2.895 -10.331 428 1HZ LYS 53 HZ1 LYS 53 12.353 -2.520 -12.240 429 2HZ LYS 53 HZ2 LYS 53 12.852 -1.125 -11.538 430 3HZ LYS 53 HZ3 LYS 53 13.069 -2.583 -10.770 431 H LYS 54 H LYS 54 7.817 -0.093 -14.635 432 HA LYS 54 HA LYS 54 5.350 1.105 -15.600 433 1HB LYS 54 HB2 LYS 54 6.443 2.335 -17.423 434 2HB LYS 54 HB3 LYS 54 6.898 2.997 -15.856 435 1HG LYS 54 HG2 LYS 54 9.086 1.813 -15.978 436 2HG LYS 54 HG3 LYS 54 8.627 1.120 -17.543 437 1HD LYS 54 HD2 LYS 54 8.444 3.400 -18.503 438 2HD LYS 54 HD3 LYS 54 8.920 4.092 -16.934 439 1HE LYS 54 HE2 LYS 54 11.074 2.852 -17.048 440 2HE LYS 54 HE3 LYS 54 10.598 2.162 -18.605 441 1HZ LYS 54 HZ1 LYS 54 12.040 4.075 -18.887 442 2HZ LYS 54 HZ2 LYS 54 10.578 4.411 -19.519 443 3HZ LYS 54 HZ3 LYS 54 11.016 5.049 -18.080 444 H GLU 55 H GLU 55 4.960 0.367 -17.839 445 HA GLU 55 HA GLU 55 5.449 -2.387 -18.243 446 1HB GLU 55 HB2 GLU 55 4.837 -0.355 -20.438 447 2HB GLU 55 HB3 GLU 55 4.506 -2.082 -20.425 448 1HG GLU 55 HG2 GLU 55 2.416 -1.374 -19.919 449 2HG GLU 55 HG3 GLU 55 3.035 -1.439 -18.275 450 H GLY 56 H GLY 56 7.056 -3.510 -19.314 451 1HA GLY 56 HA2 GLY 56 8.800 -3.926 -20.701 452 2HA GLY 56 HA3 GLY 56 8.927 -2.211 -21.111 453 H ASP 57 H ASP 57 8.966 -2.100 -17.768 454 HA ASP 57 HA ASP 57 11.837 -1.704 -17.812 455 1HB ASP 57 HB2 ASP 57 10.255 -0.307 -16.464 456 2HB ASP 57 HB3 ASP 57 10.006 -1.691 -15.391 457 H PHE 58 H PHE 58 13.345 -2.713 -16.402 458 HA PHE 58 HA PHE 58 13.166 -5.633 -16.233 459 1HB PHE 58 HB2 PHE 58 15.298 -4.574 -16.759 460 2HB PHE 58 HB3 PHE 58 15.186 -3.549 -15.338 461 HD1 PHE 58 HD1 PHE 58 15.819 -4.337 -13.130 462 HD2 PHE 58 HD2 PHE 58 15.843 -7.018 -16.513 463 HE1 PHE 58 HE1 PHE 58 17.156 -5.973 -11.831 464 HE2 PHE 58 HE2 PHE 58 17.173 -8.650 -15.207 465 HZ PHE 58 HZ PHE 58 17.863 -8.118 -12.877 466 H VAL 59 H VAL 59 12.991 -6.835 -14.301 467 HA VAL 59 HA VAL 59 12.653 -5.412 -11.765 468 HB VAL 59 HB VAL 59 10.603 -6.799 -11.288 469 1HG1 VAL 59 HG11 VAL 59 9.049 -5.147 -12.159 470 2HG1 VAL 59 HG12 VAL 59 10.544 -4.366 -11.657 471 3HG1 VAL 59 HG13 VAL 59 10.212 -4.626 -13.387 472 1HG2 VAL 59 HG21 VAL 59 10.333 -6.962 -14.322 473 2HG2 VAL 59 HG22 VAL 59 10.686 -8.330 -13.238 474 3HG2 VAL 59 HG23 VAL 59 9.141 -7.467 -13.114 475 H ASN 60 H ASN 60 12.589 -6.925 -9.929 476 HA ASN 60 HA ASN 60 13.873 -9.495 -10.467 477 1HB ASN 60 HB2 ASN 60 15.478 -7.294 -9.970 478 2HB ASN 60 HB3 ASN 60 15.248 -7.958 -8.351 479 1HD2 ASN 60 HD22 ASN 60 15.868 -9.020 -11.749 480 2HD2 ASN 60 HD21 ASN 60 17.026 -10.267 -11.330 481 H GLU 61 H GLU 61 14.227 -10.716 -8.378 482 HA GLU 61 HA GLU 61 11.752 -10.942 -6.964 483 1HB GLU 61 HB2 GLU 61 13.240 -12.824 -7.318 484 2HB GLU 61 HB3 GLU 61 14.560 -12.018 -6.481 485 1HG GLU 61 HG2 GLU 61 13.183 -12.072 -4.364 486 2HG GLU 61 HG3 GLU 61 11.918 -12.928 -5.242 487 H GLY 62 H GLY 62 10.993 -9.466 -5.584 488 1HA GLY 62 HA2 GLY 62 10.926 -8.332 -3.566 489 2HA GLY 62 HA3 GLY 62 12.690 -8.358 -3.444 490 H ASP 63 H ASP 63 11.816 -7.348 -6.638 491 HA ASP 63 HA ASP 63 12.612 -4.608 -6.027 492 1HB ASP 63 HB2 ASP 63 13.317 -5.990 -8.059 493 2HB ASP 63 HB3 ASP 63 11.675 -5.783 -8.671 494 H VAL 64 H VAL 64 11.151 -3.004 -5.618 495 HA VAL 64 HA VAL 64 8.479 -3.743 -5.056 496 HB VAL 64 HB VAL 64 9.549 -0.904 -5.227 497 1HG1 VAL 64 HG11 VAL 64 7.107 -1.062 -4.847 498 2HG1 VAL 64 HG12 VAL 64 7.372 -2.232 -3.544 499 3HG1 VAL 64 HG13 VAL 64 7.909 -0.545 -3.364 500 1HG2 VAL 64 HG21 VAL 64 10.115 -1.164 -2.799 501 2HG2 VAL 64 HG22 VAL 64 9.806 -2.907 -2.936 502 3HG2 VAL 64 HG23 VAL 64 11.142 -2.149 -3.832 503 H LEU 65 H LEU 65 6.521 -3.169 -5.990 504 HA LEU 65 HA LEU 65 6.606 -2.197 -8.816 505 1HB LEU 65 HB2 LEU 65 5.899 -4.512 -8.707 506 2HB LEU 65 HB3 LEU 65 4.755 -4.159 -7.414 507 HG LEU 65 HG LEU 65 3.407 -2.753 -8.957 508 1HD1 LEU 65 HD11 LEU 65 3.823 -2.913 -11.417 509 2HD1 LEU 65 HD12 LEU 65 5.015 -1.959 -10.545 510 3HD1 LEU 65 HD13 LEU 65 5.419 -3.615 -11.066 511 1HD2 LEU 65 HD21 LEU 65 3.941 -5.527 -10.070 512 2HD2 LEU 65 HD22 LEU 65 2.922 -5.167 -8.656 513 3HD2 LEU 65 HD23 LEU 65 2.471 -4.564 -10.255 514 H LEU 66 H LEU 66 4.725 -2.131 -5.671 515 HA LEU 66 HA LEU 66 4.008 0.628 -6.308 516 1HB LEU 66 HB2 LEU 66 1.662 0.429 -6.304 517 2HB LEU 66 HB3 LEU 66 2.275 -0.582 -7.588 518 HG LEU 66 HG LEU 66 1.379 -1.676 -4.871 519 1HD1 LEU 66 HD11 LEU 66 -0.735 -2.245 -5.968 520 2HD1 LEU 66 HD12 LEU 66 -0.483 -0.492 -5.937 521 3HD1 LEU 66 HD13 LEU 66 -0.226 -1.402 -7.439 522 1HD2 LEU 66 HD21 LEU 66 2.770 -3.246 -6.232 523 2HD2 LEU 66 HD22 LEU 66 1.087 -3.785 -6.130 524 3HD2 LEU 66 HD23 LEU 66 1.670 -3.002 -7.606 525 H GLU 67 H GLU 67 2.732 1.671 -4.658 526 HA GLU 67 HA GLU 67 3.290 0.662 -1.909 527 1HB GLU 67 HB2 GLU 67 4.914 2.381 -2.720 528 2HB GLU 67 HB3 GLU 67 3.565 3.490 -3.014 529 1HG GLU 67 HG2 GLU 67 3.012 3.341 -0.557 530 2HG GLU 67 HG3 GLU 67 4.466 2.354 -0.343 531 H LEU 68 H LEU 68 1.541 1.166 -0.454 532 HA LEU 68 HA LEU 68 -0.992 2.028 -1.798 533 1HB LEU 68 HB2 LEU 68 -0.652 -0.222 0.229 534 2HB LEU 68 HB3 LEU 68 -2.151 0.275 -0.542 535 HG LEU 68 HG LEU 68 0.206 -1.055 -1.938 536 1HD1 LEU 68 HD11 LEU 68 -2.588 -2.094 -1.294 537 2HD1 LEU 68 HD12 LEU 68 -1.286 -2.981 -2.113 538 3HD1 LEU 68 HD13 LEU 68 -1.108 -2.525 -0.414 539 1HD2 LEU 68 HD21 LEU 68 -2.494 -0.176 -3.041 540 2HD2 LEU 68 HD22 LEU 68 -0.882 0.433 -3.504 541 3HD2 LEU 68 HD23 LEU 68 -1.316 -1.230 -3.861 542 H SER 69 H SER 69 -2.663 2.816 -0.361 543 HA SER 69 HA SER 69 -1.822 4.407 1.870 544 1HB SER 69 HB2 SER 69 -4.308 4.452 2.297 545 2HB SER 69 HB3 SER 69 -3.838 4.908 0.647 546 HG SER 69 HG SER 69 -5.634 3.286 1.071 547 H ASN 70 H ASN 70 -3.299 1.210 1.549 548 HA ASN 70 HA ASN 70 -3.322 0.561 4.351 549 1HB ASN 70 HB2 ASN 70 -4.963 -0.219 2.590 550 2HB ASN 70 HB3 ASN 70 -3.685 -1.246 1.930 551 1HD2 ASN 70 HD22 ASN 70 -5.219 -3.006 2.329 552 2HD2 ASN 70 HD21 ASN 70 -5.356 -3.696 3.942 553 H SER 71 H SER 71 -0.580 1.190 3.304 554 HA SER 71 HA SER 71 0.875 -1.366 3.501 555 1HB SER 71 HB2 SER 71 1.925 1.487 3.387 556 2HB SER 71 HB3 SER 71 2.874 -0.006 3.237 557 HG SER 71 HG SER 71 1.048 1.192 1.498 558 H THR 72 H THR 72 -0.692 -1.330 5.634 559 HA THR 72 HA THR 72 0.185 0.098 7.944 560 HB THR 72 HB THR 72 -1.230 -1.805 9.034 561 HG1 THR 72 HG1 THR 72 -1.175 -3.325 7.404 562 1HG2 THR 72 HG21 THR 72 -2.491 -0.053 6.869 563 2HG2 THR 72 HG22 THR 72 -3.335 -0.813 8.235 564 3HG2 THR 72 HG23 THR 72 -2.129 0.447 8.536 565 H GLN 73 H GLN 73 1.182 -0.837 9.864 566 HA GLN 73 HA GLN 73 2.909 -3.191 9.538 567 1HB GLN 73 HB2 GLN 73 3.931 -0.399 10.267 568 2HB GLN 73 HB3 GLN 73 4.831 -1.897 10.492 569 1HG GLN 73 HG2 GLN 73 4.779 -2.307 8.037 570 2HG GLN 73 HG3 GLN 73 3.932 -0.772 7.807 571 1HE2 GLN 73 HE22 GLN 73 5.081 1.240 8.182 572 2HE2 GLN 73 HE21 GLN 73 6.825 1.280 8.263 Start of MODEL 11 1 1H THR 2 H1 THR 2 3.440 -0.825 1.062 2 2H THR 2 H2 THR 2 2.288 -1.865 0.523 3 3H THR 2 H3 THR 2 3.519 -2.431 1.456 4 HA THR 2 HA THR 2 3.931 -1.157 -1.144 5 HB THR 2 HB THR 2 5.790 -3.055 0.316 6 HG1 THR 2 HG1 THR 2 5.795 -0.217 0.521 7 1HG2 THR 2 HG21 THR 2 6.387 -2.699 -2.013 8 2HG2 THR 2 HG22 THR 2 6.276 -0.933 -1.814 9 3HG2 THR 2 HG23 THR 2 7.547 -1.858 -0.982 10 H VAL 3 H VAL 3 3.995 -2.518 -3.051 11 HA VAL 3 HA VAL 3 3.452 -5.397 -2.631 12 HB VAL 3 HB VAL 3 2.118 -3.784 -4.834 13 1HG1 VAL 3 HG11 VAL 3 2.505 -6.179 -5.343 14 2HG1 VAL 3 HG12 VAL 3 1.677 -6.630 -3.834 15 3HG1 VAL 3 HG13 VAL 3 0.788 -5.837 -5.159 16 1HG2 VAL 3 HG21 VAL 3 1.006 -3.125 -2.738 17 2HG2 VAL 3 HG22 VAL 3 -0.049 -4.166 -3.698 18 3HG2 VAL 3 HG23 VAL 3 0.809 -4.830 -2.282 19 H SER 4 H SER 4 4.708 -6.639 -4.023 20 HA SER 4 HA SER 4 6.692 -5.246 -5.751 21 1HB SER 4 HB2 SER 4 7.251 -7.261 -3.538 22 2HB SER 4 HB3 SER 4 8.458 -6.469 -4.556 23 HG SER 4 HG SER 4 8.205 -5.488 -2.469 24 H ILE 5 H ILE 5 8.014 -6.801 -6.948 25 HA ILE 5 HA ILE 5 6.455 -9.058 -8.038 26 HB ILE 5 HB ILE 5 9.215 -7.995 -8.790 27 1HG1 ILE 5 HG12 ILE 5 7.720 -6.139 -9.149 28 2HG1 ILE 5 HG13 ILE 5 8.113 -6.848 -10.694 29 1HG2 ILE 5 HG21 ILE 5 8.735 -9.084 -10.995 30 2HG2 ILE 5 HG22 ILE 5 8.859 -10.224 -9.671 31 3HG2 ILE 5 HG23 ILE 5 7.260 -9.789 -10.302 32 1HD1 ILE 5 HD11 ILE 5 5.926 -7.988 -10.786 33 2HD1 ILE 5 HD12 ILE 5 5.496 -7.264 -9.214 34 3HD1 ILE 5 HD13 ILE 5 5.770 -6.239 -10.630 35 H GLN 6 H GLN 6 7.474 -11.228 -8.033 36 HA GLN 6 HA GLN 6 9.367 -11.724 -5.797 37 1HB GLN 6 HB2 GLN 6 7.910 -13.642 -5.091 38 2HB GLN 6 HB3 GLN 6 7.351 -12.041 -4.692 39 1HG GLN 6 HG2 GLN 6 6.302 -13.411 -7.192 40 2HG GLN 6 HG3 GLN 6 5.678 -13.846 -5.608 41 1HE2 GLN 6 HE22 GLN 6 5.025 -11.783 -8.186 42 2HE2 GLN 6 HE21 GLN 6 4.228 -10.498 -7.296 43 H MET 7 H MET 7 9.710 -11.666 -8.730 44 HA MET 7 HA MET 7 11.197 -14.114 -8.981 45 1HB MET 7 HB2 MET 7 10.198 -14.760 -11.151 46 2HB MET 7 HB3 MET 7 9.085 -15.004 -9.815 47 1HG MET 7 HG2 MET 7 8.996 -12.556 -11.611 48 2HG MET 7 HG3 MET 7 8.158 -14.051 -11.979 49 1HE MET 7 HE1 MET 7 5.694 -13.470 -12.077 50 2HE MET 7 HE2 MET 7 5.976 -14.863 -11.004 51 3HE MET 7 HE3 MET 7 4.808 -13.604 -10.546 52 H ALA 8 H ALA 8 12.684 -13.905 -10.844 53 HA ALA 8 HA ALA 8 13.313 -11.101 -11.506 54 1HB ALA 8 HB1 ALA 8 15.117 -12.663 -10.884 55 2HB ALA 8 HB2 ALA 8 14.682 -13.709 -12.261 56 3HB ALA 8 HB3 ALA 8 15.302 -12.069 -12.553 57 H GLY 9 H GLY 9 12.984 -10.130 -13.497 58 1HA GLY 9 HA2 GLY 9 12.719 -11.457 -15.954 59 2HA GLY 9 HA3 GLY 9 11.089 -11.310 -15.299 60 H ASN 10 H ASN 10 10.423 -9.864 -16.924 61 HA ASN 10 HA ASN 10 11.311 -7.040 -16.567 62 1HB ASN 10 HB2 ASN 10 11.219 -8.621 -19.155 63 2HB ASN 10 HB3 ASN 10 10.683 -6.947 -19.149 64 1HD2 ASN 10 HD22 ASN 10 13.422 -7.997 -17.043 65 2HD2 ASN 10 HD21 ASN 10 14.629 -7.178 -18.013 66 H LEU 11 H LEU 11 9.517 -5.699 -16.511 67 HA LEU 11 HA LEU 11 7.081 -7.143 -15.948 68 1HB LEU 11 HB2 LEU 11 8.151 -5.125 -14.713 69 2HB LEU 11 HB3 LEU 11 7.456 -4.135 -15.996 70 HG LEU 11 HG LEU 11 5.185 -5.075 -15.397 71 1HD1 LEU 11 HD11 LEU 11 5.781 -7.195 -14.262 72 2HD1 LEU 11 HD12 LEU 11 6.717 -6.307 -13.046 73 3HD1 LEU 11 HD13 LEU 11 4.954 -6.142 -13.127 74 1HD2 LEU 11 HD21 LEU 11 5.009 -3.726 -13.344 75 2HD2 LEU 11 HD22 LEU 11 6.765 -3.791 -13.129 76 3HD2 LEU 11 HD23 LEU 11 6.056 -2.921 -14.518 77 H TRP 12 H TRP 12 5.438 -7.520 -17.341 78 HA TRP 12 HA TRP 12 5.850 -6.818 -20.120 79 1HB TRP 12 HB2 TRP 12 5.028 -9.045 -19.057 80 2HB TRP 12 HB3 TRP 12 3.470 -8.258 -18.900 81 HD1 TRP 12 HD1 TRP 12 6.042 -8.905 -21.651 82 HE1 TRP 12 HE1 TRP 12 4.883 -9.604 -23.829 83 HE3 TRP 12 HE3 TRP 12 1.202 -8.546 -20.091 84 HZ2 TRP 12 HZ2 TRP 12 2.156 -9.982 -24.758 85 HZ3 TRP 12 HZ3 TRP 12 -0.665 -9.099 -21.623 86 HH2 TRP 12 HH2 TRP 12 -0.201 -9.815 -23.959 87 H LYS 13 H LYS 13 3.243 -6.221 -17.705 88 HA LYS 13 HA LYS 13 2.381 -3.751 -19.052 89 1HB LYS 13 HB2 LYS 13 0.632 -6.216 -18.602 90 2HB LYS 13 HB3 LYS 13 -0.026 -4.613 -18.938 91 1HG LYS 13 HG2 LYS 13 1.796 -6.103 -20.857 92 2HG LYS 13 HG3 LYS 13 0.049 -6.222 -20.881 93 1HD LYS 13 HD2 LYS 13 -0.290 -4.051 -21.578 94 2HD LYS 13 HD3 LYS 13 1.279 -3.462 -21.022 95 1HE LYS 13 HE2 LYS 13 1.113 -5.573 -23.197 96 2HE LYS 13 HE3 LYS 13 0.867 -3.867 -23.593 97 1HZ LYS 13 HZ1 LYS 13 3.204 -4.612 -23.809 98 2HZ LYS 13 HZ2 LYS 13 2.995 -3.324 -22.812 99 3HZ LYS 13 HZ3 LYS 13 3.286 -4.801 -22.168 100 H VAL 14 H VAL 14 0.893 -2.556 -17.599 101 HA VAL 14 HA VAL 14 0.738 -3.482 -14.800 102 HB VAL 14 HB VAL 14 1.807 -0.756 -15.682 103 1HG1 VAL 14 HG11 VAL 14 2.143 -0.361 -13.235 104 2HG1 VAL 14 HG12 VAL 14 0.443 -0.474 -13.669 105 3HG1 VAL 14 HG13 VAL 14 1.251 -1.858 -12.886 106 1HG2 VAL 14 HG21 VAL 14 3.573 -2.426 -15.832 107 2HG2 VAL 14 HG22 VAL 14 3.838 -1.498 -14.357 108 3HG2 VAL 14 HG23 VAL 14 3.094 -3.116 -14.264 109 H HIS 15 H HIS 15 -1.146 -2.714 -13.799 110 HA HIS 15 HA HIS 15 -3.163 -1.496 -15.638 111 1HB HIS 15 HB2 HIS 15 -3.806 -3.623 -13.604 112 2HB HIS 15 HB3 HIS 15 -4.698 -3.171 -15.050 113 HD1 HIS 15 HD1 HIS 15 -2.401 -3.689 -17.257 114 HD2 HIS 15 HD2 HIS 15 -3.231 -6.068 -13.892 115 HE1 HIS 15 HE1 HIS 15 -1.353 -5.985 -17.700 116 H VAL 16 H VAL 16 -1.564 -0.177 -13.421 117 HA VAL 16 HA VAL 16 -3.843 0.778 -11.768 118 HB VAL 16 HB VAL 16 -2.256 0.999 -9.868 119 1HG1 VAL 16 HG11 VAL 16 -2.406 -1.292 -9.077 120 2HG1 VAL 16 HG12 VAL 16 -3.894 -0.833 -9.916 121 3HG1 VAL 16 HG13 VAL 16 -2.710 -1.880 -10.730 122 1HG2 VAL 16 HG21 VAL 16 -0.445 -1.017 -11.225 123 2HG2 VAL 16 HG22 VAL 16 -0.131 0.733 -11.275 124 3HG2 VAL 16 HG23 VAL 16 -0.191 -0.093 -9.727 125 H LYS 17 H LYS 17 -3.397 2.855 -10.742 126 HA LYS 17 HA LYS 17 -1.254 4.502 -11.765 127 1HB LYS 17 HB2 LYS 17 -2.737 6.365 -12.398 128 2HB LYS 17 HB3 LYS 17 -2.949 4.985 -13.472 129 1HG LYS 17 HG2 LYS 17 -5.028 4.344 -12.324 130 2HG LYS 17 HG3 LYS 17 -4.834 5.650 -11.152 131 1HD LYS 17 HD2 LYS 17 -5.178 6.056 -14.151 132 2HD LYS 17 HD3 LYS 17 -6.482 6.127 -12.954 133 1HE LYS 17 HE2 LYS 17 -5.289 7.977 -11.773 134 2HE LYS 17 HE3 LYS 17 -4.037 7.953 -13.019 135 1HZ LYS 17 HZ1 LYS 17 -6.895 8.571 -13.495 136 2HZ LYS 17 HZ2 LYS 17 -5.681 9.655 -13.462 137 3HZ LYS 17 HZ3 LYS 17 -5.736 8.542 -14.648 138 H ALA 18 H ALA 18 -1.084 6.435 -10.299 139 HA ALA 18 HA ALA 18 -1.695 5.892 -7.576 140 1HB ALA 18 HB1 ALA 18 0.081 7.466 -8.257 141 2HB ALA 18 HB2 ALA 18 -1.145 8.570 -8.932 142 3HB ALA 18 HB3 ALA 18 -1.094 8.252 -7.185 143 H GLY 19 H GLY 19 -3.454 6.339 -6.337 144 1HA GLY 19 HA2 GLY 19 -5.466 7.297 -5.699 145 2HA GLY 19 HA3 GLY 19 -5.673 8.015 -7.301 146 H ASP 20 H ASP 20 -4.898 4.882 -8.096 147 HA ASP 20 HA ASP 20 -7.655 4.097 -8.537 148 1HB ASP 20 HB2 ASP 20 -5.699 3.520 -10.030 149 2HB ASP 20 HB3 ASP 20 -5.132 2.416 -8.768 150 H GLN 21 H GLN 21 -8.401 1.879 -7.782 151 HA GLN 21 HA GLN 21 -7.699 1.361 -4.914 152 1HB GLN 21 HB2 GLN 21 -10.012 2.174 -5.171 153 2HB GLN 21 HB3 GLN 21 -10.295 1.025 -6.473 154 1HG GLN 21 HG2 GLN 21 -11.403 0.130 -4.618 155 2HG GLN 21 HG3 GLN 21 -9.982 -0.868 -4.803 156 1HE2 GLN 21 HE22 GLN 21 -8.797 -1.234 -2.863 157 2HE2 GLN 21 HE21 GLN 21 -8.992 -0.242 -1.437 158 H ILE 22 H ILE 22 -6.972 -0.692 -4.493 159 HA ILE 22 HA ILE 22 -7.549 -2.813 -6.473 160 HB ILE 22 HB ILE 22 -5.393 -3.769 -6.342 161 1HG1 ILE 22 HG12 ILE 22 -4.620 -1.628 -4.316 162 2HG1 ILE 22 HG13 ILE 22 -4.821 -3.357 -4.008 163 1HG2 ILE 22 HG21 ILE 22 -4.957 -0.787 -6.786 164 2HG2 ILE 22 HG22 ILE 22 -4.044 -2.119 -7.504 165 3HG2 ILE 22 HG23 ILE 22 -5.725 -1.873 -7.955 166 1HD1 ILE 22 HD11 ILE 22 -2.659 -2.015 -5.654 167 2HD1 ILE 22 HD12 ILE 22 -2.490 -3.018 -4.195 168 3HD1 ILE 22 HD13 ILE 22 -2.958 -3.761 -5.717 169 H GLU 23 H GLU 23 -7.388 -4.998 -5.460 170 HA GLU 23 HA GLU 23 -8.114 -5.038 -2.603 171 1HB GLU 23 HB2 GLU 23 -10.183 -4.815 -3.868 172 2HB GLU 23 HB3 GLU 23 -9.731 -6.181 -4.910 173 1HG GLU 23 HG2 GLU 23 -9.816 -7.696 -2.951 174 2HG GLU 23 HG3 GLU 23 -10.180 -6.330 -1.895 175 H LYS 24 H LYS 24 -7.425 -7.049 -1.651 176 HA LYS 24 HA LYS 24 -5.156 -8.251 -2.693 177 1HB LYS 24 HB2 LYS 24 -5.946 -8.409 -0.346 178 2HB LYS 24 HB3 LYS 24 -7.213 -9.536 -0.844 179 1HG LYS 24 HG2 LYS 24 -5.540 -11.193 -1.535 180 2HG LYS 24 HG3 LYS 24 -4.239 -10.030 -1.302 181 1HD LYS 24 HD2 LYS 24 -4.259 -11.586 0.562 182 2HD LYS 24 HD3 LYS 24 -4.663 -9.969 1.117 183 1HE LYS 24 HE2 LYS 24 -6.094 -11.506 2.260 184 2HE LYS 24 HE3 LYS 24 -7.092 -10.588 1.135 185 1HZ LYS 24 HZ1 LYS 24 -6.085 -13.344 0.678 186 2HZ LYS 24 HZ2 LYS 24 -7.605 -12.954 1.106 187 3HZ LYS 24 HZ3 LYS 24 -7.046 -12.516 -0.359 188 H GLY 25 H GLY 25 -4.722 -9.632 -4.346 189 1HA GLY 25 HA2 GLY 25 -5.006 -11.531 -5.653 190 2HA GLY 25 HA3 GLY 25 -6.701 -11.649 -5.181 191 H GLN 26 H GLN 26 -6.535 -8.436 -6.010 192 HA GLN 26 HA GLN 26 -7.631 -8.747 -8.646 193 1HB GLN 26 HB2 GLN 26 -8.019 -6.848 -7.013 194 2HB GLN 26 HB3 GLN 26 -6.360 -6.295 -7.342 195 1HG GLN 26 HG2 GLN 26 -6.969 -5.938 -9.712 196 2HG GLN 26 HG3 GLN 26 -8.598 -6.551 -9.407 197 1HE2 GLN 26 HE22 GLN 26 -6.821 -3.708 -9.678 198 2HE2 GLN 26 HE21 GLN 26 -7.842 -2.644 -8.725 199 H GLU 27 H GLU 27 -6.532 -8.741 -10.610 200 HA GLU 27 HA GLU 27 -3.644 -9.038 -10.698 201 1HB GLU 27 HB2 GLU 27 -5.297 -10.102 -12.271 202 2HB GLU 27 HB3 GLU 27 -5.670 -8.500 -12.914 203 1HG GLU 27 HG2 GLU 27 -3.243 -8.287 -13.590 204 2HG GLU 27 HG3 GLU 27 -2.973 -9.925 -13.001 205 H VAL 28 H VAL 28 -2.158 -7.413 -10.908 206 HA VAL 28 HA VAL 28 -3.090 -4.646 -11.516 207 HB VAL 28 HB VAL 28 -1.474 -3.857 -9.764 208 1HG1 VAL 28 HG11 VAL 28 -2.996 -4.184 -7.895 209 2HG1 VAL 28 HG12 VAL 28 -3.914 -3.869 -9.380 210 3HG1 VAL 28 HG13 VAL 28 -3.812 -5.518 -8.729 211 1HG2 VAL 28 HG21 VAL 28 -0.172 -5.966 -9.439 212 2HG2 VAL 28 HG22 VAL 28 -0.861 -5.342 -7.927 213 3HG2 VAL 28 HG23 VAL 28 -1.630 -6.713 -8.737 214 H ALA 29 H ALA 29 -0.665 -7.155 -12.063 215 HA ALA 29 HA ALA 29 0.231 -5.567 -14.307 216 1HB ALA 29 HB1 ALA 29 2.236 -6.258 -12.092 217 2HB ALA 29 HB2 ALA 29 2.668 -5.690 -13.713 218 3HB ALA 29 HB3 ALA 29 1.763 -4.639 -12.622 219 H ILE 30 H ILE 30 2.085 -6.904 -15.399 220 HA ILE 30 HA ILE 30 1.747 -9.829 -15.026 221 HB ILE 30 HB ILE 30 1.511 -8.323 -17.664 222 1HG1 ILE 30 HG12 ILE 30 -0.411 -10.360 -16.454 223 2HG1 ILE 30 HG13 ILE 30 -0.594 -8.626 -16.261 224 1HG2 ILE 30 HG21 ILE 30 1.439 -10.552 -18.782 225 2HG2 ILE 30 HG22 ILE 30 2.981 -10.301 -18.003 226 3HG2 ILE 30 HG23 ILE 30 1.763 -11.335 -17.225 227 1HD1 ILE 30 HD11 ILE 30 -2.050 -9.327 -18.018 228 2HD1 ILE 30 HD12 ILE 30 -0.762 -8.334 -18.719 229 3HD1 ILE 30 HD13 ILE 30 -0.734 -10.108 -18.903 230 H LEU 31 H LEU 31 3.672 -10.887 -15.366 231 HA LEU 31 HA LEU 31 6.155 -9.279 -15.805 232 1HB LEU 31 HB2 LEU 31 5.946 -9.983 -13.551 233 2HB LEU 31 HB3 LEU 31 5.436 -11.625 -13.986 234 HG LEU 31 HG LEU 31 7.658 -11.282 -12.941 235 1HD1 LEU 31 HD11 LEU 31 7.754 -12.754 -15.595 236 2HD1 LEU 31 HD12 LEU 31 8.811 -12.991 -14.188 237 3HD1 LEU 31 HD13 LEU 31 7.087 -13.368 -14.073 238 1HD2 LEU 31 HD21 LEU 31 8.758 -10.470 -15.617 239 2HD2 LEU 31 HD22 LEU 31 8.224 -9.267 -14.429 240 3HD2 LEU 31 HD23 LEU 31 9.499 -10.423 -14.005 241 H GLU 32 H GLU 32 7.583 -10.117 -17.344 242 HA GLU 32 HA GLU 32 6.794 -12.618 -18.751 243 1HB GLU 32 HB2 GLU 32 6.453 -10.632 -20.096 244 2HB GLU 32 HB3 GLU 32 8.103 -10.082 -19.822 245 1HG GLU 32 HG2 GLU 32 7.441 -12.745 -21.147 246 2HG GLU 32 HG3 GLU 32 7.505 -11.243 -22.054 247 H SER 33 H SER 33 8.244 -14.211 -18.510 248 HA SER 33 HA SER 33 11.063 -13.851 -18.386 249 1HB SER 33 HB2 SER 33 10.265 -13.153 -15.996 250 2HB SER 33 HB3 SER 33 9.857 -14.856 -15.770 251 HG SER 33 HG SER 33 12.002 -14.064 -15.116 252 H MET 34 H MET 34 12.039 -16.127 -17.886 253 HA MET 34 HA MET 34 12.188 -18.258 -18.680 254 1HB MET 34 HB2 MET 34 10.865 -19.837 -17.311 255 2HB MET 34 HB3 MET 34 11.655 -18.558 -16.401 256 1HG MET 34 HG2 MET 34 9.518 -17.336 -16.223 257 2HG MET 34 HG3 MET 34 8.698 -18.626 -17.108 258 1HE MET 34 HE1 MET 34 8.041 -17.199 -14.235 259 2HE MET 34 HE2 MET 34 6.961 -18.388 -14.998 260 3HE MET 34 HE3 MET 34 7.463 -18.598 -13.307 261 H LYS 35 H LYS 35 10.998 -16.787 -20.644 262 HA LYS 35 HA LYS 35 9.799 -16.819 -22.534 263 1HB LYS 35 HB2 LYS 35 10.099 -19.838 -22.308 264 2HB LYS 35 HB3 LYS 35 9.672 -18.937 -23.766 265 1HG LYS 35 HG2 LYS 35 11.859 -17.754 -23.693 266 2HG LYS 35 HG3 LYS 35 12.297 -18.656 -22.240 267 1HD LYS 35 HD2 LYS 35 13.374 -19.695 -24.129 268 2HD LYS 35 HD3 LYS 35 12.162 -20.782 -23.466 269 1HE LYS 35 HE2 LYS 35 12.065 -20.919 -25.859 270 2HE LYS 35 HE3 LYS 35 10.586 -20.144 -25.296 271 1HZ LYS 35 HZ1 LYS 35 11.530 -19.020 -27.218 272 2HZ LYS 35 HZ2 LYS 35 11.554 -18.002 -25.949 273 3HZ LYS 35 HZ3 LYS 35 12.932 -18.734 -26.445 274 H MET 36 H MET 36 8.199 -16.600 -20.156 275 HA MET 36 HA MET 36 5.565 -17.410 -21.220 276 1HB MET 36 HB2 MET 36 6.675 -17.987 -18.430 277 2HB MET 36 HB3 MET 36 4.955 -18.004 -18.815 278 1HG MET 36 HG2 MET 36 5.306 -19.816 -20.444 279 2HG MET 36 HG3 MET 36 7.034 -19.798 -20.101 280 1HE MET 36 HE1 MET 36 3.460 -20.704 -18.811 281 2HE MET 36 HE2 MET 36 3.769 -21.325 -17.175 282 3HE MET 36 HE3 MET 36 3.936 -19.590 -17.505 283 H GLU 37 H GLU 37 3.846 -16.257 -19.923 284 HA GLU 37 HA GLU 37 4.755 -13.694 -18.743 285 1HB GLU 37 HB2 GLU 37 2.220 -14.129 -20.381 286 2HB GLU 37 HB3 GLU 37 2.640 -12.692 -19.462 287 1HG GLU 37 HG2 GLU 37 3.187 -12.091 -21.632 288 2HG GLU 37 HG3 GLU 37 4.740 -12.484 -20.906 289 H ILE 38 H ILE 38 3.813 -13.312 -16.745 290 HA ILE 38 HA ILE 38 2.050 -15.412 -15.602 291 HB ILE 38 HB ILE 38 4.602 -14.290 -14.343 292 1HG1 ILE 38 HG12 ILE 38 5.156 -16.933 -14.535 293 2HG1 ILE 38 HG13 ILE 38 4.162 -16.797 -15.969 294 1HG2 ILE 38 HG21 ILE 38 2.870 -14.941 -12.703 295 2HG2 ILE 38 HG22 ILE 38 2.763 -16.553 -13.449 296 3HG2 ILE 38 HG23 ILE 38 4.251 -16.029 -12.637 297 1HD1 ILE 38 HD11 ILE 38 5.759 -14.935 -16.752 298 2HD1 ILE 38 HD12 ILE 38 6.733 -15.287 -15.315 299 3HD1 ILE 38 HD13 ILE 38 6.507 -16.524 -16.555 300 HA PRO 39 HA PRO 39 0.140 -11.547 -14.337 301 1HB PRO 39 HB2 PRO 39 -1.739 -12.430 -12.548 302 2HB PRO 39 HB3 PRO 39 -1.873 -12.680 -14.316 303 1HG PRO 39 HG2 PRO 39 -0.834 -14.633 -12.243 304 2HG PRO 39 HG3 PRO 39 -2.034 -14.931 -13.543 305 1HD PRO 39 HD2 PRO 39 0.596 -15.574 -13.835 306 2HD PRO 39 HD3 PRO 39 -0.358 -14.944 -15.211 307 H ILE 40 H ILE 40 0.148 -10.100 -12.598 308 HA ILE 40 HA ILE 40 1.487 -10.899 -10.058 309 HB ILE 40 HB ILE 40 1.727 -8.336 -11.659 310 1HG1 ILE 40 HG12 ILE 40 3.121 -10.101 -12.643 311 2HG1 ILE 40 HG13 ILE 40 4.051 -8.765 -12.003 312 1HG2 ILE 40 HG21 ILE 40 2.947 -8.983 -8.952 313 2HG2 ILE 40 HG22 ILE 40 3.314 -7.554 -9.948 314 3HG2 ILE 40 HG23 ILE 40 1.697 -7.777 -9.302 315 1HD1 ILE 40 HD11 ILE 40 4.687 -10.091 -10.024 316 2HD1 ILE 40 HD12 ILE 40 3.667 -11.439 -10.583 317 3HD1 ILE 40 HD13 ILE 40 5.091 -10.950 -11.512 318 H VAL 41 H VAL 41 0.183 -10.537 -8.384 319 HA VAL 41 HA VAL 41 -2.314 -8.996 -8.796 320 HB VAL 41 HB VAL 41 -3.256 -10.612 -7.075 321 1HG1 VAL 41 HG11 VAL 41 -3.704 -12.395 -8.718 322 2HG1 VAL 41 HG12 VAL 41 -3.924 -10.782 -9.377 323 3HG1 VAL 41 HG13 VAL 41 -2.462 -11.713 -9.798 324 1HG2 VAL 41 HG21 VAL 41 -0.893 -12.371 -7.858 325 2HG2 VAL 41 HG22 VAL 41 -1.078 -11.567 -6.279 326 3HG2 VAL 41 HG23 VAL 41 -2.247 -12.790 -6.797 327 H ALA 42 H ALA 42 -3.236 -8.020 -6.953 328 HA ALA 42 HA ALA 42 -1.459 -6.522 -5.317 329 1HB ALA 42 HB1 ALA 42 -3.772 -5.854 -6.046 330 2HB ALA 42 HB2 ALA 42 -4.424 -7.113 -4.989 331 3HB ALA 42 HB3 ALA 42 -3.547 -5.745 -4.284 332 H ASP 43 H ASP 43 -0.346 -7.284 -3.573 333 HA ASP 43 HA ASP 43 -0.883 -9.788 -2.285 334 1HB ASP 43 HB2 ASP 43 1.355 -8.778 -2.393 335 2HB ASP 43 HB3 ASP 43 0.806 -7.402 -1.431 336 H ARG 44 H ARG 44 -2.143 -6.577 -1.799 337 HA ARG 44 HA ARG 44 -3.961 -7.447 0.286 338 1HB ARG 44 HB2 ARG 44 -3.390 -5.480 1.756 339 2HB ARG 44 HB3 ARG 44 -2.190 -6.768 1.783 340 1HG ARG 44 HG2 ARG 44 -0.612 -5.551 0.552 341 2HG ARG 44 HG3 ARG 44 -1.813 -4.468 -0.145 342 1HD ARG 44 HD2 ARG 44 -1.103 -4.429 2.806 343 2HD ARG 44 HD3 ARG 44 -0.283 -3.462 1.562 344 HE ARG 44 HE ARG 44 -3.198 -3.218 1.523 345 1HH1 ARG 44 HH11 ARG 44 -0.283 -1.756 3.003 346 2HH1 ARG 44 HH12 ARG 44 -1.011 -0.169 3.017 347 1HH2 ARG 44 HH21 ARG 44 -4.082 -1.205 1.692 348 2HH2 ARG 44 HH22 ARG 44 -3.148 0.154 2.307 349 H SER 45 H SER 45 -5.656 -5.757 0.573 350 HA SER 45 HA SER 45 -6.245 -4.268 -1.831 351 1HB SER 45 HB2 SER 45 -7.502 -4.138 0.937 352 2HB SER 45 HB3 SER 45 -8.277 -3.709 -0.602 353 HG SER 45 HG SER 45 -8.801 -5.843 0.269 354 H GLY 46 H GLY 46 -6.499 -1.904 -1.934 355 1HA GLY 46 HA2 GLY 46 -6.222 -0.105 0.116 356 2HA GLY 46 HA3 GLY 46 -4.553 -0.362 -0.416 357 H ILE 47 H ILE 47 -5.263 2.101 -0.676 358 HA ILE 47 HA ILE 47 -6.168 2.616 -3.459 359 HB ILE 47 HB ILE 47 -5.378 4.451 -1.152 360 1HG1 ILE 47 HG12 ILE 47 -7.621 3.468 -0.872 361 2HG1 ILE 47 HG13 ILE 47 -7.670 5.205 -1.106 362 1HG2 ILE 47 HG21 ILE 47 -6.133 6.336 -2.638 363 2HG2 ILE 47 HG22 ILE 47 -4.638 5.558 -3.154 364 3HG2 ILE 47 HG23 ILE 47 -6.154 5.192 -4.000 365 1HD1 ILE 47 HD11 ILE 47 -9.483 4.089 -2.322 366 2HD1 ILE 47 HD12 ILE 47 -8.401 4.901 -3.458 367 3HD1 ILE 47 HD13 ILE 47 -8.317 3.135 -3.255 368 H VAL 48 H VAL 48 -4.627 3.020 -4.999 369 HA VAL 48 HA VAL 48 -1.848 2.338 -4.522 370 HB VAL 48 HB VAL 48 -3.160 3.588 -6.932 371 1HG1 VAL 48 HG11 VAL 48 -0.564 1.979 -6.624 372 2HG1 VAL 48 HG12 VAL 48 -1.247 2.600 -8.143 373 3HG1 VAL 48 HG13 VAL 48 -0.659 3.730 -6.918 374 1HG2 VAL 48 HG21 VAL 48 -2.682 0.648 -6.253 375 2HG2 VAL 48 HG22 VAL 48 -4.260 1.445 -6.432 376 3HG2 VAL 48 HG23 VAL 48 -3.213 1.272 -7.833 377 H LYS 49 H LYS 49 -0.762 3.641 -3.188 378 HA LYS 49 HA LYS 49 -1.154 6.532 -3.076 379 1HB LYS 49 HB2 LYS 49 -0.503 5.197 -1.093 380 2HB LYS 49 HB3 LYS 49 0.999 4.714 -1.894 381 1HG LYS 49 HG2 LYS 49 1.704 7.109 -1.966 382 2HG LYS 49 HG3 LYS 49 0.198 7.558 -1.139 383 1HD LYS 49 HD2 LYS 49 0.869 6.153 0.807 384 2HD LYS 49 HD3 LYS 49 2.367 5.709 -0.040 385 1HE LYS 49 HE2 LYS 49 2.980 8.138 -0.158 386 2HE LYS 49 HE3 LYS 49 1.527 8.534 0.765 387 1HZ LYS 49 HZ1 LYS 49 3.780 6.870 1.743 388 2HZ LYS 49 HZ2 LYS 49 3.472 8.406 2.183 389 3HZ LYS 49 HZ3 LYS 49 2.435 7.224 2.608 390 H GLU 50 H GLU 50 1.179 4.181 -4.564 391 HA GLU 50 HA GLU 50 1.870 6.208 -6.551 392 1HB GLU 50 HB2 GLU 50 3.336 6.622 -4.449 393 2HB GLU 50 HB3 GLU 50 4.134 5.097 -4.826 394 1HG GLU 50 HG2 GLU 50 4.965 5.974 -6.917 395 2HG GLU 50 HG3 GLU 50 3.882 7.364 -6.843 396 H VAL 51 H VAL 51 3.378 5.182 -8.246 397 HA VAL 51 HA VAL 51 3.296 2.211 -8.257 398 HB VAL 51 HB VAL 51 2.768 4.005 -10.670 399 1HG1 VAL 51 HG11 VAL 51 2.174 1.866 -11.795 400 2HG1 VAL 51 HG12 VAL 51 3.860 1.876 -11.280 401 3HG1 VAL 51 HG13 VAL 51 2.653 0.964 -10.342 402 1HG2 VAL 51 HG21 VAL 51 0.784 4.040 -9.213 403 2HG2 VAL 51 HG22 VAL 51 0.469 3.060 -10.643 404 3HG2 VAL 51 HG23 VAL 51 0.832 2.264 -9.093 405 H LYS 52 H LYS 52 5.284 1.332 -8.896 406 HA LYS 52 HA LYS 52 7.487 3.350 -9.131 407 1HB LYS 52 HB2 LYS 52 7.503 0.640 -7.751 408 2HB LYS 52 HB3 LYS 52 8.800 1.825 -7.735 409 1HG LYS 52 HG2 LYS 52 6.072 2.074 -6.401 410 2HG LYS 52 HG3 LYS 52 7.617 1.830 -5.607 411 1HD LYS 52 HD2 LYS 52 6.881 4.340 -7.169 412 2HD LYS 52 HD3 LYS 52 6.732 4.143 -5.426 413 1HE LYS 52 HE2 LYS 52 9.111 3.858 -5.152 414 2HE LYS 52 HE3 LYS 52 9.380 3.807 -6.901 415 1HZ LYS 52 HZ1 LYS 52 8.183 6.167 -5.579 416 2HZ LYS 52 HZ2 LYS 52 9.815 5.998 -5.761 417 3HZ LYS 52 HZ3 LYS 52 8.845 6.081 -7.070 418 H LYS 53 H LYS 53 5.988 1.248 -11.150 419 HA LYS 53 HA LYS 53 8.483 0.658 -12.616 420 1HB LYS 53 HB2 LYS 53 6.359 -1.407 -11.862 421 2HB LYS 53 HB3 LYS 53 7.605 -1.667 -13.081 422 1HG LYS 53 HG2 LYS 53 8.214 -1.129 -10.151 423 2HG LYS 53 HG3 LYS 53 8.103 -2.732 -10.889 424 1HD LYS 53 HD2 LYS 53 9.907 -2.189 -12.454 425 2HD LYS 53 HD3 LYS 53 10.060 -0.562 -11.769 426 1HE LYS 53 HE2 LYS 53 10.758 -1.486 -9.607 427 2HE LYS 53 HE3 LYS 53 10.512 -3.125 -10.182 428 1HZ LYS 53 HZ1 LYS 53 12.752 -2.729 -10.460 429 2HZ LYS 53 HZ2 LYS 53 12.184 -2.543 -11.987 430 3HZ LYS 53 HZ3 LYS 53 12.555 -1.214 -11.116 431 H LYS 54 H LYS 54 7.820 -0.345 -14.829 432 HA LYS 54 HA LYS 54 5.410 0.831 -15.982 433 1HB LYS 54 HB2 LYS 54 6.679 2.169 -17.619 434 2HB LYS 54 HB3 LYS 54 6.937 2.750 -15.980 435 1HG LYS 54 HG2 LYS 54 9.147 1.635 -15.899 436 2HG LYS 54 HG3 LYS 54 8.895 0.989 -17.532 437 1HD LYS 54 HD2 LYS 54 8.714 3.315 -18.402 438 2HD LYS 54 HD3 LYS 54 9.051 3.947 -16.788 439 1HE LYS 54 HE2 LYS 54 10.921 2.147 -18.407 440 2HE LYS 54 HE3 LYS 54 11.019 3.907 -18.347 441 1HZ LYS 54 HZ1 LYS 54 11.394 3.698 -15.922 442 2HZ LYS 54 HZ2 LYS 54 11.485 2.056 -16.072 443 3HZ LYS 54 HZ3 LYS 54 12.567 3.012 -16.817 444 H GLU 55 H GLU 55 5.502 0.329 -18.453 445 HA GLU 55 HA GLU 55 5.865 -2.463 -18.874 446 1HB GLU 55 HB2 GLU 55 5.693 -0.139 -20.849 447 2HB GLU 55 HB3 GLU 55 5.628 -1.850 -21.291 448 1HG GLU 55 HG2 GLU 55 3.589 -2.144 -19.931 449 2HG GLU 55 HG3 GLU 55 3.633 -0.442 -19.464 450 H GLY 56 H GLY 56 7.618 -3.633 -19.440 451 1HA GLY 56 HA2 GLY 56 9.599 -4.220 -20.383 452 2HA GLY 56 HA3 GLY 56 9.823 -2.571 -20.986 453 H ASP 57 H ASP 57 9.202 -2.354 -17.629 454 HA ASP 57 HA ASP 57 11.954 -1.629 -17.113 455 1HB ASP 57 HB2 ASP 57 9.756 -0.712 -16.045 456 2HB ASP 57 HB3 ASP 57 9.890 -2.080 -14.944 457 H PHE 58 H PHE 58 13.517 -2.788 -15.931 458 HA PHE 58 HA PHE 58 13.305 -5.684 -15.847 459 1HB PHE 58 HB2 PHE 58 15.458 -4.565 -16.202 460 2HB PHE 58 HB3 PHE 58 15.292 -3.707 -14.677 461 HD1 PHE 58 HD1 PHE 58 15.757 -4.795 -12.532 462 HD2 PHE 58 HD2 PHE 58 16.011 -6.997 -16.235 463 HE1 PHE 58 HE1 PHE 58 16.980 -6.615 -11.373 464 HE2 PHE 58 HE2 PHE 58 17.220 -8.819 -15.067 465 HZ PHE 58 HZ PHE 58 17.729 -8.623 -12.641 466 H VAL 59 H VAL 59 12.903 -7.002 -14.020 467 HA VAL 59 HA VAL 59 12.362 -5.674 -11.446 468 HB VAL 59 HB VAL 59 10.257 -7.112 -11.288 469 1HG1 VAL 59 HG11 VAL 59 8.831 -5.312 -12.214 470 2HG1 VAL 59 HG12 VAL 59 10.208 -4.692 -11.302 471 3HG1 VAL 59 HG13 VAL 59 10.222 -4.653 -13.085 472 1HG2 VAL 59 HG21 VAL 59 10.284 -6.881 -14.323 473 2HG2 VAL 59 HG22 VAL 59 10.502 -8.387 -13.397 474 3HG2 VAL 59 HG23 VAL 59 8.967 -7.489 -13.311 475 H ASN 60 H ASN 60 12.140 -7.225 -9.676 476 HA ASN 60 HA ASN 60 13.506 -9.756 -10.150 477 1HB ASN 60 HB2 ASN 60 15.073 -7.522 -9.654 478 2HB ASN 60 HB3 ASN 60 14.812 -8.152 -8.027 479 1HD2 ASN 60 HD22 ASN 60 15.579 -9.237 -11.380 480 2HD2 ASN 60 HD21 ASN 60 16.728 -10.475 -10.905 481 H GLU 61 H GLU 61 13.829 -10.956 -8.097 482 HA GLU 61 HA GLU 61 11.350 -11.174 -6.698 483 1HB GLU 61 HB2 GLU 61 12.834 -13.060 -7.154 484 2HB GLU 61 HB3 GLU 61 14.122 -12.335 -6.199 485 1HG GLU 61 HG2 GLU 61 12.597 -12.486 -4.171 486 2HG GLU 61 HG3 GLU 61 11.396 -13.280 -5.190 487 H GLY 62 H GLY 62 10.656 -9.542 -5.440 488 1HA GLY 62 HA2 GLY 62 10.599 -8.539 -3.321 489 2HA GLY 62 HA3 GLY 62 12.365 -8.549 -3.231 490 H ASP 63 H ASP 63 11.486 -7.505 -6.400 491 HA ASP 63 HA ASP 63 12.314 -4.786 -5.728 492 1HB ASP 63 HB2 ASP 63 13.069 -6.147 -7.748 493 2HB ASP 63 HB3 ASP 63 11.445 -5.939 -8.406 494 H VAL 64 H VAL 64 10.915 -3.047 -5.592 495 HA VAL 64 HA VAL 64 8.191 -3.577 -5.005 496 HB VAL 64 HB VAL 64 9.587 -0.914 -5.502 497 1HG1 VAL 64 HG11 VAL 64 6.964 -1.591 -4.097 498 2HG1 VAL 64 HG12 VAL 64 7.795 -0.027 -3.951 499 3HG1 VAL 64 HG13 VAL 64 7.181 -0.554 -5.515 500 1HG2 VAL 64 HG21 VAL 64 9.169 -2.517 -2.936 501 2HG2 VAL 64 HG22 VAL 64 10.727 -2.159 -3.710 502 3HG2 VAL 64 HG23 VAL 64 9.783 -0.851 -3.007 503 H LEU 65 H LEU 65 6.300 -2.924 -6.040 504 HA LEU 65 HA LEU 65 6.431 -2.499 -8.993 505 1HB LEU 65 HB2 LEU 65 5.772 -4.760 -8.397 506 2HB LEU 65 HB3 LEU 65 4.556 -4.195 -7.278 507 HG LEU 65 HG LEU 65 3.799 -5.116 -9.464 508 1HD1 LEU 65 HD11 LEU 65 1.910 -3.697 -9.759 509 2HD1 LEU 65 HD12 LEU 65 2.287 -3.815 -8.038 510 3HD1 LEU 65 HD13 LEU 65 2.714 -2.344 -8.959 511 1HD2 LEU 65 HD21 LEU 65 4.564 -2.411 -10.628 512 2HD2 LEU 65 HD22 LEU 65 5.451 -3.925 -10.921 513 3HD2 LEU 65 HD23 LEU 65 3.765 -3.757 -11.451 514 H LEU 66 H LEU 66 4.399 -2.100 -6.020 515 HA LEU 66 HA LEU 66 4.013 0.712 -6.741 516 1HB LEU 66 HB2 LEU 66 1.593 0.717 -6.711 517 2HB LEU 66 HB3 LEU 66 2.192 -0.312 -7.975 518 HG LEU 66 HG LEU 66 1.728 -2.285 -6.392 519 1HD1 LEU 66 HD11 LEU 66 0.188 -0.115 -4.922 520 2HD1 LEU 66 HD12 LEU 66 -0.147 -1.855 -4.758 521 3HD1 LEU 66 HD13 LEU 66 1.401 -1.222 -4.241 522 1HD2 LEU 66 HD21 LEU 66 -0.615 -0.623 -7.371 523 2HD2 LEU 66 HD22 LEU 66 0.335 -1.786 -8.333 524 3HD2 LEU 66 HD23 LEU 66 -0.646 -2.363 -6.993 525 H GLU 67 H GLU 67 2.593 1.811 -4.983 526 HA GLU 67 HA GLU 67 3.142 0.606 -2.348 527 1HB GLU 67 HB2 GLU 67 4.940 2.263 -2.907 528 2HB GLU 67 HB3 GLU 67 3.704 3.510 -3.097 529 1HG GLU 67 HG2 GLU 67 4.837 3.621 -0.897 530 2HG GLU 67 HG3 GLU 67 3.107 3.346 -0.730 531 H LEU 68 H LEU 68 1.677 1.332 -0.705 532 HA LEU 68 HA LEU 68 -0.961 2.175 -1.823 533 1HB LEU 68 HB2 LEU 68 -0.315 -0.090 0.110 534 2HB LEU 68 HB3 LEU 68 -1.945 0.452 -0.262 535 HG LEU 68 HG LEU 68 -0.033 -0.792 -2.260 536 1HD1 LEU 68 HD11 LEU 68 -0.853 -2.370 -0.586 537 2HD1 LEU 68 HD12 LEU 68 -2.538 -1.888 -0.917 538 3HD1 LEU 68 HD13 LEU 68 -1.575 -2.709 -2.159 539 1HD2 LEU 68 HD21 LEU 68 -2.042 -0.855 -3.741 540 2HD2 LEU 68 HD22 LEU 68 -2.944 0.097 -2.547 541 3HD2 LEU 68 HD23 LEU 68 -1.512 0.758 -3.372 542 H SER 69 H SER 69 -2.566 2.624 -0.159 543 HA SER 69 HA SER 69 -1.890 4.609 1.716 544 1HB SER 69 HB2 SER 69 -4.243 3.973 2.551 545 2HB SER 69 HB3 SER 69 -4.075 4.512 0.872 546 HG SER 69 HG SER 69 -5.298 2.419 1.556 547 H ASN 70 H ASN 70 -1.674 4.531 3.951 548 HA ASN 70 HA ASN 70 -1.926 2.121 5.502 549 1HB ASN 70 HB2 ASN 70 0.321 1.625 4.535 550 2HB ASN 70 HB3 ASN 70 0.939 3.153 5.151 551 1HD2 ASN 70 HD22 ASN 70 1.214 3.391 7.548 552 2HD2 ASN 70 HD21 ASN 70 1.227 1.954 8.537 553 H SER 71 H SER 71 -0.052 5.182 5.421 554 HA SER 71 HA SER 71 -1.205 5.998 8.045 555 1HB SER 71 HB2 SER 71 1.362 6.968 6.750 556 2HB SER 71 HB3 SER 71 0.854 7.136 8.440 557 HG SER 71 HG SER 71 2.383 5.477 8.187 558 H THR 72 H THR 72 -2.020 6.378 5.028 559 HA THR 72 HA THR 72 -1.868 9.158 4.391 560 HB THR 72 HB THR 72 -3.578 8.127 2.611 561 HG1 THR 72 HG1 THR 72 -4.051 6.183 3.523 562 1HG2 THR 72 HG21 THR 72 -1.217 8.679 2.111 563 2HG2 THR 72 HG22 THR 72 -0.698 7.134 2.823 564 3HG2 THR 72 HG23 THR 72 -1.703 7.153 1.354 565 H GLN 73 H GLN 73 -3.867 7.442 6.583 566 HA GLN 73 HA GLN 73 -5.670 9.672 6.919 567 1HB GLN 73 HB2 GLN 73 -7.706 8.264 6.839 568 2HB GLN 73 HB3 GLN 73 -6.949 8.438 5.259 569 1HG GLN 73 HG2 GLN 73 -5.980 6.149 5.464 570 2HG GLN 73 HG3 GLN 73 -6.699 5.997 7.068 571 1HE2 GLN 73 HE22 GLN 73 -8.418 4.587 6.935 572 2HE2 GLN 73 HE21 GLN 73 -9.622 4.588 5.671 Start of MODEL 12 1 1H THR 2 H1 THR 2 4.105 -2.062 1.383 2 2H THR 2 H2 THR 2 3.658 -0.543 0.894 3 3H THR 2 H3 THR 2 2.593 -1.799 0.782 4 HA THR 2 HA THR 2 3.726 -1.060 -1.322 5 HB THR 2 HB THR 2 5.967 -2.396 -1.524 6 HG1 THR 2 HG1 THR 2 7.081 -2.626 0.368 7 1HG2 THR 2 HG21 THR 2 5.982 0.154 0.134 8 2HG2 THR 2 HG22 THR 2 7.290 -0.483 -0.881 9 3HG2 THR 2 HG23 THR 2 5.795 0.085 -1.636 10 H VAL 3 H VAL 3 4.003 -2.644 -3.071 11 HA VAL 3 HA VAL 3 3.361 -5.451 -2.441 12 HB VAL 3 HB VAL 3 2.019 -3.860 -4.670 13 1HG1 VAL 3 HG11 VAL 3 2.438 -6.189 -5.317 14 2HG1 VAL 3 HG12 VAL 3 1.676 -6.759 -3.816 15 3HG1 VAL 3 HG13 VAL 3 0.721 -5.919 -5.067 16 1HG2 VAL 3 HG21 VAL 3 -0.131 -4.312 -3.518 17 2HG2 VAL 3 HG22 VAL 3 0.765 -4.991 -2.133 18 3HG2 VAL 3 HG23 VAL 3 0.924 -3.276 -2.559 19 H SER 4 H SER 4 4.568 -6.790 -3.909 20 HA SER 4 HA SER 4 6.597 -5.403 -5.592 21 1HB SER 4 HB2 SER 4 7.088 -7.495 -3.444 22 2HB SER 4 HB3 SER 4 8.321 -6.704 -4.432 23 HG SER 4 HG SER 4 8.075 -5.770 -2.321 24 H ILE 5 H ILE 5 7.863 -6.849 -6.879 25 HA ILE 5 HA ILE 5 6.357 -9.101 -8.048 26 HB ILE 5 HB ILE 5 9.056 -7.854 -8.797 27 1HG1 ILE 5 HG12 ILE 5 7.569 -7.154 -10.887 28 2HG1 ILE 5 HG13 ILE 5 6.229 -7.268 -9.762 29 1HG2 ILE 5 HG21 ILE 5 8.825 -10.172 -9.603 30 2HG2 ILE 5 HG22 ILE 5 7.260 -9.775 -10.352 31 3HG2 ILE 5 HG23 ILE 5 8.771 -9.052 -10.938 32 1HD1 ILE 5 HD11 ILE 5 8.700 -5.498 -9.410 33 2HD1 ILE 5 HD12 ILE 5 7.144 -4.966 -10.080 34 3HD1 ILE 5 HD13 ILE 5 7.245 -5.469 -8.394 35 H GLN 6 H GLN 6 7.395 -11.259 -8.030 36 HA GLN 6 HA GLN 6 9.368 -11.703 -5.850 37 1HB GLN 6 HB2 GLN 6 8.003 -13.656 -5.103 38 2HB GLN 6 HB3 GLN 6 7.370 -12.079 -4.717 39 1HG GLN 6 HG2 GLN 6 6.364 -13.533 -7.190 40 2HG GLN 6 HG3 GLN 6 5.780 -13.978 -5.594 41 1HE2 GLN 6 HE22 GLN 6 5.028 -11.957 -8.193 42 2HE2 GLN 6 HE21 GLN 6 4.163 -10.715 -7.305 43 H MET 7 H MET 7 9.679 -11.619 -8.775 44 HA MET 7 HA MET 7 11.219 -14.029 -9.068 45 1HB MET 7 HB2 MET 7 10.203 -14.661 -11.242 46 2HB MET 7 HB3 MET 7 9.130 -14.964 -9.886 47 1HG MET 7 HG2 MET 7 8.921 -12.482 -11.627 48 2HG MET 7 HG3 MET 7 8.126 -13.999 -12.011 49 1HE MET 7 HE1 MET 7 6.000 -14.917 -10.997 50 2HE MET 7 HE2 MET 7 4.798 -13.710 -10.488 51 3HE MET 7 HE3 MET 7 5.642 -13.518 -12.036 52 H ALA 8 H ALA 8 12.664 -13.777 -10.965 53 HA ALA 8 HA ALA 8 13.235 -10.955 -11.616 54 1HB ALA 8 HB1 ALA 8 15.082 -12.491 -11.051 55 2HB ALA 8 HB2 ALA 8 14.623 -13.540 -12.418 56 3HB ALA 8 HB3 ALA 8 15.210 -11.891 -12.723 57 H GLY 9 H GLY 9 12.853 -9.987 -13.612 58 1HA GLY 9 HA2 GLY 9 12.624 -11.311 -16.059 59 2HA GLY 9 HA3 GLY 9 10.989 -11.280 -15.408 60 H ASN 10 H ASN 10 10.253 -9.886 -17.071 61 HA ASN 10 HA ASN 10 11.003 -7.013 -16.689 62 1HB ASN 10 HB2 ASN 10 10.786 -8.576 -19.276 63 2HB ASN 10 HB3 ASN 10 10.260 -6.898 -19.219 64 1HD2 ASN 10 HD22 ASN 10 13.070 -7.878 -17.194 65 2HD2 ASN 10 HD21 ASN 10 14.242 -7.101 -18.234 66 H LEU 11 H LEU 11 9.242 -5.712 -16.511 67 HA LEU 11 HA LEU 11 6.821 -7.092 -15.745 68 1HB LEU 11 HB2 LEU 11 8.064 -5.270 -14.483 69 2HB LEU 11 HB3 LEU 11 7.444 -4.126 -15.662 70 HG LEU 11 HG LEU 11 5.091 -4.857 -15.008 71 1HD1 LEU 11 HD11 LEU 11 6.623 -6.415 -12.869 72 2HD1 LEU 11 HD12 LEU 11 4.904 -6.015 -12.751 73 3HD1 LEU 11 HD13 LEU 11 5.467 -7.075 -14.041 74 1HD2 LEU 11 HD21 LEU 11 5.150 -3.598 -12.899 75 2HD2 LEU 11 HD22 LEU 11 6.899 -3.855 -12.763 76 3HD2 LEU 11 HD23 LEU 11 6.234 -2.865 -14.085 77 H TRP 12 H TRP 12 6.391 -7.793 -17.945 78 HA TRP 12 HA TRP 12 5.953 -6.814 -20.279 79 1HB TRP 12 HB2 TRP 12 5.181 -9.037 -19.293 80 2HB TRP 12 HB3 TRP 12 3.664 -8.250 -18.900 81 HD1 TRP 12 HD1 TRP 12 5.861 -9.059 -21.906 82 HE1 TRP 12 HE1 TRP 12 4.445 -9.457 -23.997 83 HE3 TRP 12 HE3 TRP 12 1.268 -8.012 -19.938 84 HZ2 TRP 12 HZ2 TRP 12 1.638 -9.291 -24.731 85 HZ3 TRP 12 HZ3 TRP 12 -0.770 -8.194 -21.334 86 HH2 TRP 12 HH2 TRP 12 -0.597 -8.810 -23.735 87 H LYS 13 H LYS 13 3.279 -6.262 -17.893 88 HA LYS 13 HA LYS 13 2.819 -3.600 -19.006 89 1HB LYS 13 HB2 LYS 13 0.678 -5.777 -19.054 90 2HB LYS 13 HB3 LYS 13 0.294 -4.058 -19.070 91 1HG LYS 13 HG2 LYS 13 1.701 -3.798 -21.144 92 2HG LYS 13 HG3 LYS 13 1.871 -5.563 -21.188 93 1HD LYS 13 HD2 LYS 13 -0.664 -5.716 -21.198 94 2HD LYS 13 HD3 LYS 13 -0.722 -3.965 -21.402 95 1HE LYS 13 HE2 LYS 13 0.673 -5.934 -23.282 96 2HE LYS 13 HE3 LYS 13 -0.942 -5.270 -23.536 97 1HZ LYS 13 HZ1 LYS 13 0.051 -3.056 -23.666 98 2HZ LYS 13 HZ2 LYS 13 1.555 -3.677 -23.471 99 3HZ LYS 13 HZ3 LYS 13 0.683 -4.042 -24.794 100 H VAL 14 H VAL 14 1.260 -2.401 -17.587 101 HA VAL 14 HA VAL 14 0.972 -3.423 -14.836 102 HB VAL 14 HB VAL 14 2.162 -0.703 -15.582 103 1HG1 VAL 14 HG11 VAL 14 0.805 -0.495 -13.558 104 2HG1 VAL 14 HG12 VAL 14 1.560 -1.948 -12.854 105 3HG1 VAL 14 HG13 VAL 14 2.505 -0.467 -13.108 106 1HG2 VAL 14 HG21 VAL 14 3.408 -3.154 -14.294 107 2HG2 VAL 14 HG22 VAL 14 3.880 -2.413 -15.838 108 3HG2 VAL 14 HG23 VAL 14 4.177 -1.545 -14.332 109 H HIS 15 H HIS 15 -0.940 -2.601 -13.902 110 HA HIS 15 HA HIS 15 -2.773 -1.265 -15.848 111 1HB HIS 15 HB2 HIS 15 -3.591 -3.200 -13.684 112 2HB HIS 15 HB3 HIS 15 -4.464 -2.747 -15.142 113 HD1 HIS 15 HD1 HIS 15 -2.167 -3.479 -17.313 114 HD2 HIS 15 HD2 HIS 15 -3.235 -5.739 -13.928 115 HE1 HIS 15 HE1 HIS 15 -1.256 -5.838 -17.695 116 H VAL 16 H VAL 16 -1.398 -1.009 -12.664 117 HA VAL 16 HA VAL 16 -3.583 0.590 -11.553 118 HB VAL 16 HB VAL 16 -2.012 0.903 -9.666 119 1HG1 VAL 16 HG11 VAL 16 -2.432 -1.990 -10.501 120 2HG1 VAL 16 HG12 VAL 16 -2.099 -1.409 -8.852 121 3HG1 VAL 16 HG13 VAL 16 -3.602 -0.951 -9.668 122 1HG2 VAL 16 HG21 VAL 16 0.078 -0.085 -9.468 123 2HG2 VAL 16 HG22 VAL 16 -0.125 -1.118 -10.906 124 3HG2 VAL 16 HG23 VAL 16 0.133 0.633 -11.071 125 H LYS 17 H LYS 17 -3.111 2.702 -10.586 126 HA LYS 17 HA LYS 17 -0.964 4.302 -11.624 127 1HB LYS 17 HB2 LYS 17 -2.306 6.129 -12.449 128 2HB LYS 17 HB3 LYS 17 -2.685 4.694 -13.397 129 1HG LYS 17 HG2 LYS 17 -4.806 4.398 -12.212 130 2HG LYS 17 HG3 LYS 17 -4.391 5.666 -11.063 131 1HD LYS 17 HD2 LYS 17 -4.222 7.203 -13.229 132 2HD LYS 17 HD3 LYS 17 -5.199 5.921 -13.951 133 1HE LYS 17 HE2 LYS 17 -6.772 7.494 -13.135 134 2HE LYS 17 HE3 LYS 17 -6.790 6.184 -11.949 135 1HZ LYS 17 HZ1 LYS 17 -5.237 7.593 -10.586 136 2HZ LYS 17 HZ2 LYS 17 -5.409 8.796 -11.679 137 3HZ LYS 17 HZ3 LYS 17 -6.700 8.294 -10.830 138 H ALA 18 H ALA 18 -0.918 6.357 -10.229 139 HA ALA 18 HA ALA 18 -1.596 5.906 -7.500 140 1HB ALA 18 HB1 ALA 18 0.120 7.537 -8.202 141 2HB ALA 18 HB2 ALA 18 -1.135 8.539 -8.975 142 3HB ALA 18 HB3 ALA 18 -1.131 8.314 -7.213 143 H GLY 19 H GLY 19 -3.415 6.382 -6.312 144 1HA GLY 19 HA2 GLY 19 -5.494 7.211 -5.792 145 2HA GLY 19 HA3 GLY 19 -5.618 7.977 -7.381 146 H ASP 20 H ASP 20 -4.740 4.847 -8.155 147 HA ASP 20 HA ASP 20 -7.462 3.960 -8.716 148 1HB ASP 20 HB2 ASP 20 -5.430 3.410 -10.123 149 2HB ASP 20 HB3 ASP 20 -4.867 2.372 -8.800 150 H GLN 21 H GLN 21 -8.094 1.691 -7.888 151 HA GLN 21 HA GLN 21 -7.251 1.251 -5.062 152 1HB GLN 21 HB2 GLN 21 -9.517 2.306 -5.168 153 2HB GLN 21 HB3 GLN 21 -10.077 0.966 -6.176 154 1HG GLN 21 HG2 GLN 21 -9.583 -0.634 -4.358 155 2HG GLN 21 HG3 GLN 21 -8.966 0.665 -3.342 156 1HE2 GLN 21 HE22 GLN 21 -11.141 -1.181 -2.713 157 2HE2 GLN 21 HE21 GLN 21 -12.578 -0.217 -2.488 158 H ILE 22 H ILE 22 -6.892 -0.890 -4.569 159 HA ILE 22 HA ILE 22 -7.398 -2.933 -6.660 160 HB ILE 22 HB ILE 22 -5.234 -3.888 -6.384 161 1HG1 ILE 22 HG12 ILE 22 -4.656 -1.756 -4.283 162 2HG1 ILE 22 HG13 ILE 22 -4.795 -3.500 -4.033 163 1HG2 ILE 22 HG21 ILE 22 -4.834 -0.898 -6.805 164 2HG2 ILE 22 HG22 ILE 22 -3.840 -2.207 -7.443 165 3HG2 ILE 22 HG23 ILE 22 -5.498 -2.017 -8.015 166 1HD1 ILE 22 HD11 ILE 22 -2.587 -2.010 -5.479 167 2HD1 ILE 22 HD12 ILE 22 -2.481 -3.028 -4.024 168 3HD1 ILE 22 HD13 ILE 22 -2.789 -3.772 -5.594 169 H GLU 23 H GLU 23 -7.289 -5.161 -5.707 170 HA GLU 23 HA GLU 23 -8.122 -5.269 -2.875 171 1HB GLU 23 HB2 GLU 23 -10.137 -5.065 -4.249 172 2HB GLU 23 HB3 GLU 23 -9.615 -6.429 -5.259 173 1HG GLU 23 HG2 GLU 23 -9.759 -7.935 -3.296 174 2HG GLU 23 HG3 GLU 23 -10.187 -6.569 -2.264 175 H LYS 24 H LYS 24 -7.350 -7.174 -1.889 176 HA LYS 24 HA LYS 24 -5.086 -8.425 -2.802 177 1HB LYS 24 HB2 LYS 24 -6.057 -8.529 -0.499 178 2HB LYS 24 HB3 LYS 24 -7.251 -9.700 -1.070 179 1HG LYS 24 HG2 LYS 24 -5.415 -11.275 -1.672 180 2HG LYS 24 HG3 LYS 24 -4.226 -10.087 -1.135 181 1HD LYS 24 HD2 LYS 24 -5.322 -10.188 1.184 182 2HD LYS 24 HD3 LYS 24 -6.357 -11.472 0.551 183 1HE LYS 24 HE2 LYS 24 -4.683 -12.698 1.586 184 2HE LYS 24 HE3 LYS 24 -4.154 -12.689 -0.097 185 1HZ LYS 24 HZ1 LYS 24 -3.115 -11.003 2.105 186 2HZ LYS 24 HZ2 LYS 24 -2.310 -12.174 1.310 187 3HZ LYS 24 HZ3 LYS 24 -2.683 -10.769 0.548 188 H GLY 25 H GLY 25 -4.584 -9.799 -4.436 189 1HA GLY 25 HA2 GLY 25 -4.758 -11.735 -5.695 190 2HA GLY 25 HA3 GLY 25 -6.455 -11.916 -5.249 191 H GLN 26 H GLN 26 -6.472 -8.752 -6.183 192 HA GLN 26 HA GLN 26 -7.417 -9.211 -8.878 193 1HB GLN 26 HB2 GLN 26 -7.960 -7.218 -7.296 194 2HB GLN 26 HB3 GLN 26 -6.327 -6.630 -7.682 195 1HG GLN 26 HG2 GLN 26 -7.190 -6.898 -10.198 196 2HG GLN 26 HG3 GLN 26 -8.777 -6.863 -9.448 197 1HE2 GLN 26 HE22 GLN 26 -5.993 -5.017 -10.413 198 2HE2 GLN 26 HE21 GLN 26 -6.568 -3.445 -9.869 199 H GLU 27 H GLU 27 -6.196 -9.041 -10.818 200 HA GLU 27 HA GLU 27 -3.301 -9.045 -10.664 201 1HB GLU 27 HB2 GLU 27 -3.304 -9.200 -12.998 202 2HB GLU 27 HB3 GLU 27 -4.600 -10.234 -12.433 203 1HG GLU 27 HG2 GLU 27 -4.855 -7.495 -13.743 204 2HG GLU 27 HG3 GLU 27 -5.197 -9.052 -14.478 205 H VAL 28 H VAL 28 -1.917 -7.379 -11.074 206 HA VAL 28 HA VAL 28 -2.985 -4.632 -11.485 207 HB VAL 28 HB VAL 28 -1.292 -3.902 -9.720 208 1HG1 VAL 28 HG11 VAL 28 -3.654 -5.568 -8.733 209 2HG1 VAL 28 HG12 VAL 28 -2.820 -4.273 -7.857 210 3HG1 VAL 28 HG13 VAL 28 -3.744 -3.897 -9.324 211 1HG2 VAL 28 HG21 VAL 28 -0.064 -6.092 -9.507 212 2HG2 VAL 28 HG22 VAL 28 -0.677 -5.462 -7.965 213 3HG2 VAL 28 HG23 VAL 28 -1.537 -6.774 -8.782 214 H ALA 29 H ALA 29 -0.464 -7.045 -12.068 215 HA ALA 29 HA ALA 29 0.356 -5.448 -14.340 216 1HB ALA 29 HB1 ALA 29 2.796 -5.557 -13.779 217 2HB ALA 29 HB2 ALA 29 1.906 -4.522 -12.659 218 3HB ALA 29 HB3 ALA 29 2.394 -6.146 -12.157 219 H ILE 30 H ILE 30 2.215 -6.830 -15.461 220 HA ILE 30 HA ILE 30 1.804 -9.735 -15.086 221 HB ILE 30 HB ILE 30 1.471 -8.207 -17.701 222 1HG1 ILE 30 HG12 ILE 30 -0.388 -10.188 -16.301 223 2HG1 ILE 30 HG13 ILE 30 -0.560 -8.441 -16.246 224 1HG2 ILE 30 HG21 ILE 30 1.328 -10.406 -18.853 225 2HG2 ILE 30 HG22 ILE 30 2.897 -10.228 -18.118 226 3HG2 ILE 30 HG23 ILE 30 1.678 -11.240 -17.324 227 1HD1 ILE 30 HD11 ILE 30 -2.125 -9.273 -17.836 228 2HD1 ILE 30 HD12 ILE 30 -0.872 -8.378 -18.713 229 3HD1 ILE 30 HD13 ILE 30 -0.881 -10.162 -18.721 230 H LEU 31 H LEU 31 3.642 -10.865 -15.629 231 HA LEU 31 HA LEU 31 6.169 -9.329 -16.000 232 1HB LEU 31 HB2 LEU 31 5.830 -9.915 -13.713 233 2HB LEU 31 HB3 LEU 31 5.327 -11.562 -14.098 234 HG LEU 31 HG LEU 31 7.524 -11.222 -12.987 235 1HD1 LEU 31 HD11 LEU 31 7.695 -12.758 -15.603 236 2HD1 LEU 31 HD12 LEU 31 8.709 -12.965 -14.164 237 3HD1 LEU 31 HD13 LEU 31 6.979 -13.334 -14.088 238 1HD2 LEU 31 HD21 LEU 31 8.663 -10.468 -15.670 239 2HD2 LEU 31 HD22 LEU 31 8.167 -9.250 -14.480 240 3HD2 LEU 31 HD23 LEU 31 9.418 -10.432 -14.060 241 H GLU 32 H GLU 32 7.479 -10.176 -17.563 242 HA GLU 32 HA GLU 32 6.723 -12.747 -18.862 243 1HB GLU 32 HB2 GLU 32 6.546 -10.773 -20.341 244 2HB GLU 32 HB3 GLU 32 8.218 -10.331 -19.967 245 1HG GLU 32 HG2 GLU 32 8.947 -12.557 -20.930 246 2HG GLU 32 HG3 GLU 32 7.268 -12.872 -21.369 247 H SER 33 H SER 33 8.159 -14.351 -18.505 248 HA SER 33 HA SER 33 10.976 -14.031 -18.328 249 1HB SER 33 HB2 SER 33 10.192 -13.188 -15.999 250 2HB SER 33 HB3 SER 33 9.681 -14.849 -15.687 251 HG SER 33 HG SER 33 11.874 -14.086 -15.063 252 H MET 34 H MET 34 11.928 -16.277 -17.793 253 HA MET 34 HA MET 34 12.044 -18.498 -18.269 254 1HB MET 34 HB2 MET 34 9.286 -18.560 -16.989 255 2HB MET 34 HB3 MET 34 10.411 -19.908 -17.103 256 1HG MET 34 HG2 MET 34 11.948 -18.910 -15.579 257 2HG MET 34 HG3 MET 34 11.118 -17.357 -15.604 258 1HE MET 34 HE1 MET 34 7.992 -17.785 -13.427 259 2HE MET 34 HE2 MET 34 9.116 -16.651 -14.200 260 3HE MET 34 HE3 MET 34 8.119 -17.735 -15.196 261 H LYS 35 H LYS 35 10.992 -16.851 -20.433 262 HA LYS 35 HA LYS 35 9.855 -16.837 -22.378 263 1HB LYS 35 HB2 LYS 35 10.202 -19.859 -22.314 264 2HB LYS 35 HB3 LYS 35 9.864 -18.878 -23.732 265 1HG LYS 35 HG2 LYS 35 12.422 -18.794 -22.081 266 2HG LYS 35 HG3 LYS 35 12.199 -19.563 -23.653 267 1HD LYS 35 HD2 LYS 35 11.614 -17.314 -24.627 268 2HD LYS 35 HD3 LYS 35 12.051 -16.564 -23.088 269 1HE LYS 35 HE2 LYS 35 13.906 -18.257 -24.827 270 2HE LYS 35 HE3 LYS 35 13.855 -16.494 -24.823 271 1HZ LYS 35 HZ1 LYS 35 15.626 -17.298 -23.429 272 2HZ LYS 35 HZ2 LYS 35 14.537 -16.533 -22.494 273 3HZ LYS 35 HZ3 LYS 35 14.613 -18.171 -22.502 274 H MET 36 H MET 36 8.220 -16.751 -20.055 275 HA MET 36 HA MET 36 5.629 -17.618 -21.174 276 1HB MET 36 HB2 MET 36 6.684 -18.163 -18.358 277 2HB MET 36 HB3 MET 36 4.979 -18.260 -18.799 278 1HG MET 36 HG2 MET 36 5.499 -19.991 -20.484 279 2HG MET 36 HG3 MET 36 7.185 -19.980 -19.975 280 1HE MET 36 HE1 MET 36 8.104 -20.912 -17.735 281 2HE MET 36 HE2 MET 36 7.086 -19.808 -16.777 282 3HE MET 36 HE3 MET 36 7.102 -21.544 -16.411 283 H GLU 37 H GLU 37 3.886 -16.546 -19.725 284 HA GLU 37 HA GLU 37 4.680 -13.850 -18.768 285 1HB GLU 37 HB2 GLU 37 2.353 -14.648 -20.556 286 2HB GLU 37 HB3 GLU 37 2.386 -13.141 -19.628 287 1HG GLU 37 HG2 GLU 37 4.250 -12.284 -20.853 288 2HG GLU 37 HG3 GLU 37 4.602 -13.854 -21.578 289 H ILE 38 H ILE 38 3.757 -13.400 -16.796 290 HA ILE 38 HA ILE 38 1.917 -15.375 -15.563 291 HB ILE 38 HB ILE 38 4.482 -14.297 -14.286 292 1HG1 ILE 38 HG12 ILE 38 5.061 -16.917 -14.415 293 2HG1 ILE 38 HG13 ILE 38 4.065 -16.854 -15.855 294 1HG2 ILE 38 HG21 ILE 38 2.675 -14.911 -12.711 295 2HG2 ILE 38 HG22 ILE 38 2.577 -16.528 -13.444 296 3HG2 ILE 38 HG23 ILE 38 4.039 -16.015 -12.577 297 1HD1 ILE 38 HD11 ILE 38 6.394 -16.582 -16.466 298 2HD1 ILE 38 HD12 ILE 38 5.653 -14.993 -16.698 299 3HD1 ILE 38 HD13 ILE 38 6.629 -15.312 -15.257 300 HA PRO 39 HA PRO 39 0.294 -11.311 -14.393 301 1HB PRO 39 HB2 PRO 39 -1.683 -12.024 -12.635 302 2HB PRO 39 HB3 PRO 39 -1.828 -12.212 -14.409 303 1HG PRO 39 HG2 PRO 39 -1.055 -14.310 -12.365 304 2HG PRO 39 HG3 PRO 39 -2.224 -14.452 -13.717 305 1HD PRO 39 HD2 PRO 39 0.358 -15.359 -13.892 306 2HD PRO 39 HD3 PRO 39 -0.496 -14.670 -15.307 307 H ILE 40 H ILE 40 0.392 -9.908 -12.620 308 HA ILE 40 HA ILE 40 1.704 -10.853 -10.118 309 HB ILE 40 HB ILE 40 2.016 -8.212 -11.582 310 1HG1 ILE 40 HG12 ILE 40 3.319 -9.930 -12.727 311 2HG1 ILE 40 HG13 ILE 40 4.337 -8.723 -11.964 312 1HG2 ILE 40 HG21 ILE 40 3.218 -9.132 -8.941 313 2HG2 ILE 40 HG22 ILE 40 3.729 -7.683 -9.832 314 3HG2 ILE 40 HG23 ILE 40 2.082 -7.801 -9.202 315 1HD1 ILE 40 HD11 ILE 40 4.856 -10.273 -10.107 316 2HD1 ILE 40 HD12 ILE 40 3.785 -11.501 -10.825 317 3HD1 ILE 40 HD13 ILE 40 5.253 -10.989 -11.668 318 H VAL 41 H VAL 41 0.428 -10.506 -8.423 319 HA VAL 41 HA VAL 41 -2.104 -9.035 -8.842 320 HB VAL 41 HB VAL 41 -3.000 -10.667 -7.126 321 1HG1 VAL 41 HG11 VAL 41 -3.318 -12.498 -8.735 322 2HG1 VAL 41 HG12 VAL 41 -3.562 -10.916 -9.462 323 3HG1 VAL 41 HG13 VAL 41 -2.054 -11.810 -9.784 324 1HG2 VAL 41 HG21 VAL 41 -0.804 -11.483 -6.235 325 2HG2 VAL 41 HG22 VAL 41 -1.884 -12.780 -6.762 326 3HG2 VAL 41 HG23 VAL 41 -0.518 -12.312 -7.787 327 H ALA 42 H ALA 42 -3.106 -8.090 -7.030 328 HA ALA 42 HA ALA 42 -1.425 -6.516 -5.340 329 1HB ALA 42 HB1 ALA 42 -4.376 -7.215 -5.157 330 2HB ALA 42 HB2 ALA 42 -3.582 -5.874 -4.313 331 3HB ALA 42 HB3 ALA 42 -3.710 -5.867 -6.088 332 H ASP 43 H ASP 43 -0.285 -7.337 -3.643 333 HA ASP 43 HA ASP 43 -0.819 -9.825 -2.327 334 1HB ASP 43 HB2 ASP 43 1.402 -8.825 -2.308 335 2HB ASP 43 HB3 ASP 43 0.788 -7.366 -1.523 336 H ARG 44 H ARG 44 -2.135 -6.597 -1.892 337 HA ARG 44 HA ARG 44 -4.024 -7.519 0.102 338 1HB ARG 44 HB2 ARG 44 -3.420 -5.829 1.779 339 2HB ARG 44 HB3 ARG 44 -2.118 -6.990 1.538 340 1HG ARG 44 HG2 ARG 44 -1.103 -5.192 -0.110 341 2HG ARG 44 HG3 ARG 44 -2.272 -4.095 0.628 342 1HD ARG 44 HD2 ARG 44 -0.136 -3.849 1.711 343 2HD ARG 44 HD3 ARG 44 -1.266 -4.596 2.863 344 HE ARG 44 HE ARG 44 0.183 -6.625 1.421 345 1HH1 ARG 44 HH11 ARG 44 0.735 -4.254 4.028 346 2HH1 ARG 44 HH12 ARG 44 2.021 -5.163 4.729 347 1HH2 ARG 44 HH21 ARG 44 1.764 -7.757 2.278 348 2HH2 ARG 44 HH22 ARG 44 2.655 -7.265 3.708 349 H SER 45 H SER 45 -5.766 -5.933 0.338 350 HA SER 45 HA SER 45 -6.263 -4.366 -2.010 351 1HB SER 45 HB2 SER 45 -7.713 -4.290 0.668 352 2HB SER 45 HB3 SER 45 -8.380 -3.931 -0.932 353 HG SER 45 HG SER 45 -8.860 -6.072 -0.043 354 H GLY 46 H GLY 46 -6.637 -2.006 -2.058 355 1HA GLY 46 HA2 GLY 46 -6.547 -0.225 -0.014 356 2HA GLY 46 HA3 GLY 46 -4.828 -0.436 -0.366 357 H ILE 47 H ILE 47 -5.538 2.019 -0.682 358 HA ILE 47 HA ILE 47 -6.188 2.581 -3.520 359 HB ILE 47 HB ILE 47 -5.491 4.411 -1.183 360 1HG1 ILE 47 HG12 ILE 47 -7.706 3.426 -0.858 361 2HG1 ILE 47 HG13 ILE 47 -7.802 5.147 -1.176 362 1HG2 ILE 47 HG21 ILE 47 -4.772 5.498 -3.212 363 2HG2 ILE 47 HG22 ILE 47 -6.294 5.114 -4.035 364 3HG2 ILE 47 HG23 ILE 47 -6.267 6.269 -2.684 365 1HD1 ILE 47 HD11 ILE 47 -8.367 2.960 -3.218 366 2HD1 ILE 47 HD12 ILE 47 -9.581 3.902 -2.338 367 3HD1 ILE 47 HD13 ILE 47 -8.521 4.707 -3.508 368 H VAL 48 H VAL 48 -4.562 2.973 -4.964 369 HA VAL 48 HA VAL 48 -1.796 2.352 -4.308 370 HB VAL 48 HB VAL 48 -2.994 3.505 -6.825 371 1HG1 VAL 48 HG11 VAL 48 -0.507 3.697 -6.686 372 2HG1 VAL 48 HG12 VAL 48 -0.389 1.960 -6.321 373 3HG1 VAL 48 HG13 VAL 48 -0.993 2.511 -7.899 374 1HG2 VAL 48 HG21 VAL 48 -4.094 1.361 -6.337 375 2HG2 VAL 48 HG22 VAL 48 -2.970 1.181 -7.674 376 3HG2 VAL 48 HG23 VAL 48 -2.517 0.589 -6.055 377 H LYS 49 H LYS 49 -0.589 3.771 -3.182 378 HA LYS 49 HA LYS 49 -1.125 6.657 -3.186 379 1HB LYS 49 HB2 LYS 49 -0.293 5.513 -1.160 380 2HB LYS 49 HB3 LYS 49 1.176 5.021 -2.015 381 1HG LYS 49 HG2 LYS 49 1.810 7.399 -2.286 382 2HG LYS 49 HG3 LYS 49 0.296 7.898 -1.502 383 1HD LYS 49 HD2 LYS 49 0.996 6.728 0.577 384 2HD LYS 49 HD3 LYS 49 2.511 6.235 -0.213 385 1HE LYS 49 HE2 LYS 49 3.105 8.626 -0.554 386 2HE LYS 49 HE3 LYS 49 1.598 9.117 0.227 387 1HZ LYS 49 HZ1 LYS 49 2.394 8.073 2.270 388 2HZ LYS 49 HZ2 LYS 49 3.791 7.619 1.548 389 3HZ LYS 49 HZ3 LYS 49 3.454 9.198 1.761 390 H GLU 50 H GLU 50 1.280 4.293 -4.532 391 HA GLU 50 HA GLU 50 1.970 6.198 -6.648 392 1HB GLU 50 HB2 GLU 50 3.333 6.940 -4.676 393 2HB GLU 50 HB3 GLU 50 4.000 5.320 -4.532 394 1HG GLU 50 HG2 GLU 50 5.570 6.881 -5.569 395 2HG GLU 50 HG3 GLU 50 5.176 5.564 -6.653 396 H VAL 51 H VAL 51 3.452 5.155 -8.235 397 HA VAL 51 HA VAL 51 3.464 2.173 -8.084 398 HB VAL 51 HB VAL 51 3.112 3.814 -10.624 399 1HG1 VAL 51 HG11 VAL 51 2.811 0.819 -10.063 400 2HG1 VAL 51 HG12 VAL 51 2.500 1.624 -11.614 401 3HG1 VAL 51 HG13 VAL 51 4.140 1.580 -10.966 402 1HG2 VAL 51 HG21 VAL 51 1.010 2.301 -9.019 403 2HG2 VAL 51 HG22 VAL 51 1.045 4.055 -9.309 404 3HG2 VAL 51 HG23 VAL 51 0.773 2.953 -10.656 405 H LYS 52 H LYS 52 5.461 1.263 -8.597 406 HA LYS 52 HA LYS 52 7.722 3.215 -8.756 407 1HB LYS 52 HB2 LYS 52 7.547 0.534 -7.319 408 2HB LYS 52 HB3 LYS 52 8.923 1.622 -7.293 409 1HG LYS 52 HG2 LYS 52 6.174 2.161 -6.085 410 2HG LYS 52 HG3 LYS 52 7.636 1.744 -5.211 411 1HD LYS 52 HD2 LYS 52 7.239 4.312 -6.805 412 2HD LYS 52 HD3 LYS 52 7.076 4.140 -5.055 413 1HE LYS 52 HE2 LYS 52 9.449 3.420 -4.895 414 2HE LYS 52 HE3 LYS 52 9.631 3.614 -6.643 415 1HZ LYS 52 HZ1 LYS 52 8.999 5.799 -4.741 416 2HZ LYS 52 HZ2 LYS 52 10.439 5.546 -5.453 417 3HZ LYS 52 HZ3 LYS 52 9.161 5.982 -6.361 418 H LYS 53 H LYS 53 6.265 1.443 -10.915 419 HA LYS 53 HA LYS 53 8.696 0.756 -12.367 420 1HB LYS 53 HB2 LYS 53 6.497 -1.307 -11.817 421 2HB LYS 53 HB3 LYS 53 7.786 -1.506 -13.007 422 1HG LYS 53 HG2 LYS 53 8.219 -1.287 -10.023 423 2HG LYS 53 HG3 LYS 53 8.192 -2.783 -10.941 424 1HD LYS 53 HD2 LYS 53 10.137 -2.152 -12.243 425 2HD LYS 53 HD3 LYS 53 10.177 -0.537 -11.549 426 1HE LYS 53 HE2 LYS 53 10.601 -3.104 -9.983 427 2HE LYS 53 HE3 LYS 53 11.870 -2.029 -10.571 428 1HZ LYS 53 HZ1 LYS 53 10.856 -0.271 -9.170 429 2HZ LYS 53 HZ2 LYS 53 9.803 -1.385 -8.567 430 3HZ LYS 53 HZ3 LYS 53 11.399 -1.600 -8.307 431 H LYS 54 H LYS 54 7.788 -0.202 -14.632 432 HA LYS 54 HA LYS 54 5.278 1.015 -15.453 433 1HB LYS 54 HB2 LYS 54 6.229 2.234 -17.336 434 2HB LYS 54 HB3 LYS 54 6.825 2.902 -15.822 435 1HG LYS 54 HG2 LYS 54 8.983 1.817 -16.097 436 2HG LYS 54 HG3 LYS 54 8.433 0.926 -17.516 437 1HD LYS 54 HD2 LYS 54 8.619 3.957 -17.352 438 2HD LYS 54 HD3 LYS 54 9.880 2.925 -18.013 439 1HE LYS 54 HE2 LYS 54 7.031 3.102 -19.108 440 2HE LYS 54 HE3 LYS 54 8.415 3.990 -19.738 441 1HZ LYS 54 HZ1 LYS 54 9.469 1.856 -20.259 442 2HZ LYS 54 HZ2 LYS 54 8.139 1.029 -19.754 443 3HZ LYS 54 HZ3 LYS 54 8.050 2.031 -21.036 444 H GLU 55 H GLU 55 4.870 0.357 -17.774 445 HA GLU 55 HA GLU 55 5.147 -2.408 -18.167 446 1HB GLU 55 HB2 GLU 55 4.837 -0.323 -20.380 447 2HB GLU 55 HB3 GLU 55 4.368 -2.016 -20.416 448 1HG GLU 55 HG2 GLU 55 2.316 -1.153 -20.012 449 2HG GLU 55 HG3 GLU 55 2.836 -1.285 -18.338 450 H GLY 56 H GLY 56 6.721 -3.667 -18.957 451 1HA GLY 56 HA2 GLY 56 8.488 -4.391 -20.206 452 2HA GLY 56 HA3 GLY 56 8.663 -2.776 -20.907 453 H ASP 57 H ASP 57 8.732 -2.289 -17.547 454 HA ASP 57 HA ASP 57 11.584 -1.800 -17.636 455 1HB ASP 57 HB2 ASP 57 9.906 -0.466 -16.313 456 2HB ASP 57 HB3 ASP 57 9.778 -1.827 -15.193 457 H PHE 58 H PHE 58 13.162 -2.766 -16.161 458 HA PHE 58 HA PHE 58 13.015 -5.686 -15.996 459 1HB PHE 58 HB2 PHE 58 15.141 -4.521 -16.426 460 2HB PHE 58 HB3 PHE 58 14.978 -3.625 -14.923 461 HD1 PHE 58 HD1 PHE 58 15.667 -6.971 -16.397 462 HD2 PHE 58 HD2 PHE 58 15.564 -4.622 -12.778 463 HE1 PHE 58 HE1 PHE 58 16.960 -8.727 -15.219 464 HE2 PHE 58 HE2 PHE 58 16.868 -6.378 -11.607 465 HZ PHE 58 HZ PHE 58 17.590 -8.421 -12.834 466 H VAL 59 H VAL 59 12.700 -6.903 -14.092 467 HA VAL 59 HA VAL 59 12.250 -5.509 -11.549 468 HB VAL 59 HB VAL 59 10.175 -6.967 -11.203 469 1HG1 VAL 59 HG11 VAL 59 8.669 -5.275 -12.076 470 2HG1 VAL 59 HG12 VAL 59 10.112 -4.543 -11.364 471 3HG1 VAL 59 HG13 VAL 59 9.940 -4.635 -13.134 472 1HG2 VAL 59 HG21 VAL 59 8.810 -7.528 -13.126 473 2HG2 VAL 59 HG22 VAL 59 10.048 -6.936 -14.247 474 3HG2 VAL 59 HG23 VAL 59 10.369 -8.369 -13.241 475 H ASN 60 H ASN 60 12.119 -7.069 -9.737 476 HA ASN 60 HA ASN 60 13.436 -9.610 -10.270 477 1HB ASN 60 HB2 ASN 60 15.048 -7.395 -9.785 478 2HB ASN 60 HB3 ASN 60 14.845 -8.080 -8.172 479 1HD2 ASN 60 HD22 ASN 60 15.476 -9.057 -11.595 480 2HD2 ASN 60 HD21 ASN 60 16.623 -10.321 -11.198 481 H GLU 61 H GLU 61 13.817 -10.830 -8.231 482 HA GLU 61 HA GLU 61 11.355 -11.092 -6.825 483 1HB GLU 61 HB2 GLU 61 12.855 -12.953 -7.291 484 2HB GLU 61 HB3 GLU 61 14.148 -12.216 -6.353 485 1HG GLU 61 HG2 GLU 61 12.671 -12.403 -4.299 486 2HG GLU 61 HG3 GLU 61 11.452 -13.197 -5.295 487 H GLY 62 H GLY 62 10.604 -9.597 -5.439 488 1HA GLY 62 HA2 GLY 62 10.554 -8.662 -3.298 489 2HA GLY 62 HA3 GLY 62 12.321 -8.612 -3.237 490 H ASP 63 H ASP 63 11.443 -7.509 -6.333 491 HA ASP 63 HA ASP 63 12.146 -4.776 -5.603 492 1HB ASP 63 HB2 ASP 63 12.854 -6.073 -7.710 493 2HB ASP 63 HB3 ASP 63 11.222 -5.793 -8.314 494 H VAL 64 H VAL 64 10.713 -3.036 -5.463 495 HA VAL 64 HA VAL 64 7.997 -3.722 -4.818 496 HB VAL 64 HB VAL 64 9.380 -1.015 -5.044 497 1HG1 VAL 64 HG11 VAL 64 6.948 -0.708 -5.098 498 2HG1 VAL 64 HG12 VAL 64 6.748 -1.789 -3.705 499 3HG1 VAL 64 HG13 VAL 64 7.568 -0.219 -3.525 500 1HG2 VAL 64 HG21 VAL 64 9.537 -1.176 -2.561 501 2HG2 VAL 64 HG22 VAL 64 8.879 -2.826 -2.635 502 3HG2 VAL 64 HG23 VAL 64 10.461 -2.453 -3.350 503 H LEU 65 H LEU 65 6.198 -3.590 -6.013 504 HA LEU 65 HA LEU 65 6.266 -2.690 -8.831 505 1HB LEU 65 HB2 LEU 65 5.034 -4.778 -8.358 506 2HB LEU 65 HB3 LEU 65 4.125 -3.992 -7.075 507 HG LEU 65 HG LEU 65 3.027 -2.496 -8.743 508 1HD1 LEU 65 HD11 LEU 65 4.740 -2.467 -10.511 509 2HD1 LEU 65 HD12 LEU 65 4.506 -4.212 -10.778 510 3HD1 LEU 65 HD13 LEU 65 3.206 -3.054 -11.150 511 1HD2 LEU 65 HD21 LEU 65 2.771 -5.456 -9.365 512 2HD2 LEU 65 HD22 LEU 65 1.958 -4.596 -8.039 513 3HD2 LEU 65 HD23 LEU 65 1.575 -4.190 -9.720 514 H LEU 66 H LEU 66 4.601 -2.017 -5.660 515 HA LEU 66 HA LEU 66 4.204 0.777 -6.431 516 1HB LEU 66 HB2 LEU 66 1.767 0.724 -6.441 517 2HB LEU 66 HB3 LEU 66 2.425 -0.282 -7.700 518 HG LEU 66 HG LEU 66 1.985 -2.284 -6.171 519 1HD1 LEU 66 HD11 LEU 66 0.050 -1.901 -4.552 520 2HD1 LEU 66 HD12 LEU 66 1.596 -1.299 -3.988 521 3HD1 LEU 66 HD13 LEU 66 0.405 -0.163 -4.663 522 1HD2 LEU 66 HD21 LEU 66 -0.373 -0.663 -7.159 523 2HD2 LEU 66 HD22 LEU 66 0.617 -1.809 -8.106 524 3HD2 LEU 66 HD23 LEU 66 -0.385 -2.402 -6.786 525 H GLU 67 H GLU 67 2.774 1.890 -4.743 526 HA GLU 67 HA GLU 67 3.139 0.721 -2.061 527 1HB GLU 67 HB2 GLU 67 5.016 2.253 -2.357 528 2HB GLU 67 HB3 GLU 67 3.947 3.506 -2.970 529 1HG GLU 67 HG2 GLU 67 4.614 4.034 -0.719 530 2HG GLU 67 HG3 GLU 67 2.887 3.743 -0.756 531 H LEU 68 H LEU 68 1.609 1.507 -0.540 532 HA LEU 68 HA LEU 68 -0.953 2.358 -1.821 533 1HB LEU 68 HB2 LEU 68 -0.487 0.334 0.410 534 2HB LEU 68 HB3 LEU 68 -2.062 0.856 -0.177 535 HG LEU 68 HG LEU 68 0.001 -0.703 -1.789 536 1HD1 LEU 68 HD11 LEU 68 -1.609 -2.549 -1.640 537 2HD1 LEU 68 HD12 LEU 68 -1.086 -2.031 -0.026 538 3HD1 LEU 68 HD13 LEU 68 -2.686 -1.555 -0.639 539 1HD2 LEU 68 HD21 LEU 68 -1.848 -0.946 -3.450 540 2HD2 LEU 68 HD22 LEU 68 -2.810 0.224 -2.533 541 3HD2 LEU 68 HD23 LEU 68 -1.262 0.691 -3.288 542 H SER 69 H SER 69 -2.390 3.535 -0.527 543 HA SER 69 HA SER 69 -1.190 5.432 1.229 544 1HB SER 69 HB2 SER 69 -4.126 4.940 0.610 545 2HB SER 69 HB3 SER 69 -3.388 6.454 1.175 546 HG SER 69 HG SER 69 -3.666 6.551 -1.046 547 H ASN 70 H ASN 70 -0.977 2.770 2.408 548 HA ASN 70 HA ASN 70 -2.948 2.343 4.479 549 1HB ASN 70 HB2 ASN 70 -1.483 0.522 3.698 550 2HB ASN 70 HB3 ASN 70 -0.052 1.420 4.223 551 1HD2 ASN 70 HD22 ASN 70 0.709 0.921 6.280 552 2HD2 ASN 70 HD21 ASN 70 -0.273 0.300 7.578 553 H SER 71 H SER 71 -2.859 2.921 6.681 554 HA SER 71 HA SER 71 -1.955 5.486 7.258 555 1HB SER 71 HB2 SER 71 -2.676 3.325 9.270 556 2HB SER 71 HB3 SER 71 -2.908 5.076 9.426 557 HG SER 71 HG SER 71 -4.844 3.991 8.851 558 H THR 72 H THR 72 -0.094 2.545 7.492 559 HA THR 72 HA THR 72 1.970 3.845 9.188 560 HB THR 72 HB THR 72 2.181 1.481 10.201 561 HG1 THR 72 HG1 THR 72 0.359 0.205 10.096 562 1HG2 THR 72 HG21 THR 72 1.215 3.427 11.431 563 2HG2 THR 72 HG22 THR 72 -0.397 2.996 10.816 564 3HG2 THR 72 HG23 THR 72 0.478 1.886 11.890 565 H GLN 73 H GLN 73 4.079 2.664 9.055 566 HA GLN 73 HA GLN 73 4.894 2.167 6.333 567 1HB GLN 73 HB2 GLN 73 6.281 1.596 8.995 568 2HB GLN 73 HB3 GLN 73 7.020 1.403 7.404 569 1HG GLN 73 HG2 GLN 73 6.680 3.824 6.940 570 2HG GLN 73 HG3 GLN 73 5.995 4.036 8.555 571 1HE2 GLN 73 HE22 GLN 73 7.426 3.706 10.446 572 2HE2 GLN 73 HE21 GLN 73 9.155 3.855 10.265 Start of MODEL 13 1 1H THR 2 H1 THR 2 3.517 -0.991 1.036 2 2H THR 2 H2 THR 2 2.453 -2.216 0.762 3 3H THR 2 H3 THR 2 3.968 -2.551 1.306 4 HA THR 2 HA THR 2 3.486 -1.286 -1.286 5 HB THR 2 HB THR 2 5.840 -2.409 -1.619 6 HG1 THR 2 HG1 THR 2 7.006 -2.663 0.234 7 1HG2 THR 2 HG21 THR 2 5.568 0.049 0.169 8 2HG2 THR 2 HG22 THR 2 6.999 -0.423 -0.768 9 3HG2 THR 2 HG23 THR 2 5.518 0.028 -1.614 10 H VAL 3 H VAL 3 3.886 -2.769 -3.171 11 HA VAL 3 HA VAL 3 3.392 -5.634 -2.633 12 HB VAL 3 HB VAL 3 1.959 -4.028 -4.787 13 1HG1 VAL 3 HG11 VAL 3 0.765 -6.097 -5.295 14 2HG1 VAL 3 HG12 VAL 3 2.489 -6.321 -5.511 15 3HG1 VAL 3 HG13 VAL 3 1.705 -6.971 -4.054 16 1HG2 VAL 3 HG21 VAL 3 0.799 -5.279 -2.266 17 2HG2 VAL 3 HG22 VAL 3 0.855 -3.554 -2.664 18 3HG2 VAL 3 HG23 VAL 3 -0.159 -4.629 -3.621 19 H SER 4 H SER 4 4.674 -6.877 -4.054 20 HA SER 4 HA SER 4 6.590 -5.423 -5.805 21 1HB SER 4 HB2 SER 4 7.236 -7.445 -3.619 22 2HB SER 4 HB3 SER 4 8.402 -6.606 -4.648 23 HG SER 4 HG SER 4 8.127 -5.672 -2.529 24 H ILE 5 H ILE 5 7.777 -6.787 -7.223 25 HA ILE 5 HA ILE 5 6.245 -9.000 -8.360 26 HB ILE 5 HB ILE 5 9.011 -7.881 -9.047 27 1HG1 ILE 5 HG12 ILE 5 7.590 -7.094 -11.147 28 2HG1 ILE 5 HG13 ILE 5 6.222 -7.189 -10.057 29 1HG2 ILE 5 HG21 ILE 5 8.729 -9.049 -11.197 30 2HG2 ILE 5 HG22 ILE 5 8.684 -10.190 -9.874 31 3HG2 ILE 5 HG23 ILE 5 7.167 -9.703 -10.662 32 1HD1 ILE 5 HD11 ILE 5 8.730 -5.500 -9.603 33 2HD1 ILE 5 HD12 ILE 5 7.214 -4.908 -10.311 34 3HD1 ILE 5 HD13 ILE 5 7.247 -5.444 -8.633 35 H GLN 6 H GLN 6 7.010 -11.242 -8.323 36 HA GLN 6 HA GLN 6 8.519 -11.819 -5.816 37 1HB GLN 6 HB2 GLN 6 6.603 -13.693 -7.228 38 2HB GLN 6 HB3 GLN 6 7.225 -13.772 -5.589 39 1HG GLN 6 HG2 GLN 6 5.140 -13.010 -5.117 40 2HG GLN 6 HG3 GLN 6 5.948 -11.457 -5.286 41 1HE2 GLN 6 HE22 GLN 6 4.717 -10.000 -6.556 42 2HE2 GLN 6 HE21 GLN 6 3.644 -10.524 -7.841 43 H MET 7 H MET 7 9.366 -11.654 -8.951 44 HA MET 7 HA MET 7 11.208 -13.918 -8.932 45 1HB MET 7 HB2 MET 7 10.321 -14.810 -11.057 46 2HB MET 7 HB3 MET 7 9.177 -15.009 -9.740 47 1HG MET 7 HG2 MET 7 9.032 -12.795 -11.812 48 2HG MET 7 HG3 MET 7 8.198 -14.334 -11.948 49 1HE MET 7 HE1 MET 7 5.983 -14.968 -10.799 50 2HE MET 7 HE2 MET 7 4.852 -13.633 -10.476 51 3HE MET 7 HE3 MET 7 5.657 -13.743 -12.054 52 H ALA 8 H ALA 8 12.673 -13.767 -10.838 53 HA ALA 8 HA ALA 8 13.244 -10.981 -11.586 54 1HB ALA 8 HB1 ALA 8 15.234 -11.948 -12.613 55 2HB ALA 8 HB2 ALA 8 15.056 -12.512 -10.933 56 3HB ALA 8 HB3 ALA 8 14.633 -13.590 -12.290 57 H GLY 9 H GLY 9 12.879 -10.049 -13.570 58 1HA GLY 9 HA2 GLY 9 12.629 -11.382 -16.018 59 2HA GLY 9 HA3 GLY 9 11.000 -11.316 -15.352 60 H ASN 10 H ASN 10 10.257 -9.896 -16.979 61 HA ASN 10 HA ASN 10 11.106 -7.047 -16.653 62 1HB ASN 10 HB2 ASN 10 10.876 -8.653 -19.205 63 2HB ASN 10 HB3 ASN 10 10.340 -6.978 -19.196 64 1HD2 ASN 10 HD21 ASN 10 13.162 -7.986 -17.174 65 2HD2 ASN 10 HD22 ASN 10 14.330 -7.191 -18.208 66 H LEU 11 H LEU 11 9.401 -5.634 -16.653 67 HA LEU 11 HA LEU 11 6.941 -6.854 -15.761 68 1HB LEU 11 HB2 LEU 11 8.237 -4.985 -14.661 69 2HB LEU 11 HB3 LEU 11 7.658 -3.915 -15.931 70 HG LEU 11 HG LEU 11 5.294 -4.452 -15.236 71 1HD1 LEU 11 HD11 LEU 11 6.683 -6.043 -13.030 72 2HD1 LEU 11 HD12 LEU 11 5.002 -5.498 -12.937 73 3HD1 LEU 11 HD13 LEU 11 5.477 -6.642 -14.185 74 1HD2 LEU 11 HD21 LEU 11 7.160 -3.488 -13.019 75 2HD2 LEU 11 HD22 LEU 11 6.534 -2.504 -14.366 76 3HD2 LEU 11 HD23 LEU 11 5.428 -3.133 -13.146 77 H TRP 12 H TRP 12 6.286 -7.751 -17.774 78 HA TRP 12 HA TRP 12 5.992 -6.836 -20.240 79 1HB TRP 12 HB2 TRP 12 5.253 -9.049 -19.147 80 2HB TRP 12 HB3 TRP 12 3.703 -8.280 -18.872 81 HD1 TRP 12 HD1 TRP 12 6.076 -9.049 -21.754 82 HE1 TRP 12 HE1 TRP 12 4.782 -9.759 -23.840 83 HE3 TRP 12 HE3 TRP 12 1.338 -8.361 -19.990 84 HZ2 TRP 12 HZ2 TRP 12 1.999 -10.043 -24.625 85 HZ3 TRP 12 HZ3 TRP 12 -0.622 -8.921 -21.397 86 HH2 TRP 12 HH2 TRP 12 -0.306 -9.753 -23.718 87 H LYS 13 H LYS 13 3.360 -6.258 -17.824 88 HA LYS 13 HA LYS 13 2.679 -3.710 -19.106 89 1HB LYS 13 HB2 LYS 13 0.716 -6.038 -18.877 90 2HB LYS 13 HB3 LYS 13 0.215 -4.354 -19.070 91 1HG LYS 13 HG2 LYS 13 1.517 -4.238 -21.210 92 2HG LYS 13 HG3 LYS 13 1.848 -5.973 -21.059 93 1HD LYS 13 HD2 LYS 13 -0.636 -6.383 -20.980 94 2HD LYS 13 HD3 LYS 13 -0.901 -4.672 -21.318 95 1HE LYS 13 HE2 LYS 13 0.648 -6.616 -23.099 96 2HE LYS 13 HE3 LYS 13 -1.042 -6.167 -23.332 97 1HZ LYS 13 HZ1 LYS 13 0.383 -4.865 -24.750 98 2HZ LYS 13 HZ2 LYS 13 -0.329 -3.872 -23.675 99 3HZ LYS 13 HZ3 LYS 13 1.244 -4.291 -23.495 100 H VAL 14 H VAL 14 1.186 -2.469 -17.694 101 HA VAL 14 HA VAL 14 0.970 -3.413 -14.888 102 HB VAL 14 HB VAL 14 2.149 -0.712 -15.703 103 1HG1 VAL 14 HG11 VAL 14 2.536 -0.423 -13.237 104 2HG1 VAL 14 HG12 VAL 14 0.824 -0.459 -13.650 105 3HG1 VAL 14 HG13 VAL 14 1.594 -1.895 -12.933 106 1HG2 VAL 14 HG21 VAL 14 4.176 -1.521 -14.487 107 2HG2 VAL 14 HG22 VAL 14 3.405 -3.125 -14.340 108 3HG2 VAL 14 HG23 VAL 14 3.843 -2.469 -15.933 109 H HIS 15 H HIS 15 -0.923 -2.678 -13.935 110 HA HIS 15 HA HIS 15 -2.821 -1.324 -15.803 111 1HB HIS 15 HB2 HIS 15 -3.586 -3.276 -13.641 112 2HB HIS 15 HB3 HIS 15 -4.475 -2.829 -15.090 113 HD1 HIS 15 HD1 HIS 15 -2.114 -3.548 -17.244 114 HD2 HIS 15 HD2 HIS 15 -3.306 -5.827 -13.914 115 HE1 HIS 15 HE1 HIS 15 -1.201 -5.909 -17.610 116 H VAL 16 H VAL 16 -1.433 -1.232 -12.579 117 HA VAL 16 HA VAL 16 -3.517 0.452 -11.444 118 HB VAL 16 HB VAL 16 -1.829 0.786 -9.622 119 1HG1 VAL 16 HG11 VAL 16 -3.550 -0.915 -9.460 120 2HG1 VAL 16 HG12 VAL 16 -2.566 -2.061 -10.382 121 3HG1 VAL 16 HG13 VAL 16 -2.041 -1.532 -8.763 122 1HG2 VAL 16 HG21 VAL 16 -0.166 -1.375 -10.963 123 2HG2 VAL 16 HG22 VAL 16 0.248 0.357 -10.980 124 3HG2 VAL 16 HG23 VAL 16 0.142 -0.507 -9.442 125 H LYS 17 H LYS 17 -3.124 2.589 -10.633 126 HA LYS 17 HA LYS 17 -0.975 4.199 -11.680 127 1HB LYS 17 HB2 LYS 17 -2.460 5.967 -12.568 128 2HB LYS 17 HB3 LYS 17 -2.562 4.490 -13.523 129 1HG LYS 17 HG2 LYS 17 -4.708 3.902 -12.430 130 2HG LYS 17 HG3 LYS 17 -4.607 5.359 -11.422 131 1HD LYS 17 HD2 LYS 17 -4.664 6.771 -13.458 132 2HD LYS 17 HD3 LYS 17 -4.769 5.310 -14.466 133 1HE LYS 17 HE2 LYS 17 -6.886 4.681 -13.321 134 2HE LYS 17 HE3 LYS 17 -6.781 6.136 -12.321 135 1HZ LYS 17 HZ1 LYS 17 -8.254 6.459 -14.203 136 2HZ LYS 17 HZ2 LYS 17 -6.978 7.460 -14.346 137 3HZ LYS 17 HZ3 LYS 17 -7.074 6.114 -15.271 138 H ALA 18 H ALA 18 -0.915 6.231 -10.337 139 HA ALA 18 HA ALA 18 -1.674 5.860 -7.625 140 1HB ALA 18 HB1 ALA 18 -1.139 8.253 -7.361 141 2HB ALA 18 HB2 ALA 18 0.106 7.421 -8.312 142 3HB ALA 18 HB3 ALA 18 -1.097 8.454 -9.124 143 H GLY 19 H GLY 19 -3.559 6.200 -6.558 144 1HA GLY 19 HA2 GLY 19 -5.625 7.165 -6.090 145 2HA GLY 19 HA3 GLY 19 -5.735 7.819 -7.729 146 H ASP 20 H ASP 20 -4.803 4.712 -8.375 147 HA ASP 20 HA ASP 20 -7.489 3.711 -8.862 148 1HB ASP 20 HB2 ASP 20 -5.424 3.140 -10.238 149 2HB ASP 20 HB3 ASP 20 -4.861 2.180 -8.869 150 H GLN 21 H GLN 21 -8.067 1.467 -7.945 151 HA GLN 21 HA GLN 21 -7.241 1.171 -5.094 152 1HB GLN 21 HB2 GLN 21 -9.493 2.197 -5.212 153 2HB GLN 21 HB3 GLN 21 -10.059 0.854 -6.218 154 1HG GLN 21 HG2 GLN 21 -9.617 -0.738 -4.390 155 2HG GLN 21 HG3 GLN 21 -8.960 0.547 -3.381 156 1HE2 GLN 21 HE22 GLN 21 -11.044 -1.128 -2.511 157 2HE2 GLN 21 HE21 GLN 21 -12.506 -0.187 -2.360 158 H ILE 22 H ILE 22 -6.892 -0.930 -4.466 159 HA ILE 22 HA ILE 22 -7.369 -3.072 -6.443 160 HB ILE 22 HB ILE 22 -5.196 -3.976 -6.223 161 1HG1 ILE 22 HG12 ILE 22 -4.547 -1.785 -4.203 162 2HG1 ILE 22 HG13 ILE 22 -4.691 -3.518 -3.887 163 1HG2 ILE 22 HG21 ILE 22 -3.846 -2.309 -7.360 164 2HG2 ILE 22 HG22 ILE 22 -5.515 -2.121 -7.880 165 3HG2 ILE 22 HG23 ILE 22 -4.817 -0.992 -6.704 166 1HD1 ILE 22 HD11 ILE 22 -2.520 -2.098 -5.461 167 2HD1 ILE 22 HD12 ILE 22 -2.370 -3.101 -3.999 168 3HD1 ILE 22 HD13 ILE 22 -2.753 -3.852 -5.548 169 H GLU 23 H GLU 23 -7.203 -5.233 -5.445 170 HA GLU 23 HA GLU 23 -8.006 -5.325 -2.613 171 1HB GLU 23 HB2 GLU 23 -10.037 -5.114 -3.999 172 2HB GLU 23 HB3 GLU 23 -9.519 -6.498 -4.984 173 1HG GLU 23 HG2 GLU 23 -9.673 -7.968 -2.994 174 2HG GLU 23 HG3 GLU 23 -10.092 -6.582 -1.984 175 H LYS 24 H LYS 24 -7.288 -7.333 -1.673 176 HA LYS 24 HA LYS 24 -5.022 -8.576 -2.652 177 1HB LYS 24 HB2 LYS 24 -5.900 -8.838 -0.358 178 2HB LYS 24 HB3 LYS 24 -7.217 -9.847 -0.966 179 1HG LYS 24 HG2 LYS 24 -5.522 -11.499 -1.812 180 2HG LYS 24 HG3 LYS 24 -4.237 -10.530 -1.107 181 1HD LYS 24 HD2 LYS 24 -6.571 -11.802 0.400 182 2HD LYS 24 HD3 LYS 24 -4.975 -12.520 0.272 183 1HE LYS 24 HE2 LYS 24 -5.497 -9.803 1.565 184 2HE LYS 24 HE3 LYS 24 -5.521 -11.328 2.448 185 1HZ LYS 24 HZ1 LYS 24 -3.374 -10.290 2.625 186 2HZ LYS 24 HZ2 LYS 24 -3.217 -11.689 1.810 187 3HZ LYS 24 HZ3 LYS 24 -3.159 -10.260 1.005 188 H GLY 25 H GLY 25 -4.559 -9.825 -4.382 189 1HA GLY 25 HA2 GLY 25 -4.766 -11.687 -5.752 190 2HA GLY 25 HA3 GLY 25 -6.464 -11.867 -5.311 191 H GLN 26 H GLN 26 -6.382 -8.641 -6.086 192 HA GLN 26 HA GLN 26 -7.404 -8.917 -8.764 193 1HB GLN 26 HB2 GLN 26 -7.860 -7.061 -7.087 194 2HB GLN 26 HB3 GLN 26 -6.201 -6.481 -7.360 195 1HG GLN 26 HG2 GLN 26 -6.747 -6.058 -9.729 196 2HG GLN 26 HG3 GLN 26 -8.376 -6.700 -9.494 197 1HE2 GLN 26 HE22 GLN 26 -6.654 -3.819 -9.643 198 2HE2 GLN 26 HE21 GLN 26 -7.699 -2.805 -8.664 199 H GLU 27 H GLU 27 -6.189 -8.899 -10.708 200 HA GLU 27 HA GLU 27 -3.267 -8.963 -10.478 201 1HB GLU 27 HB2 GLU 27 -3.158 -9.497 -12.752 202 2HB GLU 27 HB3 GLU 27 -4.449 -10.455 -12.037 203 1HG GLU 27 HG2 GLU 27 -6.067 -8.666 -12.957 204 2HG GLU 27 HG3 GLU 27 -4.677 -8.049 -13.867 205 H VAL 28 H VAL 28 -1.891 -7.368 -10.952 206 HA VAL 28 HA VAL 28 -2.973 -4.653 -11.529 207 HB VAL 28 HB VAL 28 -1.347 -3.879 -9.739 208 1HG1 VAL 28 HG11 VAL 28 -2.905 -4.324 -7.897 209 2HG1 VAL 28 HG12 VAL 28 -3.804 -3.956 -9.382 210 3HG1 VAL 28 HG13 VAL 28 -3.674 -5.629 -8.810 211 1HG2 VAL 28 HG21 VAL 28 -1.480 -6.747 -8.765 212 2HG2 VAL 28 HG22 VAL 28 -0.037 -6.012 -9.500 213 3HG2 VAL 28 HG23 VAL 28 -0.681 -5.383 -7.972 214 H ALA 29 H ALA 29 -0.463 -7.048 -12.100 215 HA ALA 29 HA ALA 29 0.380 -5.449 -14.362 216 1HB ALA 29 HB1 ALA 29 2.815 -5.541 -13.802 217 2HB ALA 29 HB2 ALA 29 1.924 -4.515 -12.676 218 3HB ALA 29 HB3 ALA 29 2.423 -6.143 -12.186 219 H ILE 30 H ILE 30 2.281 -6.832 -15.448 220 HA ILE 30 HA ILE 30 1.858 -9.731 -15.054 221 HB ILE 30 HB ILE 30 1.595 -8.244 -17.699 222 1HG1 ILE 30 HG12 ILE 30 -0.322 -10.179 -16.318 223 2HG1 ILE 30 HG13 ILE 30 -0.472 -8.428 -16.283 224 1HG2 ILE 30 HG21 ILE 30 3.004 -10.267 -18.060 225 2HG2 ILE 30 HG22 ILE 30 1.779 -11.261 -17.238 226 3HG2 ILE 30 HG23 ILE 30 1.436 -10.483 -18.793 227 1HD1 ILE 30 HD11 ILE 30 -0.733 -8.379 -18.751 228 2HD1 ILE 30 HD12 ILE 30 -0.754 -10.164 -18.753 229 3HD1 ILE 30 HD13 ILE 30 -2.011 -9.262 -17.899 230 H LEU 31 H LEU 31 3.703 -10.874 -15.508 231 HA LEU 31 HA LEU 31 6.248 -9.354 -15.846 232 1HB LEU 31 HB2 LEU 31 5.864 -10.015 -13.579 233 2HB LEU 31 HB3 LEU 31 5.385 -11.657 -14.029 234 HG LEU 31 HG LEU 31 7.573 -11.317 -12.883 235 1HD1 LEU 31 HD11 LEU 31 7.061 -13.410 -14.032 236 2HD1 LEU 31 HD12 LEU 31 7.757 -12.786 -15.536 237 3HD1 LEU 31 HD13 LEU 31 8.784 -13.015 -14.114 238 1HD2 LEU 31 HD21 LEU 31 8.206 -9.303 -14.297 239 2HD2 LEU 31 HD22 LEU 31 9.469 -10.490 -13.932 240 3HD2 LEU 31 HD23 LEU 31 8.703 -10.466 -15.541 241 H GLU 32 H GLU 32 7.510 -10.132 -17.479 242 HA GLU 32 HA GLU 32 6.773 -12.683 -18.831 243 1HB GLU 32 HB2 GLU 32 6.700 -10.692 -20.268 244 2HB GLU 32 HB3 GLU 32 8.348 -10.256 -19.796 245 1HG GLU 32 HG2 GLU 32 9.144 -12.437 -20.792 246 2HG GLU 32 HG3 GLU 32 7.493 -12.763 -21.312 247 H SER 33 H SER 33 8.154 -14.342 -18.435 248 HA SER 33 HA SER 33 10.974 -14.088 -18.271 249 1HB SER 33 HB2 SER 33 10.226 -13.258 -15.920 250 2HB SER 33 HB3 SER 33 9.708 -14.920 -15.620 251 HG SER 33 HG SER 33 11.914 -14.167 -15.023 252 H MET 34 H MET 34 11.860 -16.376 -17.657 253 HA MET 34 HA MET 34 11.953 -18.526 -18.403 254 1HB MET 34 HB2 MET 34 10.566 -20.035 -17.021 255 2HB MET 34 HB3 MET 34 11.392 -18.767 -16.129 256 1HG MET 34 HG2 MET 34 9.299 -17.472 -15.977 257 2HG MET 34 HG3 MET 34 8.440 -18.743 -16.853 258 1HE MET 34 HE1 MET 34 6.690 -18.464 -14.731 259 2HE MET 34 HE2 MET 34 7.201 -18.667 -13.042 260 3HE MET 34 HE3 MET 34 7.804 -17.292 -13.990 261 H LYS 35 H LYS 35 10.880 -17.097 -20.426 262 HA LYS 35 HA LYS 35 9.711 -17.126 -22.338 263 1HB LYS 35 HB2 LYS 35 9.864 -20.146 -22.010 264 2HB LYS 35 HB3 LYS 35 9.532 -19.273 -23.510 265 1HG LYS 35 HG2 LYS 35 11.760 -18.172 -23.370 266 2HG LYS 35 HG3 LYS 35 12.123 -19.119 -21.912 267 1HD LYS 35 HD2 LYS 35 11.848 -21.219 -23.202 268 2HD LYS 35 HD3 LYS 35 11.495 -20.272 -24.665 269 1HE LYS 35 HE2 LYS 35 13.730 -19.194 -24.500 270 2HE LYS 35 HE3 LYS 35 14.082 -20.138 -23.047 271 1HZ LYS 35 HZ1 LYS 35 15.051 -21.145 -25.011 272 2HZ LYS 35 HZ2 LYS 35 13.927 -22.150 -24.397 273 3HZ LYS 35 HZ3 LYS 35 13.602 -21.276 -25.741 274 H MET 36 H MET 36 8.066 -16.816 -19.970 275 HA MET 36 HA MET 36 5.422 -17.535 -21.077 276 1HB MET 36 HB2 MET 36 6.488 -18.116 -18.271 277 2HB MET 36 HB3 MET 36 4.768 -18.068 -18.642 278 1HG MET 36 HG2 MET 36 6.748 -19.971 -19.934 279 2HG MET 36 HG3 MET 36 5.691 -20.353 -18.581 280 1HE MET 36 HE1 MET 36 4.216 -22.440 -21.566 281 2HE MET 36 HE2 MET 36 5.925 -22.030 -21.306 282 3HE MET 36 HE3 MET 36 4.903 -22.500 -19.928 283 H GLU 37 H GLU 37 3.729 -16.322 -19.743 284 HA GLU 37 HA GLU 37 4.726 -13.773 -18.629 285 1HB GLU 37 HB2 GLU 37 2.203 -14.072 -20.311 286 2HB GLU 37 HB3 GLU 37 2.731 -12.642 -19.438 287 1HG GLU 37 HG2 GLU 37 3.365 -12.144 -21.598 288 2HG GLU 37 HG3 GLU 37 4.868 -12.695 -20.873 289 H ILE 38 H ILE 38 3.762 -13.297 -16.673 290 HA ILE 38 HA ILE 38 1.828 -15.250 -15.530 291 HB ILE 38 HB ILE 38 4.425 -14.228 -14.272 292 1HG1 ILE 38 HG12 ILE 38 4.794 -16.912 -14.302 293 2HG1 ILE 38 HG13 ILE 38 3.831 -16.783 -15.760 294 1HG2 ILE 38 HG21 ILE 38 3.938 -15.852 -12.473 295 2HG2 ILE 38 HG22 ILE 38 2.685 -14.630 -12.596 296 3HG2 ILE 38 HG23 ILE 38 2.394 -16.260 -13.253 297 1HD1 ILE 38 HD11 ILE 38 6.483 -15.395 -15.140 298 2HD1 ILE 38 HD12 ILE 38 6.213 -16.707 -16.296 299 3HD1 ILE 38 HD13 ILE 38 5.562 -15.098 -16.623 300 HA PRO 39 HA PRO 39 0.193 -11.187 -14.324 301 1HB PRO 39 HB2 PRO 39 -1.808 -11.940 -12.606 302 2HB PRO 39 HB3 PRO 39 -1.940 -12.029 -14.391 303 1HG PRO 39 HG2 PRO 39 -1.266 -14.242 -12.446 304 2HG PRO 39 HG3 PRO 39 -2.387 -14.285 -13.842 305 1HD PRO 39 HD2 PRO 39 0.190 -15.247 -13.960 306 2HD PRO 39 HD3 PRO 39 -0.606 -14.496 -15.376 307 H ILE 40 H ILE 40 0.417 -9.831 -12.592 308 HA ILE 40 HA ILE 40 1.713 -10.831 -10.101 309 HB ILE 40 HB ILE 40 2.059 -8.228 -11.629 310 1HG1 ILE 40 HG12 ILE 40 3.332 -9.987 -12.696 311 2HG1 ILE 40 HG13 ILE 40 4.386 -8.805 -11.942 312 1HG2 ILE 40 HG21 ILE 40 3.216 -9.021 -8.934 313 2HG2 ILE 40 HG22 ILE 40 3.780 -7.647 -9.901 314 3HG2 ILE 40 HG23 ILE 40 2.122 -7.678 -9.287 315 1HD1 ILE 40 HD11 ILE 40 5.213 -11.087 -11.587 316 2HD1 ILE 40 HD12 ILE 40 4.799 -10.351 -10.038 317 3HD1 ILE 40 HD13 ILE 40 3.713 -11.549 -10.783 318 H VAL 41 H VAL 41 0.450 -10.520 -8.407 319 HA VAL 41 HA VAL 41 -2.066 -9.014 -8.759 320 HB VAL 41 HB VAL 41 -2.941 -10.679 -7.058 321 1HG1 VAL 41 HG11 VAL 41 -3.561 -10.886 -9.378 322 2HG1 VAL 41 HG12 VAL 41 -2.051 -11.750 -9.765 323 3HG1 VAL 41 HG13 VAL 41 -3.278 -12.485 -8.706 324 1HG2 VAL 41 HG21 VAL 41 -0.481 -12.327 -7.799 325 2HG2 VAL 41 HG22 VAL 41 -0.726 -11.522 -6.227 326 3HG2 VAL 41 HG23 VAL 41 -1.826 -12.801 -6.751 327 H ALA 42 H ALA 42 -3.036 -8.085 -6.943 328 HA ALA 42 HA ALA 42 -1.359 -6.548 -5.219 329 1HB ALA 42 HB1 ALA 42 -3.522 -5.923 -4.196 330 2HB ALA 42 HB2 ALA 42 -3.644 -5.898 -5.976 331 3HB ALA 42 HB3 ALA 42 -4.305 -7.257 -5.063 332 H ASP 43 H ASP 43 -0.266 -7.360 -3.479 333 HA ASP 43 HA ASP 43 -0.846 -9.868 -2.194 334 1HB ASP 43 HB2 ASP 43 1.384 -8.903 -2.061 335 2HB ASP 43 HB3 ASP 43 0.755 -7.415 -1.354 336 H ARG 44 H ARG 44 -2.065 -6.571 -1.734 337 HA ARG 44 HA ARG 44 -4.046 -7.502 0.170 338 1HB ARG 44 HB2 ARG 44 -3.381 -6.048 1.997 339 2HB ARG 44 HB3 ARG 44 -2.071 -7.152 1.604 340 1HG ARG 44 HG2 ARG 44 -1.275 -5.034 0.089 341 2HG ARG 44 HG3 ARG 44 -2.231 -4.167 1.290 342 1HD ARG 44 HD2 ARG 44 0.211 -5.926 1.704 343 2HD ARG 44 HD3 ARG 44 0.059 -4.210 2.020 344 HE ARG 44 HE ARG 44 -1.330 -4.660 3.927 345 1HH1 ARG 44 HH11 ARG 44 0.163 -7.652 2.584 346 2HH1 ARG 44 HH12 ARG 44 0.094 -8.472 4.102 347 1HH2 ARG 44 HH21 ARG 44 -1.446 -5.834 5.887 348 2HH2 ARG 44 HH22 ARG 44 -0.866 -7.450 5.982 349 H SER 45 H SER 45 -5.690 -5.873 0.526 350 HA SER 45 HA SER 45 -6.196 -4.308 -1.795 351 1HB SER 45 HB2 SER 45 -7.625 -4.217 0.892 352 2HB SER 45 HB3 SER 45 -8.311 -3.902 -0.710 353 HG SER 45 HG SER 45 -8.745 -6.039 0.210 354 H GLY 46 H GLY 46 -6.552 -1.960 -1.893 355 1HA GLY 46 HA2 GLY 46 -6.330 -0.117 0.126 356 2HA GLY 46 HA3 GLY 46 -4.649 -0.374 -0.357 357 H ILE 47 H ILE 47 -5.276 2.085 -0.729 358 HA ILE 47 HA ILE 47 -6.152 2.509 -3.544 359 HB ILE 47 HB ILE 47 -5.411 4.471 -1.328 360 1HG1 ILE 47 HG12 ILE 47 -7.579 3.447 -0.849 361 2HG1 ILE 47 HG13 ILE 47 -7.749 5.140 -1.267 362 1HG2 ILE 47 HG21 ILE 47 -6.356 5.005 -4.172 363 2HG2 ILE 47 HG22 ILE 47 -6.306 6.225 -2.881 364 3HG2 ILE 47 HG23 ILE 47 -4.812 5.471 -3.435 365 1HD1 ILE 47 HD11 ILE 47 -9.531 3.782 -2.277 366 2HD1 ILE 47 HD12 ILE 47 -8.539 4.526 -3.541 367 3HD1 ILE 47 HD13 ILE 47 -8.331 2.807 -3.139 368 H VAL 48 H VAL 48 -4.593 2.901 -5.060 369 HA VAL 48 HA VAL 48 -1.797 2.333 -4.499 370 HB VAL 48 HB VAL 48 -3.178 3.416 -6.964 371 1HG1 VAL 48 HG11 VAL 48 -0.427 2.118 -6.600 372 2HG1 VAL 48 HG12 VAL 48 -1.165 2.591 -8.148 373 3HG1 VAL 48 HG13 VAL 48 -0.715 3.828 -6.973 374 1HG2 VAL 48 HG21 VAL 48 -3.032 1.086 -7.781 375 2HG2 VAL 48 HG22 VAL 48 -2.411 0.559 -6.197 376 3HG2 VAL 48 HG23 VAL 48 -4.061 1.200 -6.363 377 H LYS 49 H LYS 49 -0.648 3.772 -3.341 378 HA LYS 49 HA LYS 49 -1.301 6.644 -3.397 379 1HB LYS 49 HB2 LYS 49 -0.691 5.466 -1.290 380 2HB LYS 49 HB3 LYS 49 0.910 5.110 -1.967 381 1HG LYS 49 HG2 LYS 49 1.366 7.557 -2.112 382 2HG LYS 49 HG3 LYS 49 -0.262 7.897 -1.510 383 1HD LYS 49 HD2 LYS 49 1.374 8.151 0.275 384 2HD LYS 49 HD3 LYS 49 0.291 6.795 0.644 385 1HE LYS 49 HE2 LYS 49 1.976 5.180 -0.087 386 2HE LYS 49 HE3 LYS 49 3.024 6.481 -0.676 387 1HZ LYS 49 HZ1 LYS 49 3.797 5.680 1.394 388 2HZ LYS 49 HZ2 LYS 49 3.273 7.215 1.630 389 3HZ LYS 49 HZ3 LYS 49 2.358 5.952 2.155 390 H GLU 50 H GLU 50 1.282 4.354 -4.529 391 HA GLU 50 HA GLU 50 1.939 6.256 -6.659 392 1HB GLU 50 HB2 GLU 50 3.309 6.984 -4.644 393 2HB GLU 50 HB3 GLU 50 4.098 5.403 -4.664 394 1HG GLU 50 HG2 GLU 50 5.069 5.853 -6.843 395 2HG GLU 50 HG3 GLU 50 4.082 7.308 -7.043 396 H VAL 51 H VAL 51 3.258 5.182 -8.335 397 HA VAL 51 HA VAL 51 3.443 2.215 -8.062 398 HB VAL 51 HB VAL 51 2.959 3.810 -10.615 399 1HG1 VAL 51 HG11 VAL 51 2.509 1.581 -11.612 400 2HG1 VAL 51 HG12 VAL 51 4.164 1.688 -11.016 401 3HG1 VAL 51 HG13 VAL 51 2.943 0.798 -10.079 402 1HG2 VAL 51 HG21 VAL 51 0.701 2.764 -10.611 403 2HG2 VAL 51 HG22 VAL 51 1.022 2.108 -8.990 404 3HG2 VAL 51 HG23 VAL 51 0.913 3.864 -9.250 405 H LYS 52 H LYS 52 5.456 1.384 -8.471 406 HA LYS 52 HA LYS 52 7.629 3.415 -8.469 407 1HB LYS 52 HB2 LYS 52 7.605 0.476 -7.670 408 2HB LYS 52 HB3 LYS 52 8.938 1.600 -7.418 409 1HG LYS 52 HG2 LYS 52 6.211 1.685 -6.060 410 2HG LYS 52 HG3 LYS 52 7.752 1.198 -5.360 411 1HD LYS 52 HD2 LYS 52 8.629 3.512 -5.690 412 2HD LYS 52 HD3 LYS 52 7.005 4.014 -6.246 413 1HE LYS 52 HE2 LYS 52 6.008 3.384 -4.155 414 2HE LYS 52 HE3 LYS 52 7.507 2.643 -3.578 415 1HZ LYS 52 HZ1 LYS 52 8.500 4.819 -3.475 416 2HZ LYS 52 HZ2 LYS 52 7.163 5.538 -4.118 417 3HZ LYS 52 HZ3 LYS 52 7.080 4.814 -2.639 418 H LYS 53 H LYS 53 6.212 1.494 -10.820 419 HA LYS 53 HA LYS 53 8.761 1.068 -12.289 420 1HB LYS 53 HB2 LYS 53 6.577 -0.980 -11.671 421 2HB LYS 53 HB3 LYS 53 7.790 -1.207 -12.926 422 1HG LYS 53 HG2 LYS 53 8.532 -0.809 -10.012 423 2HG LYS 53 HG3 LYS 53 8.269 -2.389 -10.766 424 1HD LYS 53 HD2 LYS 53 10.015 -1.907 -12.441 425 2HD LYS 53 HD3 LYS 53 10.323 -0.329 -11.685 426 1HE LYS 53 HE2 LYS 53 11.073 -1.388 -9.627 427 2HE LYS 53 HE3 LYS 53 10.620 -2.981 -10.213 428 1HZ LYS 53 HZ1 LYS 53 12.760 -1.266 -11.323 429 2HZ LYS 53 HZ2 LYS 53 12.904 -2.727 -10.539 430 3HZ LYS 53 HZ3 LYS 53 12.261 -2.649 -12.043 431 H LYS 54 H LYS 54 8.002 0.049 -14.567 432 HA LYS 54 HA LYS 54 5.627 1.376 -15.601 433 1HB LYS 54 HB2 LYS 54 6.783 2.494 -17.422 434 2HB LYS 54 HB3 LYS 54 7.335 3.149 -15.886 435 1HG LYS 54 HG2 LYS 54 9.419 1.886 -16.014 436 2HG LYS 54 HG3 LYS 54 8.889 1.036 -17.465 437 1HD LYS 54 HD2 LYS 54 9.330 4.037 -17.275 438 2HD LYS 54 HD3 LYS 54 10.509 2.891 -17.900 439 1HE LYS 54 HE2 LYS 54 7.741 3.388 -19.099 440 2HE LYS 54 HE3 LYS 54 9.246 4.097 -19.675 441 1HZ LYS 54 HZ1 LYS 54 8.596 1.196 -19.721 442 2HZ LYS 54 HZ2 LYS 54 8.698 2.203 -20.995 443 3HZ LYS 54 HZ3 LYS 54 10.044 1.842 -20.158 444 H GLU 55 H GLU 55 5.265 0.606 -17.861 445 HA GLU 55 HA GLU 55 5.571 -2.217 -18.023 446 1HB GLU 55 HB2 GLU 55 4.922 -0.280 -20.289 447 2HB GLU 55 HB3 GLU 55 4.552 -2.013 -20.207 448 1HG GLU 55 HG2 GLU 55 3.200 -1.475 -18.096 449 2HG GLU 55 HG3 GLU 55 3.362 0.227 -18.512 450 H GLY 56 H GLY 56 7.089 -3.459 -19.000 451 1HA GLY 56 HA2 GLY 56 8.816 -4.085 -20.369 452 2HA GLY 56 HA3 GLY 56 8.998 -2.421 -20.936 453 H ASP 57 H ASP 57 9.087 -2.116 -17.571 454 HA ASP 57 HA ASP 57 11.972 -1.785 -17.635 455 1HB ASP 57 HB2 ASP 57 10.445 -0.345 -16.281 456 2HB ASP 57 HB3 ASP 57 10.129 -1.725 -15.222 457 H PHE 58 H PHE 58 13.454 -2.850 -16.145 458 HA PHE 58 HA PHE 58 13.160 -5.759 -15.997 459 1HB PHE 58 HB2 PHE 58 15.347 -4.678 -16.384 460 2HB PHE 58 HB3 PHE 58 15.195 -3.797 -14.871 461 HD1 PHE 58 HD1 PHE 58 15.766 -7.147 -16.384 462 HD2 PHE 58 HD2 PHE 58 15.698 -4.851 -12.730 463 HE1 PHE 58 HE1 PHE 58 16.961 -8.975 -15.212 464 HE2 PHE 58 HE2 PHE 58 16.907 -6.678 -11.566 465 HZ PHE 58 HZ PHE 58 17.562 -8.732 -12.813 466 H VAL 59 H VAL 59 12.782 -6.957 -14.089 467 HA VAL 59 HA VAL 59 12.286 -5.535 -11.572 468 HB VAL 59 HB VAL 59 10.123 -6.902 -11.330 469 1HG1 VAL 59 HG11 VAL 59 10.102 -4.529 -13.230 470 2HG1 VAL 59 HG12 VAL 59 8.747 -5.121 -12.253 471 3HG1 VAL 59 HG13 VAL 59 10.178 -4.474 -11.451 472 1HG2 VAL 59 HG21 VAL 59 8.822 -7.344 -13.336 473 2HG2 VAL 59 HG22 VAL 59 10.149 -6.802 -14.373 474 3HG2 VAL 59 HG23 VAL 59 10.337 -8.272 -13.390 475 H ASN 60 H ASN 60 11.981 -7.103 -9.768 476 HA ASN 60 HA ASN 60 13.282 -9.664 -10.217 477 1HB ASN 60 HB2 ASN 60 14.895 -7.444 -9.681 478 2HB ASN 60 HB3 ASN 60 14.636 -8.144 -8.083 479 1HD2 ASN 60 HD22 ASN 60 15.389 -9.086 -11.491 480 2HD2 ASN 60 HD21 ASN 60 16.516 -10.358 -11.062 481 H GLU 61 H GLU 61 13.559 -10.858 -8.142 482 HA GLU 61 HA GLU 61 11.055 -11.009 -6.773 483 1HB GLU 61 HB2 GLU 61 12.466 -12.916 -7.180 484 2HB GLU 61 HB3 GLU 61 13.808 -12.235 -6.291 485 1HG GLU 61 HG2 GLU 61 11.095 -12.817 -5.008 486 2HG GLU 61 HG3 GLU 61 12.322 -14.065 -5.186 487 H GLY 62 H GLY 62 10.336 -9.490 -5.443 488 1HA GLY 62 HA2 GLY 62 10.258 -8.380 -3.402 489 2HA GLY 62 HA3 GLY 62 12.016 -8.487 -3.234 490 H ASP 63 H ASP 63 11.286 -7.425 -6.436 491 HA ASP 63 HA ASP 63 12.120 -4.696 -5.794 492 1HB ASP 63 HB2 ASP 63 12.847 -6.119 -7.814 493 2HB ASP 63 HB3 ASP 63 11.235 -5.836 -8.472 494 H VAL 64 H VAL 64 10.651 -3.011 -5.560 495 HA VAL 64 HA VAL 64 7.949 -3.770 -5.030 496 HB VAL 64 HB VAL 64 9.131 -0.969 -5.170 497 1HG1 VAL 64 HG11 VAL 64 7.333 -0.463 -3.497 498 2HG1 VAL 64 HG12 VAL 64 6.672 -0.956 -5.055 499 3HG1 VAL 64 HG13 VAL 64 6.700 -2.111 -3.712 500 1HG2 VAL 64 HG21 VAL 64 10.480 -2.311 -3.605 501 2HG2 VAL 64 HG22 VAL 64 9.443 -1.212 -2.701 502 3HG2 VAL 64 HG23 VAL 64 9.005 -2.929 -2.831 503 H LEU 65 H LEU 65 6.096 -3.458 -6.153 504 HA LEU 65 HA LEU 65 6.223 -2.461 -8.950 505 1HB LEU 65 HB2 LEU 65 5.128 -4.658 -8.651 506 2HB LEU 65 HB3 LEU 65 4.088 -3.999 -7.399 507 HG LEU 65 HG LEU 65 3.031 -2.477 -9.080 508 1HD1 LEU 65 HD11 LEU 65 4.802 -3.960 -11.053 509 2HD1 LEU 65 HD12 LEU 65 3.421 -2.925 -11.496 510 3HD1 LEU 65 HD13 LEU 65 4.821 -2.215 -10.700 511 1HD2 LEU 65 HD21 LEU 65 1.735 -4.189 -10.210 512 2HD2 LEU 65 HD22 LEU 65 3.010 -5.395 -9.926 513 3HD2 LEU 65 HD23 LEU 65 2.087 -4.730 -8.563 514 H LEU 66 H LEU 66 4.392 -2.087 -5.803 515 HA LEU 66 HA LEU 66 4.071 0.739 -6.424 516 1HB LEU 66 HB2 LEU 66 1.715 0.899 -6.415 517 2HB LEU 66 HB3 LEU 66 2.218 -0.115 -7.725 518 HG LEU 66 HG LEU 66 0.069 -0.648 -6.609 519 1HD1 LEU 66 HD11 LEU 66 0.346 -3.104 -6.598 520 2HD1 LEU 66 HD12 LEU 66 1.046 -2.306 -8.004 521 3HD1 LEU 66 HD13 LEU 66 2.106 -2.879 -6.696 522 1HD2 LEU 66 HD21 LEU 66 1.676 -1.784 -4.308 523 2HD2 LEU 66 HD22 LEU 66 0.703 -0.293 -4.260 524 3HD2 LEU 66 HD23 LEU 66 -0.069 -1.862 -4.549 525 H GLU 67 H GLU 67 2.780 1.896 -4.727 526 HA GLU 67 HA GLU 67 3.218 0.753 -2.026 527 1HB GLU 67 HB2 GLU 67 5.058 2.313 -2.653 528 2HB GLU 67 HB3 GLU 67 3.861 3.600 -2.924 529 1HG GLU 67 HG2 GLU 67 3.156 3.373 -0.545 530 2HG GLU 67 HG3 GLU 67 4.380 2.117 -0.315 531 H LEU 68 H LEU 68 1.592 1.377 -0.540 532 HA LEU 68 HA LEU 68 -0.920 2.299 -1.865 533 1HB LEU 68 HB2 LEU 68 -0.456 0.230 0.335 534 2HB LEU 68 HB3 LEU 68 -2.039 0.755 -0.220 535 HG LEU 68 HG LEU 68 0.003 -0.704 -1.936 536 1HD1 LEU 68 HD11 LEU 68 -1.518 -2.612 -1.792 537 2HD1 LEU 68 HD12 LEU 68 -0.970 -2.141 -0.176 538 3HD1 LEU 68 HD13 LEU 68 -2.605 -1.703 -0.724 539 1HD2 LEU 68 HD21 LEU 68 -2.864 0.190 -2.493 540 2HD2 LEU 68 HD22 LEU 68 -1.372 0.715 -3.318 541 3HD2 LEU 68 HD23 LEU 68 -1.941 -0.926 -3.508 542 H SER 69 H SER 69 -2.571 3.075 -0.351 543 HA SER 69 HA SER 69 -1.810 5.176 1.365 544 1HB SER 69 HB2 SER 69 -4.215 4.793 2.189 545 2HB SER 69 HB3 SER 69 -3.988 5.091 0.454 546 HG SER 69 HG SER 69 -5.368 3.214 1.278 547 H ASN 70 H ASN 70 -2.502 1.742 2.021 548 HA ASN 70 HA ASN 70 -2.224 1.760 4.832 549 1HB ASN 70 HB2 ASN 70 -3.230 -0.078 3.499 550 2HB ASN 70 HB3 ASN 70 -1.643 -0.477 2.838 551 1HD2 ASN 70 HD22 ASN 70 -0.415 -2.002 4.007 552 2HD2 ASN 70 HD21 ASN 70 -0.755 -2.461 5.653 553 H SER 71 H SER 71 0.330 2.127 2.447 554 HA SER 71 HA SER 71 2.364 0.695 3.942 555 1HB SER 71 HB2 SER 71 2.622 2.595 1.590 556 2HB SER 71 HB3 SER 71 3.838 1.444 2.152 557 HG SER 71 HG SER 71 1.435 0.223 1.735 558 H THR 72 H THR 72 0.919 3.463 4.926 559 HA THR 72 HA THR 72 3.076 5.243 5.521 560 HB THR 72 HB THR 72 1.395 5.858 7.419 561 HG1 THR 72 HG1 THR 72 0.171 3.982 7.469 562 1HG2 THR 72 HG21 THR 72 1.576 7.128 5.317 563 2HG2 THR 72 HG22 THR 72 0.496 5.975 4.502 564 3HG2 THR 72 HG23 THR 72 -0.111 6.990 5.828 565 H GLN 73 H GLN 73 4.130 5.531 7.601 566 HA GLN 73 HA GLN 73 4.201 3.289 9.488 567 1HB GLN 73 HB2 GLN 73 6.654 4.389 8.032 568 2HB GLN 73 HB3 GLN 73 6.726 3.406 9.488 569 1HG GLN 73 HG2 GLN 73 5.545 2.426 6.853 570 2HG GLN 73 HG3 GLN 73 7.210 2.193 7.348 571 1HE2 GLN 73 HE22 GLN 73 3.845 1.327 8.128 572 2HE2 GLN 73 HE21 GLN 73 4.241 -0.105 9.073 Start of MODEL 14 1 1H THR 2 H1 THR 2 5.902 -2.640 0.966 2 2H THR 2 H2 THR 2 5.729 -4.235 0.594 3 3H THR 2 H3 THR 2 5.978 -3.132 -0.595 4 HA THR 2 HA THR 2 3.640 -3.346 1.155 5 HB THR 2 HB THR 2 4.036 -1.313 -1.061 6 HG1 THR 2 HG1 THR 2 4.437 0.111 0.574 7 1HG2 THR 2 HG21 THR 2 2.064 -0.237 0.038 8 2HG2 THR 2 HG22 THR 2 1.659 -1.823 -0.637 9 3HG2 THR 2 HG23 THR 2 1.909 -1.636 1.115 10 H VAL 3 H VAL 3 3.999 -2.978 -2.495 11 HA VAL 3 HA VAL 3 3.113 -5.803 -2.715 12 HB VAL 3 HB VAL 3 2.094 -3.511 -4.419 13 1HG1 VAL 3 HG11 VAL 3 2.336 -5.620 -5.682 14 2HG1 VAL 3 HG12 VAL 3 1.399 -6.478 -4.444 15 3HG1 VAL 3 HG13 VAL 3 0.634 -5.222 -5.453 16 1HG2 VAL 3 HG21 VAL 3 0.600 -5.139 -2.331 17 2HG2 VAL 3 HG22 VAL 3 0.889 -3.387 -2.329 18 3HG2 VAL 3 HG23 VAL 3 -0.179 -4.096 -3.542 19 H SER 4 H SER 4 4.550 -6.871 -3.954 20 HA SER 4 HA SER 4 6.569 -5.399 -5.561 21 1HB SER 4 HB2 SER 4 7.112 -7.491 -3.427 22 2HB SER 4 HB3 SER 4 8.321 -6.600 -4.364 23 HG SER 4 HG SER 4 7.982 -5.739 -2.237 24 H ILE 5 H ILE 5 7.862 -6.795 -6.875 25 HA ILE 5 HA ILE 5 6.427 -9.107 -7.997 26 HB ILE 5 HB ILE 5 9.163 -7.992 -8.743 27 1HG1 ILE 5 HG12 ILE 5 7.701 -6.097 -8.997 28 2HG1 ILE 5 HG13 ILE 5 8.045 -6.752 -10.579 29 1HG2 ILE 5 HG21 ILE 5 8.614 -8.990 -10.982 30 2HG2 ILE 5 HG22 ILE 5 8.748 -10.184 -9.706 31 3HG2 ILE 5 HG23 ILE 5 7.144 -9.698 -10.279 32 1HD1 ILE 5 HD11 ILE 5 5.827 -7.827 -10.672 33 2HD1 ILE 5 HD12 ILE 5 5.453 -7.189 -9.052 34 3HD1 ILE 5 HD13 ILE 5 5.713 -6.082 -10.404 35 H GLN 6 H GLN 6 7.507 -11.196 -8.050 36 HA GLN 6 HA GLN 6 9.236 -11.746 -5.688 37 1HB GLN 6 HB2 GLN 6 7.765 -13.554 -5.084 38 2HB GLN 6 HB3 GLN 6 6.871 -12.048 -5.136 39 1HG GLN 6 HG2 GLN 6 6.801 -14.204 -7.301 40 2HG GLN 6 HG3 GLN 6 5.603 -13.985 -6.035 41 1HE2 GLN 6 HE22 GLN 6 4.189 -12.044 -6.112 42 2HE2 GLN 6 HE21 GLN 6 4.001 -11.189 -7.622 43 H MET 7 H MET 7 9.642 -11.670 -8.780 44 HA MET 7 HA MET 7 11.390 -13.959 -8.903 45 1HB MET 7 HB2 MET 7 10.417 -14.865 -11.007 46 2HB MET 7 HB3 MET 7 9.341 -15.074 -9.624 47 1HG MET 7 HG2 MET 7 8.058 -13.067 -10.339 48 2HG MET 7 HG3 MET 7 9.047 -12.980 -11.799 49 1HE MET 7 HE1 MET 7 5.793 -13.913 -10.468 50 2HE MET 7 HE2 MET 7 6.022 -12.958 -11.949 51 3HE MET 7 HE3 MET 7 5.144 -14.495 -12.008 52 H ALA 8 H ALA 8 12.808 -13.732 -10.822 53 HA ALA 8 HA ALA 8 13.257 -10.931 -11.569 54 1HB ALA 8 HB1 ALA 8 15.226 -11.838 -12.711 55 2HB ALA 8 HB2 ALA 8 15.138 -12.440 -11.035 56 3HB ALA 8 HB3 ALA 8 14.670 -13.496 -12.394 57 H GLY 9 H GLY 9 12.788 -9.970 -13.539 58 1HA GLY 9 HA2 GLY 9 12.506 -11.342 -15.977 59 2HA GLY 9 HA3 GLY 9 10.892 -11.233 -15.281 60 H ASN 10 H ASN 10 10.207 -9.858 -16.988 61 HA ASN 10 HA ASN 10 11.004 -6.999 -16.639 62 1HB ASN 10 HB2 ASN 10 10.766 -8.583 -19.213 63 2HB ASN 10 HB3 ASN 10 10.265 -6.896 -19.169 64 1HD2 ASN 10 HD22 ASN 10 13.063 -7.914 -17.145 65 2HD2 ASN 10 HD21 ASN 10 14.246 -7.157 -18.188 66 H LEU 11 H LEU 11 9.250 -5.696 -16.445 67 HA LEU 11 HA LEU 11 6.826 -7.062 -15.677 68 1HB LEU 11 HB2 LEU 11 8.072 -5.242 -14.419 69 2HB LEU 11 HB3 LEU 11 7.473 -4.098 -15.609 70 HG LEU 11 HG LEU 11 5.111 -4.775 -14.969 71 1HD1 LEU 11 HD11 LEU 11 5.429 -7.011 -14.028 72 2HD1 LEU 11 HD12 LEU 11 6.575 -6.387 -12.823 73 3HD1 LEU 11 HD13 LEU 11 4.856 -5.951 -12.745 74 1HD2 LEU 11 HD21 LEU 11 6.289 -2.819 -14.017 75 2HD2 LEU 11 HD22 LEU 11 5.176 -3.534 -12.848 76 3HD2 LEU 11 HD23 LEU 11 6.918 -3.833 -12.695 77 H TRP 12 H TRP 12 6.413 -7.764 -17.889 78 HA TRP 12 HA TRP 12 6.027 -6.771 -20.220 79 1HB TRP 12 HB2 TRP 12 5.238 -9.006 -19.284 80 2HB TRP 12 HB3 TRP 12 3.709 -8.230 -18.919 81 HD1 TRP 12 HD1 TRP 12 5.982 -9.004 -21.877 82 HE1 TRP 12 HE1 TRP 12 4.621 -9.367 -24.010 83 HE3 TRP 12 HE3 TRP 12 1.345 -7.956 -20.018 84 HZ2 TRP 12 HZ2 TRP 12 1.835 -9.175 -24.818 85 HZ3 TRP 12 HZ3 TRP 12 -0.656 -8.104 -21.472 86 HH2 TRP 12 HH2 TRP 12 -0.422 -8.693 -23.875 87 H LYS 13 H LYS 13 3.289 -6.254 -17.907 88 HA LYS 13 HA LYS 13 2.866 -3.575 -18.987 89 1HB LYS 13 HB2 LYS 13 0.728 -5.748 -19.137 90 2HB LYS 13 HB3 LYS 13 0.340 -4.029 -19.115 91 1HG LYS 13 HG2 LYS 13 1.808 -3.720 -21.152 92 2HG LYS 13 HG3 LYS 13 1.960 -5.484 -21.235 93 1HD LYS 13 HD2 LYS 13 -0.565 -5.624 -21.356 94 2HD LYS 13 HD3 LYS 13 -0.604 -3.850 -21.444 95 1HE LYS 13 HE2 LYS 13 0.858 -3.947 -23.474 96 2HE LYS 13 HE3 LYS 13 0.837 -5.713 -23.391 97 1HZ LYS 13 HZ1 LYS 13 -1.539 -3.993 -23.827 98 2HZ LYS 13 HZ2 LYS 13 -0.790 -4.883 -24.965 99 3HZ LYS 13 HZ3 LYS 13 -1.570 -5.626 -23.743 100 H VAL 14 H VAL 14 1.295 -2.387 -17.583 101 HA VAL 14 HA VAL 14 0.938 -3.447 -14.854 102 HB VAL 14 HB VAL 14 2.198 -0.740 -15.533 103 1HG1 VAL 14 HG11 VAL 14 0.816 -0.537 -13.526 104 2HG1 VAL 14 HG12 VAL 14 1.521 -2.023 -12.839 105 3HG1 VAL 14 HG13 VAL 14 2.510 -0.564 -13.046 106 1HG2 VAL 14 HG21 VAL 14 3.374 -3.231 -14.252 107 2HG2 VAL 14 HG22 VAL 14 3.881 -2.491 -15.788 108 3HG2 VAL 14 HG23 VAL 14 4.173 -1.635 -14.276 109 H HIS 15 H HIS 15 -0.973 -2.602 -13.946 110 HA HIS 15 HA HIS 15 -2.728 -1.164 -15.894 111 1HB HIS 15 HB2 HIS 15 -3.660 -3.181 -13.858 112 2HB HIS 15 HB3 HIS 15 -4.459 -2.654 -15.334 113 HD1 HIS 15 HD1 HIS 15 -2.222 -3.342 -17.501 114 HD2 HIS 15 HD2 HIS 15 -3.131 -5.668 -14.115 115 HE1 HIS 15 HE1 HIS 15 -1.234 -5.663 -17.922 116 H VAL 16 H VAL 16 -1.480 -1.099 -12.636 117 HA VAL 16 HA VAL 16 -3.630 0.529 -11.536 118 HB VAL 16 HB VAL 16 -1.984 0.926 -9.699 119 1HG1 VAL 16 HG11 VAL 16 -3.636 -0.861 -9.561 120 2HG1 VAL 16 HG12 VAL 16 -2.546 -1.974 -10.409 121 3HG1 VAL 16 HG13 VAL 16 -2.125 -1.357 -8.791 122 1HG2 VAL 16 HG21 VAL 16 0.097 0.526 -11.158 123 2HG2 VAL 16 HG22 VAL 16 0.076 -0.124 -9.525 124 3HG2 VAL 16 HG23 VAL 16 -0.208 -1.209 -10.909 125 H LYS 17 H LYS 17 -3.224 2.666 -10.652 126 HA LYS 17 HA LYS 17 -1.122 4.310 -11.721 127 1HB LYS 17 HB2 LYS 17 -2.631 6.091 -12.537 128 2HB LYS 17 HB3 LYS 17 -2.748 4.636 -13.523 129 1HG LYS 17 HG2 LYS 17 -4.867 4.016 -12.405 130 2HG LYS 17 HG3 LYS 17 -4.750 5.445 -11.360 131 1HD LYS 17 HD2 LYS 17 -4.853 6.913 -13.356 132 2HD LYS 17 HD3 LYS 17 -4.976 5.478 -14.400 133 1HE LYS 17 HE2 LYS 17 -7.067 4.812 -13.229 134 2HE LYS 17 HE3 LYS 17 -6.945 6.239 -12.193 135 1HZ LYS 17 HZ1 LYS 17 -7.299 6.298 -15.135 136 2HZ LYS 17 HZ2 LYS 17 -8.457 6.608 -14.034 137 3HZ LYS 17 HZ3 LYS 17 -7.188 7.618 -14.176 138 H ALA 18 H ALA 18 -1.063 6.331 -10.348 139 HA ALA 18 HA ALA 18 -1.738 5.887 -7.624 140 1HB ALA 18 HB1 ALA 18 -1.238 8.287 -7.326 141 2HB ALA 18 HB2 ALA 18 -0.002 7.495 -8.322 142 3HB ALA 18 HB3 ALA 18 -1.243 8.520 -9.085 143 H GLY 19 H GLY 19 -3.588 6.228 -6.479 144 1HA GLY 19 HA2 GLY 19 -5.654 7.136 -5.941 145 2HA GLY 19 HA3 GLY 19 -5.812 7.833 -7.558 146 H ASP 20 H ASP 20 -4.885 4.745 -8.313 147 HA ASP 20 HA ASP 20 -7.584 3.780 -8.791 148 1HB ASP 20 HB2 ASP 20 -5.566 3.248 -10.223 149 2HB ASP 20 HB3 ASP 20 -4.958 2.243 -8.896 150 H GLN 21 H GLN 21 -8.257 1.592 -7.930 151 HA GLN 21 HA GLN 21 -7.437 1.205 -5.082 152 1HB GLN 21 HB2 GLN 21 -9.749 2.077 -5.266 153 2HB GLN 21 HB3 GLN 21 -10.178 0.730 -6.333 154 1HG GLN 21 HG2 GLN 21 -9.720 -0.889 -4.544 155 2HG GLN 21 HG3 GLN 21 -9.138 0.387 -3.480 156 1HE2 GLN 21 HE22 GLN 21 -10.988 -1.196 -2.410 157 2HE2 GLN 21 HE21 GLN 21 -12.557 -0.432 -2.349 158 H ILE 22 H ILE 22 -6.957 -0.868 -4.492 159 HA ILE 22 HA ILE 22 -7.360 -3.024 -6.459 160 HB ILE 22 HB ILE 22 -5.178 -3.898 -6.217 161 1HG1 ILE 22 HG12 ILE 22 -4.622 -1.724 -4.157 162 2HG1 ILE 22 HG13 ILE 22 -4.703 -3.469 -3.891 163 1HG2 ILE 22 HG21 ILE 22 -3.825 -2.221 -7.332 164 2HG2 ILE 22 HG22 ILE 22 -5.488 -2.055 -7.881 165 3HG2 ILE 22 HG23 ILE 22 -4.822 -0.911 -6.698 166 1HD1 ILE 22 HD11 ILE 22 -2.403 -2.946 -3.933 167 2HD1 ILE 22 HD12 ILE 22 -2.719 -3.682 -5.509 168 3HD1 ILE 22 HD13 ILE 22 -2.565 -1.919 -5.376 169 H GLU 23 H GLU 23 -7.291 -5.161 -5.444 170 HA GLU 23 HA GLU 23 -7.972 -5.200 -2.578 171 1HB GLU 23 HB2 GLU 23 -10.071 -5.013 -3.849 172 2HB GLU 23 HB3 GLU 23 -9.611 -6.408 -4.841 173 1HG GLU 23 HG2 GLU 23 -9.641 -7.849 -2.821 174 2HG GLU 23 HG3 GLU 23 -10.021 -6.449 -1.817 175 H LYS 24 H LYS 24 -7.188 -7.173 -1.636 176 HA LYS 24 HA LYS 24 -4.974 -8.414 -2.700 177 1HB LYS 24 HB2 LYS 24 -5.824 -8.575 -0.355 178 2HB LYS 24 HB3 LYS 24 -7.053 -9.726 -0.892 179 1HG LYS 24 HG2 LYS 24 -5.256 -11.287 -1.639 180 2HG LYS 24 HG3 LYS 24 -4.038 -10.111 -1.134 181 1HD LYS 24 HD2 LYS 24 -5.027 -10.275 1.238 182 2HD LYS 24 HD3 LYS 24 -6.056 -11.573 0.622 183 1HE LYS 24 HE2 LYS 24 -4.291 -12.768 1.549 184 2HE LYS 24 HE3 LYS 24 -3.853 -12.707 -0.160 185 1HZ LYS 24 HZ1 LYS 24 -2.749 -11.035 2.021 186 2HZ LYS 24 HZ2 LYS 24 -1.952 -12.161 1.157 187 3HZ LYS 24 HZ3 LYS 24 -2.411 -10.752 0.449 188 H GLY 25 H GLY 25 -4.610 -9.657 -4.475 189 1HA GLY 25 HA2 GLY 25 -4.901 -11.571 -5.786 190 2HA GLY 25 HA3 GLY 25 -6.588 -11.699 -5.293 191 H GLN 26 H GLN 26 -6.436 -8.479 -6.080 192 HA GLN 26 HA GLN 26 -7.593 -8.751 -8.699 193 1HB GLN 26 HB2 GLN 26 -7.943 -6.876 -7.015 194 2HB GLN 26 HB3 GLN 26 -6.298 -6.310 -7.392 195 1HG GLN 26 HG2 GLN 26 -6.990 -5.932 -9.741 196 2HG GLN 26 HG3 GLN 26 -8.606 -6.547 -9.383 197 1HE2 GLN 26 HE22 GLN 26 -6.798 -3.698 -9.648 198 2HE2 GLN 26 HE21 GLN 26 -7.780 -2.646 -8.639 199 H GLU 27 H GLU 27 -6.528 -8.673 -10.710 200 HA GLU 27 HA GLU 27 -3.646 -8.949 -10.857 201 1HB GLU 27 HB2 GLU 27 -5.273 -9.947 -12.469 202 2HB GLU 27 HB3 GLU 27 -5.727 -8.324 -13.000 203 1HG GLU 27 HG2 GLU 27 -3.357 -7.955 -13.748 204 2HG GLU 27 HG3 GLU 27 -2.964 -9.599 -13.238 205 H VAL 28 H VAL 28 -2.146 -7.352 -11.107 206 HA VAL 28 HA VAL 28 -3.038 -4.540 -11.548 207 HB VAL 28 HB VAL 28 -1.336 -3.891 -9.793 208 1HG1 VAL 28 HG11 VAL 28 -3.713 -5.508 -8.772 209 2HG1 VAL 28 HG12 VAL 28 -2.834 -4.238 -7.902 210 3HG1 VAL 28 HG13 VAL 28 -3.781 -3.835 -9.349 211 1HG2 VAL 28 HG21 VAL 28 -0.738 -5.482 -8.055 212 2HG2 VAL 28 HG22 VAL 28 -1.614 -6.771 -8.892 213 3HG2 VAL 28 HG23 VAL 28 -0.140 -6.088 -9.613 214 H ALA 29 H ALA 29 -0.638 -7.074 -12.172 215 HA ALA 29 HA ALA 29 0.278 -5.475 -14.408 216 1HB ALA 29 HB1 ALA 29 1.821 -4.612 -12.680 217 2HB ALA 29 HB2 ALA 29 2.257 -6.256 -12.199 218 3HB ALA 29 HB3 ALA 29 2.704 -5.651 -13.802 219 H ILE 30 H ILE 30 2.148 -6.865 -15.486 220 HA ILE 30 HA ILE 30 1.716 -9.772 -15.166 221 HB ILE 30 HB ILE 30 1.492 -8.203 -17.770 222 1HG1 ILE 30 HG12 ILE 30 -0.427 -10.202 -16.480 223 2HG1 ILE 30 HG13 ILE 30 -0.601 -8.455 -16.411 224 1HG2 ILE 30 HG21 ILE 30 1.685 -11.242 -17.429 225 2HG2 ILE 30 HG22 ILE 30 1.407 -10.384 -18.961 226 3HG2 ILE 30 HG23 ILE 30 2.940 -10.219 -18.149 227 1HD1 ILE 30 HD11 ILE 30 -0.805 -10.138 -18.924 228 2HD1 ILE 30 HD12 ILE 30 -2.092 -9.272 -18.078 229 3HD1 ILE 30 HD13 ILE 30 -0.806 -8.354 -18.881 230 H LEU 31 H LEU 31 3.593 -10.890 -15.607 231 HA LEU 31 HA LEU 31 6.121 -9.336 -15.936 232 1HB LEU 31 HB2 LEU 31 5.754 -9.977 -13.655 233 2HB LEU 31 HB3 LEU 31 5.298 -11.622 -14.087 234 HG LEU 31 HG LEU 31 7.465 -11.306 -12.941 235 1HD1 LEU 31 HD11 LEU 31 7.840 -12.602 -15.656 236 2HD1 LEU 31 HD12 LEU 31 8.714 -12.932 -14.152 237 3HD1 LEU 31 HD13 LEU 31 6.993 -13.325 -14.286 238 1HD2 LEU 31 HD21 LEU 31 9.350 -10.357 -13.913 239 2HD2 LEU 31 HD22 LEU 31 8.612 -10.285 -15.532 240 3HD2 LEU 31 HD23 LEU 31 8.054 -9.194 -14.245 241 H GLU 32 H GLU 32 7.475 -10.167 -17.491 242 HA GLU 32 HA GLU 32 6.744 -12.732 -18.825 243 1HB GLU 32 HB2 GLU 32 6.541 -10.760 -20.297 244 2HB GLU 32 HB3 GLU 32 8.200 -10.282 -19.908 245 1HG GLU 32 HG2 GLU 32 8.987 -12.483 -20.885 246 2HG GLU 32 HG3 GLU 32 7.317 -12.832 -21.335 247 H SER 33 H SER 33 8.211 -14.322 -18.502 248 HA SER 33 HA SER 33 11.018 -13.975 -18.306 249 1HB SER 33 HB2 SER 33 10.235 -13.150 -15.977 250 2HB SER 33 HB3 SER 33 9.725 -14.813 -15.669 251 HG SER 33 HG SER 33 11.907 -14.066 -15.025 252 H MET 34 H MET 34 11.989 -16.216 -17.752 253 HA MET 34 HA MET 34 12.132 -18.434 -18.241 254 1HB MET 34 HB2 MET 34 9.360 -18.525 -16.992 255 2HB MET 34 HB3 MET 34 10.493 -19.866 -17.107 256 1HG MET 34 HG2 MET 34 12.014 -18.865 -15.566 257 2HG MET 34 HG3 MET 34 11.165 -17.322 -15.580 258 1HE MET 34 HE1 MET 34 9.155 -16.654 -14.178 259 2HE MET 34 HE2 MET 34 8.171 -17.734 -15.191 260 3HE MET 34 HE3 MET 34 8.037 -17.805 -13.423 261 H LYS 35 H LYS 35 11.113 -16.791 -20.413 262 HA LYS 35 HA LYS 35 10.011 -16.767 -22.371 263 1HB LYS 35 HB2 LYS 35 10.443 -19.778 -22.306 264 2HB LYS 35 HB3 LYS 35 10.029 -18.811 -23.725 265 1HG LYS 35 HG2 LYS 35 12.150 -17.536 -23.495 266 2HG LYS 35 HG3 LYS 35 12.576 -18.502 -22.077 267 1HD LYS 35 HD2 LYS 35 13.777 -19.361 -23.962 268 2HD LYS 35 HD3 LYS 35 12.570 -20.559 -23.471 269 1HE LYS 35 HE2 LYS 35 11.078 -19.809 -25.315 270 2HE LYS 35 HE3 LYS 35 12.255 -18.572 -25.773 271 1HZ LYS 35 HZ1 LYS 35 12.730 -21.496 -25.873 272 2HZ LYS 35 HZ2 LYS 35 12.443 -20.537 -27.157 273 3HZ LYS 35 HZ3 LYS 35 13.817 -20.352 -26.303 274 H MET 36 H MET 36 8.325 -16.705 -20.085 275 HA MET 36 HA MET 36 5.762 -17.584 -21.254 276 1HB MET 36 HB2 MET 36 6.769 -18.139 -18.422 277 2HB MET 36 HB3 MET 36 5.072 -18.246 -18.894 278 1HG MET 36 HG2 MET 36 5.634 -19.964 -20.579 279 2HG MET 36 HG3 MET 36 7.312 -19.943 -20.042 280 1HE MET 36 HE1 MET 36 7.157 -19.789 -16.846 281 2HE MET 36 HE2 MET 36 7.178 -21.526 -16.486 282 3HE MET 36 HE3 MET 36 8.198 -20.880 -17.790 283 H GLU 37 H GLU 37 3.986 -16.533 -19.829 284 HA GLU 37 HA GLU 37 4.748 -13.848 -18.816 285 1HB GLU 37 HB2 GLU 37 2.458 -14.621 -20.664 286 2HB GLU 37 HB3 GLU 37 2.475 -13.127 -19.714 287 1HG GLU 37 HG2 GLU 37 4.358 -12.252 -20.897 288 2HG GLU 37 HG3 GLU 37 4.722 -13.813 -21.637 289 H ILE 38 H ILE 38 3.758 -13.423 -16.864 290 HA ILE 38 HA ILE 38 1.918 -15.447 -15.720 291 HB ILE 38 HB ILE 38 4.416 -14.353 -14.331 292 1HG1 ILE 38 HG12 ILE 38 5.032 -16.965 -14.486 293 2HG1 ILE 38 HG13 ILE 38 4.078 -16.889 -15.953 294 1HG2 ILE 38 HG21 ILE 38 2.447 -16.578 -13.610 295 2HG2 ILE 38 HG22 ILE 38 3.904 -16.176 -12.691 296 3HG2 ILE 38 HG23 ILE 38 2.604 -14.997 -12.803 297 1HD1 ILE 38 HD11 ILE 38 5.670 -14.984 -16.707 298 2HD1 ILE 38 HD12 ILE 38 6.612 -15.346 -15.251 299 3HD1 ILE 38 HD13 ILE 38 6.412 -16.578 -16.503 300 HA PRO 39 HA PRO 39 0.114 -11.471 -14.577 301 1HB PRO 39 HB2 PRO 39 -1.856 -12.268 -12.848 302 2HB PRO 39 HB3 PRO 39 -1.952 -12.508 -14.620 303 1HG PRO 39 HG2 PRO 39 -1.071 -14.511 -12.521 304 2HG PRO 39 HG3 PRO 39 -2.239 -14.751 -13.860 305 1HD PRO 39 HD2 PRO 39 0.368 -15.515 -14.060 306 2HD PRO 39 HD3 PRO 39 -0.512 -14.853 -15.469 307 H ILE 40 H ILE 40 0.125 -10.039 -12.801 308 HA ILE 40 HA ILE 40 1.418 -10.946 -10.273 309 HB ILE 40 HB ILE 40 1.788 -8.373 -11.830 310 1HG1 ILE 40 HG12 ILE 40 3.147 -10.185 -12.769 311 2HG1 ILE 40 HG13 ILE 40 4.093 -8.874 -12.096 312 1HG2 ILE 40 HG21 ILE 40 3.370 -7.700 -10.043 313 2HG2 ILE 40 HG22 ILE 40 1.705 -7.801 -9.485 314 3HG2 ILE 40 HG23 ILE 40 2.845 -9.093 -9.071 315 1HD1 ILE 40 HD11 ILE 40 5.102 -11.023 -11.546 316 2HD1 ILE 40 HD12 ILE 40 4.577 -10.226 -10.067 317 3HD1 ILE 40 HD13 ILE 40 3.619 -11.567 -10.743 318 H VAL 41 H VAL 41 0.153 -10.571 -8.594 319 HA VAL 41 HA VAL 41 -2.307 -8.967 -8.964 320 HB VAL 41 HB VAL 41 -3.271 -10.571 -7.252 321 1HG1 VAL 41 HG11 VAL 41 -2.493 -11.685 -9.977 322 2HG1 VAL 41 HG12 VAL 41 -3.758 -12.337 -8.904 323 3HG1 VAL 41 HG13 VAL 41 -3.931 -10.717 -9.563 324 1HG2 VAL 41 HG21 VAL 41 -2.301 -12.768 -6.984 325 2HG2 VAL 41 HG22 VAL 41 -0.941 -12.368 -8.045 326 3HG2 VAL 41 HG23 VAL 41 -1.112 -11.568 -6.461 327 H ALA 42 H ALA 42 -3.193 -7.989 -7.089 328 HA ALA 42 HA ALA 42 -1.354 -6.523 -5.496 329 1HB ALA 42 HB1 ALA 42 -4.328 -7.066 -5.149 330 2HB ALA 42 HB2 ALA 42 -3.422 -5.770 -4.350 331 3HB ALA 42 HB3 ALA 42 -3.636 -5.757 -6.118 332 H ASP 43 H ASP 43 -0.218 -7.288 -3.799 333 HA ASP 43 HA ASP 43 -0.713 -9.776 -2.478 334 1HB ASP 43 HB2 ASP 43 1.513 -8.793 -2.547 335 2HB ASP 43 HB3 ASP 43 0.948 -7.336 -1.729 336 H ARG 44 H ARG 44 -1.996 -6.545 -1.979 337 HA ARG 44 HA ARG 44 -3.772 -7.440 0.134 338 1HB ARG 44 HB2 ARG 44 -3.044 -5.755 1.761 339 2HB ARG 44 HB3 ARG 44 -1.758 -6.913 1.431 340 1HG ARG 44 HG2 ARG 44 -0.869 -5.120 -0.287 341 2HG ARG 44 HG3 ARG 44 -1.990 -4.023 0.520 342 1HD ARG 44 HD2 ARG 44 0.220 -3.759 1.439 343 2HD ARG 44 HD3 ARG 44 -0.827 -4.487 2.680 344 HE ARG 44 HE ARG 44 0.517 -6.540 1.172 345 1HH1 ARG 44 HH21 ARG 44 1.272 -4.118 3.680 346 2HH1 ARG 44 HH22 ARG 44 2.608 -5.016 4.296 347 1HH2 ARG 44 HH11 ARG 44 2.143 -7.666 1.936 348 2HH2 ARG 44 HH12 ARG 44 3.149 -7.146 3.278 349 H SER 45 H SER 45 -5.460 -5.809 0.502 350 HA SER 45 HA SER 45 -6.111 -4.289 -1.841 351 1HB SER 45 HB2 SER 45 -7.405 -4.184 0.914 352 2HB SER 45 HB3 SER 45 -8.166 -3.859 -0.649 353 HG SER 45 HG SER 45 -8.567 -5.994 0.295 354 H GLY 46 H GLY 46 -6.515 -1.941 -1.915 355 1HA GLY 46 HA2 GLY 46 -6.279 -0.110 0.093 356 2HA GLY 46 HA3 GLY 46 -4.604 -0.306 -0.436 357 H ILE 47 H ILE 47 -5.236 2.108 -0.794 358 HA ILE 47 HA ILE 47 -6.121 2.508 -3.614 359 HB ILE 47 HB ILE 47 -5.679 4.505 -1.352 360 1HG1 ILE 47 HG12 ILE 47 -7.761 3.281 -1.006 361 2HG1 ILE 47 HG13 ILE 47 -8.063 4.959 -1.418 362 1HG2 ILE 47 HG21 ILE 47 -6.508 4.986 -4.244 363 2HG2 ILE 47 HG22 ILE 47 -6.636 6.192 -2.943 364 3HG2 ILE 47 HG23 ILE 47 -5.053 5.580 -3.420 365 1HD1 ILE 47 HD11 ILE 47 -8.327 2.606 -3.330 366 2HD1 ILE 47 HD12 ILE 47 -9.657 3.463 -2.537 367 3HD1 ILE 47 HD13 ILE 47 -8.663 4.303 -3.741 368 H VAL 48 H VAL 48 -4.540 2.902 -5.067 369 HA VAL 48 HA VAL 48 -1.769 2.447 -4.415 370 HB VAL 48 HB VAL 48 -3.033 3.499 -6.943 371 1HG1 VAL 48 HG11 VAL 48 -0.370 2.055 -6.461 372 2HG1 VAL 48 HG12 VAL 48 -1.031 2.558 -8.033 373 3HG1 VAL 48 HG13 VAL 48 -0.548 3.780 -6.855 374 1HG2 VAL 48 HG21 VAL 48 -4.044 1.332 -6.349 375 2HG2 VAL 48 HG22 VAL 48 -2.950 1.142 -7.705 376 3HG2 VAL 48 HG23 VAL 48 -2.435 0.630 -6.078 377 H LYS 49 H LYS 49 -0.578 3.886 -3.312 378 HA LYS 49 HA LYS 49 -1.150 6.765 -3.390 379 1HB LYS 49 HB2 LYS 49 -0.351 5.742 -1.297 380 2HB LYS 49 HB3 LYS 49 1.095 5.138 -2.105 381 1HG LYS 49 HG2 LYS 49 1.647 7.066 -0.776 382 2HG LYS 49 HG3 LYS 49 1.862 7.466 -2.480 383 1HD LYS 49 HD2 LYS 49 -0.330 8.664 -2.468 384 2HD LYS 49 HD3 LYS 49 -0.552 8.216 -0.761 385 1HE LYS 49 HE2 LYS 49 1.571 9.435 -0.215 386 2HE LYS 49 HE3 LYS 49 1.711 9.921 -1.910 387 1HZ LYS 49 HZ1 LYS 49 0.694 11.652 -0.578 388 2HZ LYS 49 HZ2 LYS 49 -0.405 11.108 -1.654 389 3HZ LYS 49 HZ3 LYS 49 -0.499 10.650 -0.076 390 H GLU 50 H GLU 50 1.328 4.396 -4.609 391 HA GLU 50 HA GLU 50 1.868 6.182 -6.861 392 1HB GLU 50 HB2 GLU 50 3.271 7.068 -4.925 393 2HB GLU 50 HB3 GLU 50 4.128 5.526 -4.904 394 1HG GLU 50 HG2 GLU 50 5.005 5.920 -7.129 395 2HG GLU 50 HG3 GLU 50 3.926 7.298 -7.377 396 H VAL 51 H VAL 51 3.263 5.085 -8.470 397 HA VAL 51 HA VAL 51 3.398 2.127 -8.125 398 HB VAL 51 HB VAL 51 3.096 3.649 -10.748 399 1HG1 VAL 51 HG11 VAL 51 2.744 0.690 -10.050 400 2HG1 VAL 51 HG12 VAL 51 2.493 1.426 -11.647 401 3HG1 VAL 51 HG13 VAL 51 4.111 1.388 -10.945 402 1HG2 VAL 51 HG21 VAL 51 0.938 2.231 -9.135 403 2HG2 VAL 51 HG22 VAL 51 1.002 3.973 -9.487 404 3HG2 VAL 51 HG23 VAL 51 0.751 2.829 -10.801 405 H LYS 52 H LYS 52 5.414 1.241 -8.499 406 HA LYS 52 HA LYS 52 7.642 3.226 -8.580 407 1HB LYS 52 HB2 LYS 52 7.523 0.418 -7.413 408 2HB LYS 52 HB3 LYS 52 8.856 1.556 -7.239 409 1HG LYS 52 HG2 LYS 52 6.067 1.869 -6.049 410 2HG LYS 52 HG3 LYS 52 7.525 1.362 -5.206 411 1HD LYS 52 HD2 LYS 52 8.564 3.574 -5.637 412 2HD LYS 52 HD3 LYS 52 7.057 4.115 -6.428 413 1HE LYS 52 HE2 LYS 52 5.784 3.735 -4.399 414 2HE LYS 52 HE3 LYS 52 7.184 3.016 -3.589 415 1HZ LYS 52 HZ1 LYS 52 7.023 5.849 -4.462 416 2HZ LYS 52 HZ2 LYS 52 6.749 5.300 -2.936 417 3HZ LYS 52 HZ3 LYS 52 8.250 5.161 -3.603 418 H LYS 53 H LYS 53 6.225 1.461 -10.863 419 HA LYS 53 HA LYS 53 8.685 0.825 -12.316 420 1HB LYS 53 HB2 LYS 53 6.494 -1.245 -11.758 421 2HB LYS 53 HB3 LYS 53 7.804 -1.452 -12.922 422 1HG LYS 53 HG2 LYS 53 8.189 -1.183 -9.932 423 2HG LYS 53 HG3 LYS 53 8.183 -2.695 -10.828 424 1HD LYS 53 HD2 LYS 53 10.135 -2.051 -12.126 425 2HD LYS 53 HD3 LYS 53 10.169 -0.441 -11.418 426 1HE LYS 53 HE2 LYS 53 10.565 -3.029 -9.874 427 2HE LYS 53 HE3 LYS 53 11.849 -1.956 -10.435 428 1HZ LYS 53 HZ1 LYS 53 11.362 -1.563 -8.176 429 2HZ LYS 53 HZ2 LYS 53 10.848 -0.212 -9.016 430 3HZ LYS 53 HZ3 LYS 53 9.770 -1.329 -8.438 431 H LYS 54 H LYS 54 7.795 -0.170 -14.576 432 HA LYS 54 HA LYS 54 5.292 1.042 -15.430 433 1HB LYS 54 HB2 LYS 54 6.265 2.239 -17.315 434 2HB LYS 54 HB3 LYS 54 6.853 2.918 -15.802 435 1HG LYS 54 HG2 LYS 54 9.007 1.812 -16.052 436 2HG LYS 54 HG3 LYS 54 8.460 0.918 -17.470 437 1HD LYS 54 HD2 LYS 54 8.668 3.947 -17.323 438 2HD LYS 54 HD3 LYS 54 9.925 2.902 -17.971 439 1HE LYS 54 HE2 LYS 54 7.084 3.097 -19.083 440 2HE LYS 54 HE3 LYS 54 8.480 3.968 -19.710 441 1HZ LYS 54 HZ1 LYS 54 8.105 2.004 -20.998 442 2HZ LYS 54 HZ2 LYS 54 9.517 1.823 -20.212 443 3HZ LYS 54 HZ3 LYS 54 8.179 1.009 -19.710 444 H GLU 55 H GLU 55 4.892 0.368 -17.738 445 HA GLU 55 HA GLU 55 5.153 -2.397 -18.119 446 1HB GLU 55 HB2 GLU 55 4.867 -0.316 -20.337 447 2HB GLU 55 HB3 GLU 55 4.387 -2.006 -20.375 448 1HG GLU 55 HG2 GLU 55 2.338 -1.131 -19.979 449 2HG GLU 55 HG3 GLU 55 2.851 -1.262 -18.303 450 H GLY 56 H GLY 56 6.715 -3.671 -18.909 451 1HA GLY 56 HA2 GLY 56 8.479 -4.417 -20.145 452 2HA GLY 56 HA3 GLY 56 8.666 -2.808 -20.857 453 H ASP 57 H ASP 57 8.744 -2.297 -17.500 454 HA ASP 57 HA ASP 57 11.590 -1.807 -17.605 455 1HB ASP 57 HB2 ASP 57 9.926 -0.476 -16.271 456 2HB ASP 57 HB3 ASP 57 9.796 -1.838 -15.154 457 H PHE 58 H PHE 58 13.197 -2.776 -16.185 458 HA PHE 58 HA PHE 58 13.045 -5.694 -15.978 459 1HB PHE 58 HB2 PHE 58 15.173 -4.595 -16.473 460 2HB PHE 58 HB3 PHE 58 15.041 -3.609 -15.024 461 HD1 PHE 58 HD1 PHE 58 15.694 -4.453 -12.848 462 HD2 PHE 58 HD2 PHE 58 15.637 -7.071 -16.280 463 HE1 PHE 58 HE1 PHE 58 16.996 -6.146 -11.585 464 HE2 PHE 58 HE2 PHE 58 16.932 -8.760 -15.010 465 HZ PHE 58 HZ PHE 58 17.643 -8.289 -12.673 466 H VAL 59 H VAL 59 12.742 -6.884 -14.064 467 HA VAL 59 HA VAL 59 12.350 -5.465 -11.525 468 HB VAL 59 HB VAL 59 10.249 -6.871 -11.159 469 1HG1 VAL 59 HG11 VAL 59 10.246 -4.440 -11.334 470 2HG1 VAL 59 HG12 VAL 59 10.032 -4.542 -13.099 471 3HG1 VAL 59 HG13 VAL 59 8.769 -5.137 -12.007 472 1HG2 VAL 59 HG21 VAL 59 10.091 -6.848 -14.202 473 2HG2 VAL 59 HG22 VAL 59 10.377 -8.284 -13.191 474 3HG2 VAL 59 HG23 VAL 59 8.845 -7.397 -13.068 475 H ASN 60 H ASN 60 12.179 -7.017 -9.701 476 HA ASN 60 HA ASN 60 13.466 -9.580 -10.233 477 1HB ASN 60 HB2 ASN 60 15.088 -7.376 -9.740 478 2HB ASN 60 HB3 ASN 60 14.874 -8.060 -8.127 479 1HD2 ASN 60 HD22 ASN 60 15.522 -9.032 -11.548 480 2HD2 ASN 60 HD21 ASN 60 16.658 -10.304 -11.147 481 H GLU 61 H GLU 61 13.850 -10.798 -8.184 482 HA GLU 61 HA GLU 61 11.394 -11.080 -6.766 483 1HB GLU 61 HB2 GLU 61 12.907 -12.928 -7.199 484 2HB GLU 61 HB3 GLU 61 14.216 -12.144 -6.326 485 1HG GLU 61 HG2 GLU 61 12.825 -12.303 -4.217 486 2HG GLU 61 HG3 GLU 61 11.576 -13.134 -5.142 487 H GLY 62 H GLY 62 10.616 -9.621 -5.362 488 1HA GLY 62 HA2 GLY 62 10.561 -8.656 -3.244 489 2HA GLY 62 HA3 GLY 62 12.327 -8.566 -3.195 490 H ASP 63 H ASP 63 11.440 -7.494 -6.293 491 HA ASP 63 HA ASP 63 12.114 -4.761 -5.554 492 1HB ASP 63 HB2 ASP 63 12.877 -6.043 -7.635 493 2HB ASP 63 HB3 ASP 63 11.252 -5.805 -8.276 494 H VAL 64 H VAL 64 10.672 -3.084 -5.274 495 HA VAL 64 HA VAL 64 7.964 -3.775 -4.738 496 HB VAL 64 HB VAL 64 9.205 -0.999 -4.932 497 1HG1 VAL 64 HG11 VAL 64 7.441 -0.403 -3.271 498 2HG1 VAL 64 HG12 VAL 64 6.745 -0.932 -4.802 499 3HG1 VAL 64 HG13 VAL 64 6.762 -2.038 -3.416 500 1HG2 VAL 64 HG21 VAL 64 10.538 -2.343 -3.364 501 2HG2 VAL 64 HG22 VAL 64 9.530 -1.219 -2.459 502 3HG2 VAL 64 HG23 VAL 64 9.061 -2.930 -2.570 503 H LEU 65 H LEU 65 6.142 -3.582 -5.918 504 HA LEU 65 HA LEU 65 6.256 -2.676 -8.738 505 1HB LEU 65 HB2 LEU 65 5.079 -4.778 -8.355 506 2HB LEU 65 HB3 LEU 65 4.141 -4.079 -7.041 507 HG LEU 65 HG LEU 65 2.971 -2.567 -8.627 508 1HD1 LEU 65 HD11 LEU 65 3.153 -2.972 -11.061 509 2HD1 LEU 65 HD12 LEU 65 4.670 -2.363 -10.402 510 3HD1 LEU 65 HD13 LEU 65 4.499 -4.096 -10.767 511 1HD2 LEU 65 HD21 LEU 65 1.601 -4.275 -9.708 512 2HD2 LEU 65 HD22 LEU 65 2.851 -5.499 -9.393 513 3HD2 LEU 65 HD23 LEU 65 1.988 -4.733 -8.042 514 H LEU 66 H LEU 66 4.502 -2.056 -5.594 515 HA LEU 66 HA LEU 66 4.148 0.739 -6.382 516 1HB LEU 66 HB2 LEU 66 1.733 0.765 -6.431 517 2HB LEU 66 HB3 LEU 66 2.370 -0.285 -7.667 518 HG LEU 66 HG LEU 66 1.855 -2.240 -6.101 519 1HD1 LEU 66 HD11 LEU 66 -0.103 -1.782 -4.531 520 2HD1 LEU 66 HD12 LEU 66 1.424 -1.154 -3.950 521 3HD1 LEU 66 HD13 LEU 66 0.252 -0.050 -4.702 522 1HD2 LEU 66 HD21 LEU 66 0.557 -1.794 -8.080 523 2HD2 LEU 66 HD22 LEU 66 -0.501 -2.317 -6.775 524 3HD2 LEU 66 HD23 LEU 66 -0.427 -0.589 -7.201 525 H GLU 67 H GLU 67 2.768 1.902 -4.755 526 HA GLU 67 HA GLU 67 3.230 0.904 -2.000 527 1HB GLU 67 HB2 GLU 67 5.066 2.380 -2.600 528 2HB GLU 67 HB3 GLU 67 3.944 3.616 -3.197 529 1HG GLU 67 HG2 GLU 67 3.133 4.059 -0.967 530 2HG GLU 67 HG3 GLU 67 3.979 2.643 -0.321 531 H LEU 68 H LEU 68 1.631 1.656 -0.539 532 HA LEU 68 HA LEU 68 -0.907 2.477 -1.864 533 1HB LEU 68 HB2 LEU 68 -0.405 0.501 0.400 534 2HB LEU 68 HB3 LEU 68 -1.996 1.034 -0.121 535 HG LEU 68 HG LEU 68 -0.025 -0.498 -1.868 536 1HD1 LEU 68 HD11 LEU 68 -0.932 -1.868 -0.038 537 2HD1 LEU 68 HD12 LEU 68 -2.584 -1.427 -0.513 538 3HD1 LEU 68 HD13 LEU 68 -1.570 -2.383 -1.611 539 1HD2 LEU 68 HD21 LEU 68 -1.406 0.843 -3.271 540 2HD2 LEU 68 HD22 LEU 68 -2.040 -0.779 -3.355 541 3HD2 LEU 68 HD23 LEU 68 -2.887 0.428 -2.371 542 H SER 69 H SER 69 -2.422 3.522 -0.566 543 HA SER 69 HA SER 69 -1.339 5.672 1.017 544 1HB SER 69 HB2 SER 69 -4.227 4.808 0.554 545 2HB SER 69 HB3 SER 69 -3.675 6.397 1.107 546 HG SER 69 HG SER 69 -3.173 5.168 -1.415 547 H ASN 70 H ASN 70 -2.128 6.229 3.215 548 HA ASN 70 HA ASN 70 -3.078 4.058 4.945 549 1HB ASN 70 HB2 ASN 70 -0.601 3.757 4.928 550 2HB ASN 70 HB3 ASN 70 -0.392 5.452 5.363 551 1HD2 ASN 70 HD22 ASN 70 0.108 5.655 7.531 552 2HD2 ASN 70 HD21 ASN 70 -0.536 4.631 8.807 553 H SER 71 H SER 71 -3.638 4.979 7.140 554 HA SER 71 HA SER 71 -5.122 7.369 6.912 555 1HB SER 71 HB2 SER 71 -5.256 6.995 9.478 556 2HB SER 71 HB3 SER 71 -5.905 5.753 8.396 557 HG SER 71 HG SER 71 -4.599 4.866 10.057 558 H THR 72 H THR 72 -1.778 6.853 7.857 559 HA THR 72 HA THR 72 -1.454 9.792 8.140 560 HB THR 72 HB THR 72 0.085 7.706 9.749 561 HG1 THR 72 HG1 THR 72 -2.037 7.820 10.482 562 1HG2 THR 72 HG21 THR 72 -0.047 10.751 9.966 563 2HG2 THR 72 HG22 THR 72 0.842 9.668 11.062 564 3HG2 THR 72 HG23 THR 72 1.331 9.802 9.367 565 H GLN 73 H GLN 73 0.051 10.520 6.670 566 HA GLN 73 HA GLN 73 1.977 8.771 5.385 567 1HB GLN 73 HB2 GLN 73 0.992 9.153 3.122 568 2HB GLN 73 HB3 GLN 73 0.018 8.094 4.136 569 1HG GLN 73 HG2 GLN 73 -1.550 9.962 4.613 570 2HG GLN 73 HG3 GLN 73 -0.563 11.046 3.629 571 1HE2 GLN 73 HE21 GLN 73 -2.875 8.365 3.571 572 2HE2 GLN 73 HE22 GLN 73 -3.203 8.477 1.844 Start of MODEL 15 1 1H THR 2 H1 THR 2 3.581 -1.265 1.479 2 2H THR 2 H2 THR 2 2.531 -2.495 1.167 3 3H THR 2 H3 THR 2 4.104 -2.827 1.517 4 HA THR 2 HA THR 2 3.328 -1.264 -0.826 5 HB THR 2 HB THR 2 5.666 -2.286 -1.522 6 HG1 THR 2 HG1 THR 2 6.994 -2.753 0.166 7 1HG2 THR 2 HG21 THR 2 6.886 -0.411 -0.459 8 2HG2 THR 2 HG22 THR 2 5.389 0.102 -1.234 9 3HG2 THR 2 HG23 THR 2 5.462 -0.048 0.539 10 H VAL 3 H VAL 3 4.017 -2.755 -2.895 11 HA VAL 3 HA VAL 3 3.253 -5.578 -2.530 12 HB VAL 3 HB VAL 3 2.095 -3.711 -4.639 13 1HG1 VAL 3 HG11 VAL 3 2.503 -5.936 -5.598 14 2HG1 VAL 3 HG12 VAL 3 1.662 -6.702 -4.235 15 3HG1 VAL 3 HG13 VAL 3 0.775 -5.680 -5.395 16 1HG2 VAL 3 HG21 VAL 3 0.682 -5.126 -2.352 17 2HG2 VAL 3 HG22 VAL 3 0.875 -3.372 -2.582 18 3HG2 VAL 3 HG23 VAL 3 -0.133 -4.287 -3.697 19 H SER 4 H SER 4 4.590 -6.846 -3.925 20 HA SER 4 HA SER 4 6.656 -5.408 -5.518 21 1HB SER 4 HB2 SER 4 7.146 -7.514 -3.386 22 2HB SER 4 HB3 SER 4 8.376 -6.645 -4.318 23 HG SER 4 HG SER 4 8.026 -5.789 -2.180 24 H ILE 5 H ILE 5 7.947 -6.789 -6.824 25 HA ILE 5 HA ILE 5 6.526 -9.106 -7.967 26 HB ILE 5 HB ILE 5 9.237 -7.909 -8.690 27 1HG1 ILE 5 HG12 ILE 5 7.655 -6.113 -9.011 28 2HG1 ILE 5 HG13 ILE 5 8.101 -6.765 -10.568 29 1HG2 ILE 5 HG21 ILE 5 7.354 -9.781 -10.203 30 2HG2 ILE 5 HG22 ILE 5 8.772 -8.984 -10.922 31 3HG2 ILE 5 HG23 ILE 5 8.987 -10.125 -9.611 32 1HD1 ILE 5 HD11 ILE 5 5.496 -7.334 -9.118 33 2HD1 ILE 5 HD12 ILE 5 5.733 -6.280 -10.520 34 3HD1 ILE 5 HD13 ILE 5 5.964 -8.021 -10.696 35 H GLN 6 H GLN 6 7.636 -11.187 -8.032 36 HA GLN 6 HA GLN 6 9.357 -11.732 -5.663 37 1HB GLN 6 HB2 GLN 6 7.889 -13.537 -5.054 38 2HB GLN 6 HB3 GLN 6 6.987 -12.036 -5.119 39 1HG GLN 6 HG2 GLN 6 6.939 -14.213 -7.264 40 2HG GLN 6 HG3 GLN 6 5.730 -13.982 -6.011 41 1HE2 GLN 6 HE22 GLN 6 4.298 -12.065 -6.135 42 2HE2 GLN 6 HE21 GLN 6 4.126 -11.224 -7.657 43 H MET 7 H MET 7 9.737 -11.678 -8.777 44 HA MET 7 HA MET 7 11.504 -13.956 -8.884 45 1HB MET 7 HB2 MET 7 10.517 -14.897 -10.967 46 2HB MET 7 HB3 MET 7 9.458 -15.097 -9.569 47 1HG MET 7 HG2 MET 7 8.144 -13.119 -10.287 48 2HG MET 7 HG3 MET 7 9.120 -13.023 -11.755 49 1HE MET 7 HE1 MET 7 5.236 -14.584 -11.939 50 2HE MET 7 HE2 MET 7 5.888 -13.983 -10.404 51 3HE MET 7 HE3 MET 7 6.100 -13.038 -11.895 52 H ALA 8 H ALA 8 12.903 -13.743 -10.835 53 HA ALA 8 HA ALA 8 13.311 -10.938 -11.595 54 1HB ALA 8 HB1 ALA 8 14.764 -13.479 -12.418 55 2HB ALA 8 HB2 ALA 8 15.285 -11.810 -12.742 56 3HB ALA 8 HB3 ALA 8 15.219 -12.407 -11.066 57 H GLY 9 H GLY 9 12.813 -9.987 -13.556 58 1HA GLY 9 HA2 GLY 9 12.502 -11.374 -15.989 59 2HA GLY 9 HA3 GLY 9 10.900 -11.250 -15.266 60 H ASN 10 H ASN 10 10.197 -9.873 -16.958 61 HA ASN 10 HA ASN 10 11.037 -7.021 -16.663 62 1HB ASN 10 HB2 ASN 10 10.783 -8.648 -19.206 63 2HB ASN 10 HB3 ASN 10 10.264 -6.966 -19.197 64 1HD2 ASN 10 HD22 ASN 10 13.086 -7.952 -17.181 65 2HD2 ASN 10 HD21 ASN 10 14.256 -7.190 -18.236 66 H LEU 11 H LEU 11 9.307 -5.682 -16.515 67 HA LEU 11 HA LEU 11 6.870 -6.976 -15.671 68 1HB LEU 11 HB2 LEU 11 8.140 -5.139 -14.496 69 2HB LEU 11 HB3 LEU 11 7.609 -4.032 -15.755 70 HG LEU 11 HG LEU 11 5.212 -4.561 -15.122 71 1HD1 LEU 11 HD11 LEU 11 6.561 -6.146 -12.886 72 2HD1 LEU 11 HD12 LEU 11 4.872 -5.607 -12.844 73 3HD1 LEU 11 HD13 LEU 11 5.389 -6.756 -14.075 74 1HD2 LEU 11 HD21 LEU 11 6.474 -2.619 -14.259 75 2HD2 LEU 11 HD22 LEU 11 5.322 -3.218 -13.070 76 3HD2 LEU 11 HD23 LEU 11 7.043 -3.602 -12.883 77 H TRP 12 H TRP 12 6.374 -7.769 -17.842 78 HA TRP 12 HA TRP 12 5.995 -6.790 -20.208 79 1HB TRP 12 HB2 TRP 12 5.240 -9.025 -19.203 80 2HB TRP 12 HB3 TRP 12 3.695 -8.261 -18.889 81 HD1 TRP 12 HD1 TRP 12 6.041 -8.997 -21.813 82 HE1 TRP 12 HE1 TRP 12 4.714 -9.572 -23.917 83 HE3 TRP 12 HE3 TRP 12 1.333 -8.187 -20.004 84 HZ2 TRP 12 HZ2 TRP 12 1.921 -9.703 -24.706 85 HZ3 TRP 12 HZ3 TRP 12 -0.648 -8.597 -21.433 86 HH2 TRP 12 HH2 TRP 12 -0.369 -9.344 -23.785 87 H LYS 13 H LYS 13 3.276 -6.291 -17.861 88 HA LYS 13 HA LYS 13 2.742 -3.640 -18.980 89 1HB LYS 13 HB2 LYS 13 0.701 -5.912 -19.033 90 2HB LYS 13 HB3 LYS 13 0.257 -4.203 -19.126 91 1HG LYS 13 HG2 LYS 13 1.670 -3.982 -21.189 92 2HG LYS 13 HG3 LYS 13 1.941 -5.735 -21.140 93 1HD LYS 13 HD2 LYS 13 -0.570 -6.048 -21.188 94 2HD LYS 13 HD3 LYS 13 -0.739 -4.316 -21.474 95 1HE LYS 13 HE2 LYS 13 0.814 -6.273 -23.238 96 2HE LYS 13 HE3 LYS 13 -0.834 -5.727 -23.548 97 1HZ LYS 13 HZ1 LYS 13 0.733 -4.456 -24.836 98 2HZ LYS 13 HZ2 LYS 13 0.016 -3.462 -23.767 99 3HZ LYS 13 HZ3 LYS 13 1.553 -3.971 -23.517 100 H VAL 14 H VAL 14 1.113 -2.509 -17.548 101 HA VAL 14 HA VAL 14 0.861 -3.582 -14.812 102 HB VAL 14 HB VAL 14 1.989 -0.824 -15.493 103 1HG1 VAL 14 HG11 VAL 14 1.454 -2.151 -12.787 104 2HG1 VAL 14 HG12 VAL 14 2.381 -0.657 -13.015 105 3HG1 VAL 14 HG13 VAL 14 0.671 -0.688 -13.435 106 1HG2 VAL 14 HG21 VAL 14 3.294 -3.275 -14.252 107 2HG2 VAL 14 HG22 VAL 14 3.727 -2.521 -15.805 108 3HG2 VAL 14 HG23 VAL 14 4.031 -1.649 -14.308 109 H HIS 15 H HIS 15 -1.034 -2.774 -13.807 110 HA HIS 15 HA HIS 15 -2.950 -1.418 -15.652 111 1HB HIS 15 HB2 HIS 15 -3.682 -3.659 -13.769 112 2HB HIS 15 HB3 HIS 15 -4.544 -3.093 -15.196 113 HD1 HIS 15 HD1 HIS 15 -2.396 -3.512 -17.474 114 HD2 HIS 15 HD2 HIS 15 -2.894 -6.025 -14.143 115 HE1 HIS 15 HE1 HIS 15 -1.269 -5.734 -18.058 116 H VAL 16 H VAL 16 -1.418 -0.208 -13.365 117 HA VAL 16 HA VAL 16 -3.727 0.746 -11.774 118 HB VAL 16 HB VAL 16 -2.168 0.882 -9.797 119 1HG1 VAL 16 HG11 VAL 16 -2.624 -1.367 -9.021 120 2HG1 VAL 16 HG12 VAL 16 -4.018 -0.721 -9.895 121 3HG1 VAL 16 HG13 VAL 16 -2.965 -1.912 -10.685 122 1HG2 VAL 16 HG21 VAL 16 -0.313 -0.604 -9.573 123 2HG2 VAL 16 HG22 VAL 16 -0.560 -1.283 -11.194 124 3HG2 VAL 16 HG23 VAL 16 -0.030 0.404 -10.996 125 H LYS 17 H LYS 17 -3.294 2.808 -10.704 126 HA LYS 17 HA LYS 17 -1.107 4.448 -11.667 127 1HB LYS 17 HB2 LYS 17 -2.591 6.252 -12.482 128 2HB LYS 17 HB3 LYS 17 -2.712 4.801 -13.475 129 1HG LYS 17 HG2 LYS 17 -4.861 4.202 -12.372 130 2HG LYS 17 HG3 LYS 17 -4.714 5.600 -11.304 131 1HD LYS 17 HD2 LYS 17 -6.272 6.123 -13.049 132 2HD LYS 17 HD3 LYS 17 -4.824 7.119 -13.264 133 1HE LYS 17 HE2 LYS 17 -4.021 5.565 -15.035 134 2HE LYS 17 HE3 LYS 17 -5.441 4.539 -14.785 135 1HZ LYS 17 HZ1 LYS 17 -5.514 7.343 -15.745 136 2HZ LYS 17 HZ2 LYS 17 -5.734 6.019 -16.666 137 3HZ LYS 17 HZ3 LYS 17 -6.825 6.392 -15.518 138 H ALA 18 H ALA 18 -1.064 6.484 -10.330 139 HA ALA 18 HA ALA 18 -1.660 6.061 -7.591 140 1HB ALA 18 HB1 ALA 18 -1.174 8.463 -7.328 141 2HB ALA 18 HB2 ALA 18 0.033 7.677 -8.360 142 3HB ALA 18 HB3 ALA 18 -1.243 8.684 -9.089 143 H GLY 19 H GLY 19 -3.442 6.397 -6.375 144 1HA GLY 19 HA2 GLY 19 -5.476 7.272 -5.726 145 2HA GLY 19 HA3 GLY 19 -5.699 8.025 -7.310 146 H ASP 20 H ASP 20 -4.850 4.901 -8.139 147 HA ASP 20 HA ASP 20 -7.590 4.068 -8.601 148 1HB ASP 20 HB2 ASP 20 -5.552 3.491 -10.046 149 2HB ASP 20 HB3 ASP 20 -5.082 2.362 -8.775 150 H GLN 21 H GLN 21 -8.276 1.822 -7.841 151 HA GLN 21 HA GLN 21 -7.576 1.320 -4.967 152 1HB GLN 21 HB2 GLN 21 -9.883 2.173 -5.197 153 2HB GLN 21 HB3 GLN 21 -10.198 1.030 -6.494 154 1HG GLN 21 HG2 GLN 21 -11.306 0.166 -4.622 155 2HG GLN 21 HG3 GLN 21 -9.918 -0.869 -4.841 156 1HE2 GLN 21 HE22 GLN 21 -8.834 -1.360 -2.888 157 2HE2 GLN 21 HE21 GLN 21 -8.948 -0.362 -1.456 158 H ILE 22 H ILE 22 -6.981 -0.793 -4.532 159 HA ILE 22 HA ILE 22 -7.536 -2.876 -6.568 160 HB ILE 22 HB ILE 22 -5.409 -3.898 -6.281 161 1HG1 ILE 22 HG12 ILE 22 -4.756 -1.712 -4.266 162 2HG1 ILE 22 HG13 ILE 22 -4.900 -3.447 -3.967 163 1HG2 ILE 22 HG21 ILE 22 -3.995 -2.380 -7.473 164 2HG2 ILE 22 HG22 ILE 22 -5.655 -2.070 -7.981 165 3HG2 ILE 22 HG23 ILE 22 -4.857 -0.963 -6.843 166 1HD1 ILE 22 HD11 ILE 22 -2.737 -2.008 -5.509 167 2HD1 ILE 22 HD12 ILE 22 -2.582 -2.928 -3.999 168 3HD1 ILE 22 HD13 ILE 22 -2.910 -3.775 -5.520 169 H GLU 23 H GLU 23 -7.437 -5.079 -5.572 170 HA GLU 23 HA GLU 23 -8.133 -5.151 -2.709 171 1HB GLU 23 HB2 GLU 23 -10.224 -4.914 -3.947 172 2HB GLU 23 HB3 GLU 23 -9.787 -6.280 -5.001 173 1HG GLU 23 HG2 GLU 23 -9.839 -7.799 -3.044 174 2HG GLU 23 HG3 GLU 23 -10.167 -6.435 -1.973 175 H LYS 24 H LYS 24 -7.314 -7.055 -1.771 176 HA LYS 24 HA LYS 24 -5.116 -8.300 -2.819 177 1HB LYS 24 HB2 LYS 24 -5.970 -8.369 -0.448 178 2HB LYS 24 HB3 LYS 24 -7.130 -9.608 -0.941 179 1HG LYS 24 HG2 LYS 24 -5.209 -11.073 -1.644 180 2HG LYS 24 HG3 LYS 24 -4.089 -9.819 -1.090 181 1HD LYS 24 HD2 LYS 24 -5.111 -10.034 1.232 182 2HD LYS 24 HD3 LYS 24 -6.129 -11.330 0.600 183 1HE LYS 24 HE2 LYS 24 -4.403 -12.529 1.576 184 2HE LYS 24 HE3 LYS 24 -3.928 -12.494 -0.122 185 1HZ LYS 24 HZ1 LYS 24 -2.440 -10.587 0.484 186 2HZ LYS 24 HZ2 LYS 24 -2.853 -10.789 2.053 187 3HZ LYS 24 HZ3 LYS 24 -2.059 -11.974 1.269 188 H GLY 25 H GLY 25 -4.708 -9.708 -4.441 189 1HA GLY 25 HA2 GLY 25 -4.958 -11.664 -5.665 190 2HA GLY 25 HA3 GLY 25 -6.636 -11.821 -5.139 191 H GLN 26 H GLN 26 -6.680 -8.675 -6.103 192 HA GLN 26 HA GLN 26 -7.736 -9.145 -8.752 193 1HB GLN 26 HB2 GLN 26 -8.261 -7.170 -7.204 194 2HB GLN 26 HB3 GLN 26 -6.628 -6.578 -7.535 195 1HG GLN 26 HG2 GLN 26 -7.458 -6.770 -10.087 196 2HG GLN 26 HG3 GLN 26 -9.045 -6.713 -9.342 197 1HE2 GLN 26 HE22 GLN 26 -6.145 -4.936 -10.170 198 2HE2 GLN 26 HE21 GLN 26 -6.697 -3.360 -9.616 199 H GLU 27 H GLU 27 -6.628 -8.846 -10.746 200 HA GLU 27 HA GLU 27 -3.748 -9.133 -10.839 201 1HB GLU 27 HB2 GLU 27 -5.440 -9.950 -12.543 202 2HB GLU 27 HB3 GLU 27 -5.681 -8.268 -13.028 203 1HG GLU 27 HG2 GLU 27 -3.260 -8.143 -13.651 204 2HG GLU 27 HG3 GLU 27 -3.049 -9.813 -13.129 205 H VAL 28 H VAL 28 -2.205 -7.584 -11.286 206 HA VAL 28 HA VAL 28 -2.968 -4.702 -11.257 207 HB VAL 28 HB VAL 28 -1.183 -6.243 -9.333 208 1HG1 VAL 28 HG11 VAL 28 0.115 -4.254 -9.990 209 2HG1 VAL 28 HG12 VAL 28 -1.266 -3.218 -9.624 210 3HG1 VAL 28 HG13 VAL 28 -0.464 -4.133 -8.329 211 1HG2 VAL 28 HG21 VAL 28 -3.532 -6.039 -8.643 212 2HG2 VAL 28 HG22 VAL 28 -2.528 -4.997 -7.632 213 3HG2 VAL 28 HG23 VAL 28 -3.503 -4.294 -8.939 214 H ALA 29 H ALA 29 -0.595 -7.272 -12.152 215 HA ALA 29 HA ALA 29 0.244 -5.629 -14.383 216 1HB ALA 29 HB1 ALA 29 2.265 -6.381 -12.201 217 2HB ALA 29 HB2 ALA 29 2.680 -5.746 -13.800 218 3HB ALA 29 HB3 ALA 29 1.782 -4.740 -12.662 219 H ILE 30 H ILE 30 2.135 -6.964 -15.485 220 HA ILE 30 HA ILE 30 1.772 -9.885 -15.142 221 HB ILE 30 HB ILE 30 1.496 -8.331 -17.747 222 1HG1 ILE 30 HG12 ILE 30 -0.337 -10.424 -16.479 223 2HG1 ILE 30 HG13 ILE 30 -0.576 -8.690 -16.344 224 1HG2 ILE 30 HG21 ILE 30 1.467 -10.518 -18.931 225 2HG2 ILE 30 HG22 ILE 30 3.005 -10.291 -18.139 226 3HG2 ILE 30 HG23 ILE 30 1.793 -11.357 -17.401 227 1HD1 ILE 30 HD11 ILE 30 -2.051 -9.500 -18.030 228 2HD1 ILE 30 HD12 ILE 30 -0.810 -8.502 -18.806 229 3HD1 ILE 30 HD13 ILE 30 -0.738 -10.281 -18.919 230 H LEU 31 H LEU 31 3.656 -10.975 -15.537 231 HA LEU 31 HA LEU 31 6.169 -9.390 -15.849 232 1HB LEU 31 HB2 LEU 31 5.783 -10.033 -13.575 233 2HB LEU 31 HB3 LEU 31 5.353 -11.687 -14.011 234 HG LEU 31 HG LEU 31 7.507 -11.353 -12.849 235 1HD1 LEU 31 HD11 LEU 31 7.936 -12.611 -15.569 236 2HD1 LEU 31 HD12 LEU 31 8.789 -12.949 -14.058 237 3HD1 LEU 31 HD13 LEU 31 7.077 -13.369 -14.226 238 1HD2 LEU 31 HD21 LEU 31 8.082 -9.223 -14.097 239 2HD2 LEU 31 HD22 LEU 31 9.397 -10.380 -13.827 240 3HD2 LEU 31 HD23 LEU 31 8.626 -10.260 -15.430 241 H GLU 32 H GLU 32 7.444 -10.113 -17.491 242 HA GLU 32 HA GLU 32 6.798 -12.665 -18.876 243 1HB GLU 32 HB2 GLU 32 6.775 -10.622 -20.267 244 2HB GLU 32 HB3 GLU 32 8.417 -10.226 -19.740 245 1HG GLU 32 HG2 GLU 32 9.197 -12.409 -20.755 246 2HG GLU 32 HG3 GLU 32 7.560 -12.673 -21.349 247 H SER 33 H SER 33 8.175 -14.326 -18.446 248 HA SER 33 HA SER 33 10.983 -14.073 -18.213 249 1HB SER 33 HB2 SER 33 10.248 -13.256 -15.881 250 2HB SER 33 HB3 SER 33 9.643 -14.893 -15.594 251 HG SER 33 HG SER 33 11.888 -14.201 -14.971 252 H MET 34 H MET 34 11.872 -16.359 -17.659 253 HA MET 34 HA MET 34 11.961 -18.561 -18.235 254 1HB MET 34 HB2 MET 34 9.180 -18.591 -16.999 255 2HB MET 34 HB3 MET 34 10.249 -19.979 -17.174 256 1HG MET 34 HG2 MET 34 11.832 -19.105 -15.616 257 2HG MET 34 HG3 MET 34 11.052 -17.528 -15.559 258 1HE MET 34 HE1 MET 34 8.042 -17.840 -15.127 259 2HE MET 34 HE2 MET 34 7.951 -17.948 -13.359 260 3HE MET 34 HE3 MET 34 9.097 -16.826 -14.118 261 H LYS 35 H LYS 35 11.061 -16.831 -20.362 262 HA LYS 35 HA LYS 35 10.043 -16.712 -22.359 263 1HB LYS 35 HB2 LYS 35 10.341 -19.740 -22.363 264 2HB LYS 35 HB3 LYS 35 10.054 -18.715 -23.772 265 1HG LYS 35 HG2 LYS 35 12.205 -17.534 -23.363 266 2HG LYS 35 HG3 LYS 35 12.529 -18.621 -21.997 267 1HD LYS 35 HD2 LYS 35 12.450 -20.573 -23.523 268 2HD LYS 35 HD3 LYS 35 12.139 -19.486 -24.895 269 1HE LYS 35 HE2 LYS 35 14.297 -18.328 -24.462 270 2HE LYS 35 HE3 LYS 35 14.607 -19.411 -23.098 271 1HZ LYS 35 HZ1 LYS 35 14.360 -20.263 -25.927 272 2HZ LYS 35 HZ2 LYS 35 15.751 -20.144 -25.090 273 3HZ LYS 35 HZ3 LYS 35 14.649 -21.264 -24.666 274 H MET 36 H MET 36 8.251 -16.674 -20.127 275 HA MET 36 HA MET 36 5.719 -17.369 -21.470 276 1HB MET 36 HB2 MET 36 6.525 -18.141 -18.620 277 2HB MET 36 HB3 MET 36 4.865 -18.158 -19.217 278 1HG MET 36 HG2 MET 36 5.486 -19.814 -20.943 279 2HG MET 36 HG3 MET 36 7.133 -19.850 -20.308 280 1HE MET 36 HE1 MET 36 5.808 -23.355 -19.265 281 2HE MET 36 HE2 MET 36 5.451 -22.461 -20.760 282 3HE MET 36 HE3 MET 36 7.096 -22.443 -20.084 283 H GLU 37 H GLU 37 3.910 -16.304 -20.039 284 HA GLU 37 HA GLU 37 4.854 -13.803 -18.761 285 1HB GLU 37 HB2 GLU 37 2.332 -14.069 -20.449 286 2HB GLU 37 HB3 GLU 37 2.826 -12.681 -19.491 287 1HG GLU 37 HG2 GLU 37 3.437 -12.032 -21.619 288 2HG GLU 37 HG3 GLU 37 4.957 -12.590 -20.935 289 H ILE 38 H ILE 38 3.865 -13.430 -16.800 290 HA ILE 38 HA ILE 38 2.020 -15.502 -15.745 291 HB ILE 38 HB ILE 38 4.530 -14.417 -14.361 292 1HG1 ILE 38 HG12 ILE 38 5.100 -17.047 -14.557 293 2HG1 ILE 38 HG13 ILE 38 4.132 -16.927 -16.012 294 1HG2 ILE 38 HG21 ILE 38 2.749 -15.064 -12.797 295 2HG2 ILE 38 HG22 ILE 38 2.568 -16.639 -13.611 296 3HG2 ILE 38 HG23 ILE 38 4.047 -16.250 -12.727 297 1HD1 ILE 38 HD11 ILE 38 6.500 -16.671 -16.526 298 2HD1 ILE 38 HD12 ILE 38 5.744 -15.100 -16.801 299 3HD1 ILE 38 HD13 ILE 38 6.677 -15.385 -15.322 300 HA PRO 39 HA PRO 39 0.103 -11.628 -14.484 301 1HB PRO 39 HB2 PRO 39 -1.775 -12.530 -12.687 302 2HB PRO 39 HB3 PRO 39 -1.934 -12.711 -14.463 303 1HG PRO 39 HG2 PRO 39 -0.925 -14.754 -12.464 304 2HG PRO 39 HG3 PRO 39 -2.118 -14.988 -13.782 305 1HD PRO 39 HD2 PRO 39 0.499 -15.669 -14.070 306 2HD PRO 39 HD3 PRO 39 -0.427 -14.978 -15.433 307 H ILE 40 H ILE 40 0.145 -10.197 -12.749 308 HA ILE 40 HA ILE 40 1.381 -11.056 -10.180 309 HB ILE 40 HB ILE 40 1.807 -8.500 -11.762 310 1HG1 ILE 40 HG12 ILE 40 3.164 -10.334 -12.679 311 2HG1 ILE 40 HG13 ILE 40 4.100 -9.011 -12.017 312 1HG2 ILE 40 HG21 ILE 40 3.415 -7.904 -9.935 313 2HG2 ILE 40 HG22 ILE 40 1.722 -7.883 -9.450 314 3HG2 ILE 40 HG23 ILE 40 2.761 -9.242 -8.975 315 1HD1 ILE 40 HD11 ILE 40 5.109 -11.154 -11.438 316 2HD1 ILE 40 HD12 ILE 40 4.587 -10.327 -9.974 317 3HD1 ILE 40 HD13 ILE 40 3.627 -11.682 -10.621 318 H VAL 41 H VAL 41 0.223 -10.334 -8.439 319 HA VAL 41 HA VAL 41 -2.324 -8.913 -9.005 320 HB VAL 41 HB VAL 41 -3.259 -10.458 -7.207 321 1HG1 VAL 41 HG11 VAL 41 -2.345 -11.729 -9.819 322 2HG1 VAL 41 HG12 VAL 41 -3.584 -12.382 -8.722 323 3HG1 VAL 41 HG13 VAL 41 -3.857 -10.839 -9.513 324 1HG2 VAL 41 HG21 VAL 41 -2.182 -12.559 -6.737 325 2HG2 VAL 41 HG22 VAL 41 -0.826 -12.185 -7.812 326 3HG2 VAL 41 HG23 VAL 41 -1.058 -11.263 -6.302 327 H ALA 42 H ALA 42 -3.338 -7.984 -7.124 328 HA ALA 42 HA ALA 42 -1.668 -6.354 -5.457 329 1HB ALA 42 HB1 ALA 42 -3.837 -5.892 -4.316 330 2HB ALA 42 HB2 ALA 42 -4.028 -5.801 -6.079 331 3HB ALA 42 HB3 ALA 42 -4.575 -7.234 -5.208 332 H ASP 43 H ASP 43 -0.332 -7.319 -3.948 333 HA ASP 43 HA ASP 43 -0.950 -9.821 -2.658 334 1HB ASP 43 HB2 ASP 43 1.350 -8.961 -3.031 335 2HB ASP 43 HB3 ASP 43 1.047 -7.671 -1.867 336 H ARG 44 H ARG 44 -2.022 -6.578 -2.084 337 HA ARG 44 HA ARG 44 -3.775 -7.471 0.011 338 1HB ARG 44 HB2 ARG 44 -3.160 -5.699 1.636 339 2HB ARG 44 HB3 ARG 44 -1.935 -6.946 1.447 340 1HG ARG 44 HG2 ARG 44 -0.733 -5.311 -0.183 341 2HG ARG 44 HG3 ARG 44 -1.886 -4.098 0.350 342 1HD ARG 44 HD2 ARG 44 0.348 -3.998 1.494 343 2HD ARG 44 HD3 ARG 44 -1.030 -4.137 2.590 344 HE ARG 44 HE ARG 44 -0.186 -6.065 3.399 345 1HH1 ARG 44 HH21 ARG 44 1.631 -5.603 0.322 346 2HH1 ARG 44 HH22 ARG 44 1.967 -7.323 0.219 347 1HH2 ARG 44 HH11 ARG 44 0.563 -8.280 3.216 348 2HH2 ARG 44 HH12 ARG 44 1.446 -8.731 1.774 349 H SER 45 H SER 45 -5.516 -5.898 0.317 350 HA SER 45 HA SER 45 -6.155 -4.332 -1.995 351 1HB SER 45 HB2 SER 45 -7.411 -4.218 0.779 352 2HB SER 45 HB3 SER 45 -8.186 -3.869 -0.770 353 HG SER 45 HG SER 45 -8.622 -5.992 0.185 354 H GLY 46 H GLY 46 -6.530 -1.980 -2.033 355 1HA GLY 46 HA2 GLY 46 -6.367 -0.194 -0.003 356 2HA GLY 46 HA3 GLY 46 -4.662 -0.391 -0.418 357 H ILE 47 H ILE 47 -5.412 2.058 -0.702 358 HA ILE 47 HA ILE 47 -6.151 2.589 -3.522 359 HB ILE 47 HB ILE 47 -5.534 4.370 -1.136 360 1HG1 ILE 47 HG12 ILE 47 -7.808 3.370 -1.175 361 2HG1 ILE 47 HG13 ILE 47 -7.801 5.122 -1.258 362 1HG2 ILE 47 HG21 ILE 47 -5.983 5.223 -4.021 363 2HG2 ILE 47 HG22 ILE 47 -6.124 6.316 -2.624 364 3HG2 ILE 47 HG23 ILE 47 -4.578 5.553 -2.987 365 1HD1 ILE 47 HD11 ILE 47 -8.248 3.272 -3.642 366 2HD1 ILE 47 HD12 ILE 47 -9.497 4.158 -2.748 367 3HD1 ILE 47 HD13 ILE 47 -8.294 5.050 -3.683 368 H VAL 48 H VAL 48 -4.607 3.018 -5.010 369 HA VAL 48 HA VAL 48 -1.828 2.357 -4.532 370 HB VAL 48 HB VAL 48 -3.253 3.624 -6.891 371 1HG1 VAL 48 HG11 VAL 48 -0.479 2.348 -6.687 372 2HG1 VAL 48 HG12 VAL 48 -1.286 2.804 -8.200 373 3HG1 VAL 48 HG13 VAL 48 -0.830 4.045 -7.031 374 1HG2 VAL 48 HG21 VAL 48 -4.172 1.404 -6.434 375 2HG2 VAL 48 HG22 VAL 48 -3.149 1.335 -7.861 376 3HG2 VAL 48 HG23 VAL 48 -2.544 0.716 -6.309 377 H LYS 49 H LYS 49 -0.437 3.737 -3.526 378 HA LYS 49 HA LYS 49 -1.033 6.639 -3.405 379 1HB LYS 49 HB2 LYS 49 -0.378 5.581 -1.350 380 2HB LYS 49 HB3 LYS 49 1.060 4.864 -2.092 381 1HG LYS 49 HG2 LYS 49 2.047 7.109 -2.373 382 2HG LYS 49 HG3 LYS 49 0.595 7.843 -1.645 383 1HD LYS 49 HD2 LYS 49 0.993 6.638 0.451 384 2HD LYS 49 HD3 LYS 49 2.324 5.733 -0.284 385 1HE LYS 49 HE2 LYS 49 3.496 7.969 -0.668 386 2HE LYS 49 HE3 LYS 49 2.245 8.708 0.349 387 1HZ LYS 49 HZ1 LYS 49 4.110 6.544 1.145 388 2HZ LYS 49 HZ2 LYS 49 4.177 8.109 1.662 389 3HZ LYS 49 HZ3 LYS 49 2.921 7.139 2.111 390 H GLU 50 H GLU 50 1.554 4.347 -4.582 391 HA GLU 50 HA GLU 50 2.048 6.158 -6.827 392 1HB GLU 50 HB2 GLU 50 3.386 7.176 -4.975 393 2HB GLU 50 HB3 GLU 50 4.251 5.651 -4.764 394 1HG GLU 50 HG2 GLU 50 5.218 5.828 -6.983 395 2HG GLU 50 HG3 GLU 50 4.168 7.189 -7.397 396 H VAL 51 H VAL 51 2.592 4.912 -8.568 397 HA VAL 51 HA VAL 51 3.238 2.062 -8.187 398 HB VAL 51 HB VAL 51 2.978 3.626 -10.791 399 1HG1 VAL 51 HG11 VAL 51 2.426 1.409 -11.739 400 2HG1 VAL 51 HG12 VAL 51 4.028 1.381 -10.996 401 3HG1 VAL 51 HG13 VAL 51 2.644 0.651 -10.149 402 1HG2 VAL 51 HG21 VAL 51 0.787 2.154 -9.258 403 2HG2 VAL 51 HG22 VAL 51 0.836 3.899 -9.600 404 3HG2 VAL 51 HG23 VAL 51 0.650 2.759 -10.925 405 H LYS 52 H LYS 52 5.313 1.235 -8.561 406 HA LYS 52 HA LYS 52 7.470 3.303 -8.583 407 1HB LYS 52 HB2 LYS 52 7.401 0.499 -7.401 408 2HB LYS 52 HB3 LYS 52 8.735 1.634 -7.254 409 1HG LYS 52 HG2 LYS 52 5.959 2.088 -6.087 410 2HG LYS 52 HG3 LYS 52 7.339 1.424 -5.222 411 1HD LYS 52 HD2 LYS 52 8.581 3.545 -5.578 412 2HD LYS 52 HD3 LYS 52 7.137 4.234 -6.380 413 1HE LYS 52 HE2 LYS 52 5.796 3.882 -4.383 414 2HE LYS 52 HE3 LYS 52 7.123 3.026 -3.585 415 1HZ LYS 52 HZ1 LYS 52 7.135 5.900 -4.302 416 2HZ LYS 52 HZ2 LYS 52 6.909 5.248 -2.800 417 3HZ LYS 52 HZ3 LYS 52 8.365 5.095 -3.550 418 H LYS 53 H LYS 53 6.153 1.378 -10.865 419 HA LYS 53 HA LYS 53 8.700 0.930 -12.266 420 1HB LYS 53 HB2 LYS 53 6.613 -1.249 -11.788 421 2HB LYS 53 HB3 LYS 53 7.972 -1.381 -12.902 422 1HG LYS 53 HG2 LYS 53 8.271 -1.090 -9.896 423 2HG LYS 53 HG3 LYS 53 8.302 -2.612 -10.777 424 1HD LYS 53 HD2 LYS 53 10.246 -1.910 -12.082 425 2HD LYS 53 HD3 LYS 53 10.262 -0.323 -11.312 426 1HE LYS 53 HE2 LYS 53 10.618 -2.967 -9.835 427 2HE LYS 53 HE3 LYS 53 11.938 -1.946 -10.401 428 1HZ LYS 53 HZ1 LYS 53 11.070 -0.182 -8.938 429 2HZ LYS 53 HZ2 LYS 53 9.917 -1.234 -8.370 430 3HZ LYS 53 HZ3 LYS 53 11.491 -1.572 -8.129 431 H LYS 54 H LYS 54 7.907 -0.100 -14.573 432 HA LYS 54 HA LYS 54 5.407 1.099 -15.483 433 1HB LYS 54 HB2 LYS 54 6.447 2.387 -17.277 434 2HB LYS 54 HB3 LYS 54 6.962 2.991 -15.704 435 1HG LYS 54 HG2 LYS 54 9.133 1.793 -15.949 436 2HG LYS 54 HG3 LYS 54 8.612 1.174 -17.528 437 1HD LYS 54 HD2 LYS 54 8.418 3.495 -18.376 438 2HD LYS 54 HD3 LYS 54 8.952 4.114 -16.796 439 1HE LYS 54 HE2 LYS 54 11.092 2.868 -17.038 440 2HE LYS 54 HE3 LYS 54 10.560 2.252 -18.607 441 1HZ LYS 54 HZ1 LYS 54 12.003 4.167 -18.852 442 2HZ LYS 54 HZ2 LYS 54 10.523 4.540 -19.418 443 3HZ LYS 54 HZ3 LYS 54 11.014 5.110 -17.966 444 H GLU 55 H GLU 55 4.980 0.436 -17.738 445 HA GLU 55 HA GLU 55 5.260 -2.318 -18.083 446 1HB GLU 55 HB2 GLU 55 4.772 -0.279 -20.302 447 2HB GLU 55 HB3 GLU 55 4.370 -1.992 -20.308 448 1HG GLU 55 HG2 GLU 55 2.315 -1.212 -19.769 449 2HG GLU 55 HG3 GLU 55 2.948 -1.325 -18.134 450 H GLY 56 H GLY 56 6.806 -3.596 -18.862 451 1HA GLY 56 HA2 GLY 56 8.499 -4.380 -20.182 452 2HA GLY 56 HA3 GLY 56 8.690 -2.787 -20.923 453 H ASP 57 H ASP 57 8.830 -2.228 -17.575 454 HA ASP 57 HA ASP 57 11.686 -1.800 -17.697 455 1HB ASP 57 HB2 ASP 57 10.063 -0.417 -16.377 456 2HB ASP 57 HB3 ASP 57 9.879 -1.770 -15.255 457 H PHE 58 H PHE 58 13.254 -2.772 -16.219 458 HA PHE 58 HA PHE 58 13.067 -5.693 -16.030 459 1HB PHE 58 HB2 PHE 58 15.206 -4.570 -16.509 460 2HB PHE 58 HB3 PHE 58 15.084 -3.656 -15.013 461 HD1 PHE 58 HD1 PHE 58 15.663 -4.652 -12.859 462 HD2 PHE 58 HD2 PHE 58 15.716 -7.016 -16.470 463 HE1 PHE 58 HE1 PHE 58 16.952 -6.422 -11.689 464 HE2 PHE 58 HE2 PHE 58 16.993 -8.784 -15.292 465 HZ PHE 58 HZ PHE 58 17.640 -8.478 -12.912 466 H VAL 59 H VAL 59 12.763 -6.881 -14.098 467 HA VAL 59 HA VAL 59 12.376 -5.448 -11.568 468 HB VAL 59 HB VAL 59 10.265 -6.859 -11.206 469 1HG1 VAL 59 HG11 VAL 59 10.268 -4.420 -11.308 470 2HG1 VAL 59 HG12 VAL 59 10.053 -4.473 -13.075 471 3HG1 VAL 59 HG13 VAL 59 8.787 -5.096 -12.002 472 1HG2 VAL 59 HG21 VAL 59 10.087 -6.745 -14.244 473 2HG2 VAL 59 HG22 VAL 59 10.361 -8.213 -13.277 474 3HG2 VAL 59 HG23 VAL 59 8.838 -7.309 -13.122 475 H ASN 60 H ASN 60 12.187 -7.007 -9.736 476 HA ASN 60 HA ASN 60 13.493 -9.561 -10.271 477 1HB ASN 60 HB2 ASN 60 15.093 -7.342 -9.808 478 2HB ASN 60 HB3 ASN 60 14.892 -7.996 -8.182 479 1HD2 ASN 60 HD22 ASN 60 15.554 -9.008 -11.583 480 2HD2 ASN 60 HD21 ASN 60 16.698 -10.268 -11.165 481 H GLU 61 H GLU 61 13.938 -10.754 -8.211 482 HA GLU 61 HA GLU 61 11.501 -11.088 -6.771 483 1HB GLU 61 HB2 GLU 61 13.050 -12.904 -7.216 484 2HB GLU 61 HB3 GLU 61 14.349 -12.090 -6.354 485 1HG GLU 61 HG2 GLU 61 12.982 -12.276 -4.233 486 2HG GLU 61 HG3 GLU 61 11.739 -13.128 -5.146 487 H GLY 62 H GLY 62 10.708 -9.653 -5.347 488 1HA GLY 62 HA2 GLY 62 10.642 -8.669 -3.251 489 2HA GLY 62 HA3 GLY 62 12.409 -8.596 -3.182 490 H ASP 63 H ASP 63 11.489 -7.494 -6.292 491 HA ASP 63 HA ASP 63 12.228 -4.784 -5.550 492 1HB ASP 63 HB2 ASP 63 12.919 -6.070 -7.651 493 2HB ASP 63 HB3 ASP 63 11.281 -5.809 -8.250 494 H VAL 64 H VAL 64 10.804 -3.113 -5.160 495 HA VAL 64 HA VAL 64 8.072 -3.757 -4.670 496 HB VAL 64 HB VAL 64 9.401 -1.016 -4.773 497 1HG1 VAL 64 HG11 VAL 64 6.841 -1.983 -3.418 498 2HG1 VAL 64 HG12 VAL 64 7.569 -0.375 -3.200 499 3HG1 VAL 64 HG13 VAL 64 6.939 -0.853 -4.778 500 1HG2 VAL 64 HG21 VAL 64 10.583 -2.463 -3.162 501 2HG2 VAL 64 HG22 VAL 64 9.597 -1.284 -2.297 502 3HG2 VAL 64 HG23 VAL 64 9.036 -2.964 -2.447 503 H LEU 65 H LEU 65 6.296 -3.553 -5.896 504 HA LEU 65 HA LEU 65 6.538 -2.592 -8.693 505 1HB LEU 65 HB2 LEU 65 5.537 -4.794 -8.390 506 2HB LEU 65 HB3 LEU 65 4.409 -4.175 -7.186 507 HG LEU 65 HG LEU 65 3.284 -2.786 -8.903 508 1HD1 LEU 65 HD11 LEU 65 5.065 -2.302 -10.452 509 2HD1 LEU 65 HD12 LEU 65 5.271 -4.026 -10.830 510 3HD1 LEU 65 HD13 LEU 65 3.786 -3.161 -11.303 511 1HD2 LEU 65 HD21 LEU 65 2.465 -5.056 -8.471 512 2HD2 LEU 65 HD22 LEU 65 2.285 -4.643 -10.187 513 3HD2 LEU 65 HD23 LEU 65 3.601 -5.704 -9.672 514 H LEU 66 H LEU 66 4.645 -2.085 -5.615 515 HA LEU 66 HA LEU 66 4.391 0.703 -6.332 516 1HB LEU 66 HB2 LEU 66 2.049 0.940 -6.369 517 2HB LEU 66 HB3 LEU 66 2.514 -0.136 -7.663 518 HG LEU 66 HG LEU 66 1.490 -1.271 -5.026 519 1HD1 LEU 66 HD11 LEU 66 -0.139 0.385 -5.659 520 2HD1 LEU 66 HD12 LEU 66 -0.140 -0.160 -7.347 521 3HD1 LEU 66 HD13 LEU 66 -0.779 -1.211 -6.070 522 1HD2 LEU 66 HD21 LEU 66 0.658 -3.074 -6.484 523 2HD2 LEU 66 HD22 LEU 66 1.249 -2.221 -7.924 524 3HD2 LEU 66 HD23 LEU 66 2.394 -2.868 -6.727 525 H GLU 67 H GLU 67 3.204 1.949 -4.726 526 HA GLU 67 HA GLU 67 3.393 0.853 -1.967 527 1HB GLU 67 HB2 GLU 67 5.192 2.490 -2.586 528 2HB GLU 67 HB3 GLU 67 3.939 3.684 -2.974 529 1HG GLU 67 HG2 GLU 67 3.156 3.495 -0.580 530 2HG GLU 67 HG3 GLU 67 4.533 2.429 -0.267 531 H LEU 68 H LEU 68 1.665 1.467 -0.621 532 HA LEU 68 HA LEU 68 -0.789 2.461 -2.025 533 1HB LEU 68 HB2 LEU 68 -0.549 0.413 0.216 534 2HB LEU 68 HB3 LEU 68 -2.036 0.932 -0.569 535 HG LEU 68 HG LEU 68 0.202 -0.677 -1.866 536 1HD1 LEU 68 HD11 LEU 68 -1.423 -2.511 -1.850 537 2HD1 LEU 68 HD12 LEU 68 -1.135 -1.920 -0.204 538 3HD1 LEU 68 HD13 LEU 68 -2.626 -1.473 -1.063 539 1HD2 LEU 68 HD21 LEU 68 -2.483 0.209 -3.013 540 2HD2 LEU 68 HD22 LEU 68 -0.862 0.733 -3.536 541 3HD2 LEU 68 HD23 LEU 68 -1.353 -0.941 -3.763 542 H SER 69 H SER 69 -2.319 3.561 -0.609 543 HA SER 69 HA SER 69 -1.228 5.329 1.315 544 1HB SER 69 HB2 SER 69 -4.043 4.226 1.005 545 2HB SER 69 HB3 SER 69 -3.598 5.686 1.928 546 HG SER 69 HG SER 69 -4.238 6.296 -0.134 547 H ASN 70 H ASN 70 -2.556 2.029 1.656 548 HA ASN 70 HA ASN 70 -2.443 1.756 4.470 549 1HB ASN 70 HB2 ASN 70 -3.550 0.133 3.001 550 2HB ASN 70 HB3 ASN 70 -2.010 -0.278 2.237 551 1HD2 ASN 70 HD22 ASN 70 -3.735 -0.367 5.417 552 2HD2 ASN 70 HD21 ASN 70 -2.843 -1.734 6.022 553 H SER 71 H SER 71 0.237 1.855 2.129 554 HA SER 71 HA SER 71 2.155 0.501 3.850 555 1HB SER 71 HB2 SER 71 2.670 2.359 1.501 556 2HB SER 71 HB3 SER 71 3.769 1.163 2.183 557 HG SER 71 HG SER 71 1.410 -0.007 1.517 558 H THR 72 H THR 72 0.752 3.702 3.764 559 HA THR 72 HA THR 72 3.052 4.999 5.072 560 HB THR 72 HB THR 72 0.223 6.036 4.589 561 HG1 THR 72 HG1 THR 72 1.231 5.468 2.647 562 1HG2 THR 72 HG21 THR 72 2.871 7.474 5.086 563 2HG2 THR 72 HG22 THR 72 1.321 8.253 4.691 564 3HG2 THR 72 HG23 THR 72 1.502 7.377 6.218 565 H GLN 73 H GLN 73 3.187 5.235 7.307 566 HA GLN 73 HA GLN 73 0.963 4.481 9.070 567 1HB GLN 73 HB2 GLN 73 3.706 3.133 9.075 568 2HB GLN 73 HB3 GLN 73 2.554 3.033 10.398 569 1HG GLN 73 HG2 GLN 73 1.989 1.976 7.591 570 2HG GLN 73 HG3 GLN 73 2.652 1.022 8.902 571 1HE2 GLN 73 HE22 GLN 73 -0.253 2.728 7.790 572 2HE2 GLN 73 HE21 GLN 73 -1.369 1.941 8.900 Start of MODEL 16 1 1H THR 2 H1 THR 2 2.196 -1.925 0.611 2 2H THR 2 H2 THR 2 3.331 -2.806 1.402 3 3H THR 2 H3 THR 2 3.480 -1.174 1.334 4 HA THR 2 HA THR 2 3.724 -1.287 -1.074 5 HB THR 2 HB THR 2 5.793 -2.853 0.522 6 HG1 THR 2 HG1 THR 2 6.542 -0.862 1.123 7 1HG2 THR 2 HG21 THR 2 7.417 -1.683 -0.961 8 2HG2 THR 2 HG22 THR 2 6.365 -2.766 -1.876 9 3HG2 THR 2 HG23 THR 2 6.065 -1.008 -1.896 10 H VAL 3 H VAL 3 3.978 -2.627 -2.988 11 HA VAL 3 HA VAL 3 3.466 -5.536 -2.630 12 HB VAL 3 HB VAL 3 2.155 -3.779 -4.728 13 1HG1 VAL 3 HG11 VAL 3 1.696 -6.699 -3.987 14 2HG1 VAL 3 HG12 VAL 3 0.798 -5.783 -5.227 15 3HG1 VAL 3 HG13 VAL 3 2.510 -6.114 -5.455 16 1HG2 VAL 3 HG21 VAL 3 -0.022 -4.243 -3.613 17 2HG2 VAL 3 HG22 VAL 3 0.861 -4.953 -2.238 18 3HG2 VAL 3 HG23 VAL 3 1.041 -3.231 -2.641 19 H SER 4 H SER 4 4.727 -6.761 -4.040 20 HA SER 4 HA SER 4 6.680 -5.352 -5.789 21 1HB SER 4 HB2 SER 4 7.269 -7.390 -3.602 22 2HB SER 4 HB3 SER 4 8.460 -6.609 -4.644 23 HG SER 4 HG SER 4 8.250 -5.637 -2.543 24 H ILE 5 H ILE 5 7.815 -6.750 -7.227 25 HA ILE 5 HA ILE 5 6.185 -8.888 -8.369 26 HB ILE 5 HB ILE 5 8.998 -7.903 -9.071 27 1HG1 ILE 5 HG12 ILE 5 7.594 -7.019 -11.151 28 2HG1 ILE 5 HG13 ILE 5 6.245 -7.032 -10.032 29 1HG2 ILE 5 HG21 ILE 5 8.545 -10.179 -9.930 30 2HG2 ILE 5 HG22 ILE 5 7.040 -9.601 -10.688 31 3HG2 ILE 5 HG23 ILE 5 8.627 -9.021 -11.236 32 1HD1 ILE 5 HD11 ILE 5 8.873 -5.520 -9.623 33 2HD1 ILE 5 HD12 ILE 5 7.382 -4.823 -10.292 34 3HD1 ILE 5 HD13 ILE 5 7.421 -5.377 -8.618 35 H GLN 6 H GLN 6 6.819 -11.153 -8.334 36 HA GLN 6 HA GLN 6 8.400 -11.805 -5.896 37 1HB GLN 6 HB2 GLN 6 6.366 -13.609 -7.219 38 2HB GLN 6 HB3 GLN 6 7.059 -13.707 -5.612 39 1HG GLN 6 HG2 GLN 6 5.041 -12.849 -5.031 40 2HG GLN 6 HG3 GLN 6 5.894 -11.331 -5.273 41 1HE2 GLN 6 HE22 GLN 6 4.634 -9.853 -6.483 42 2HE2 GLN 6 HE21 GLN 6 3.477 -10.352 -7.704 43 H MET 7 H MET 7 9.189 -11.722 -9.089 44 HA MET 7 HA MET 7 11.160 -13.817 -8.786 45 1HB MET 7 HB2 MET 7 10.561 -15.174 -10.656 46 2HB MET 7 HB3 MET 7 9.153 -15.078 -9.615 47 1HG MET 7 HG2 MET 7 8.794 -12.956 -11.436 48 2HG MET 7 HG3 MET 7 9.545 -14.228 -12.387 49 1HE MET 7 HE1 MET 7 6.508 -12.718 -10.915 50 2HE MET 7 HE2 MET 7 5.289 -13.990 -10.729 51 3HE MET 7 HE3 MET 7 6.643 -13.881 -9.580 52 H ALA 8 H ALA 8 12.689 -13.760 -10.701 53 HA ALA 8 HA ALA 8 13.205 -11.018 -11.554 54 1HB ALA 8 HB1 ALA 8 15.023 -12.569 -10.946 55 2HB ALA 8 HB2 ALA 8 14.550 -13.639 -12.292 56 3HB ALA 8 HB3 ALA 8 15.161 -12.004 -12.629 57 H GLY 9 H GLY 9 12.844 -10.088 -13.542 58 1HA GLY 9 HA2 GLY 9 12.510 -11.446 -15.969 59 2HA GLY 9 HA3 GLY 9 10.897 -11.296 -15.278 60 H ASN 10 H ASN 10 10.236 -9.882 -16.956 61 HA ASN 10 HA ASN 10 11.146 -7.051 -16.627 62 1HB ASN 10 HB2 ASN 10 10.877 -8.646 -19.187 63 2HB ASN 10 HB3 ASN 10 10.398 -6.952 -19.168 64 1HD2 ASN 10 HD22 ASN 10 13.176 -8.034 -17.134 65 2HD2 ASN 10 HD21 ASN 10 14.373 -7.287 -18.169 66 H LEU 11 H LEU 11 9.444 -5.630 -16.574 67 HA LEU 11 HA LEU 11 6.986 -6.839 -15.695 68 1HB LEU 11 HB2 LEU 11 8.258 -4.975 -14.593 69 2HB LEU 11 HB3 LEU 11 7.732 -3.909 -15.890 70 HG LEU 11 HG LEU 11 5.343 -4.382 -15.244 71 1HD1 LEU 11 HD11 LEU 11 6.639 -5.967 -12.980 72 2HD1 LEU 11 HD12 LEU 11 4.959 -5.403 -12.961 73 3HD1 LEU 11 HD13 LEU 11 5.468 -6.570 -14.173 74 1HD2 LEU 11 HD21 LEU 11 6.616 -2.453 -14.373 75 2HD2 LEU 11 HD22 LEU 11 5.461 -3.035 -13.175 76 3HD2 LEU 11 HD23 LEU 11 7.176 -3.439 -12.996 77 H TRP 12 H TRP 12 6.357 -7.747 -17.740 78 HA TRP 12 HA TRP 12 6.022 -6.851 -20.181 79 1HB TRP 12 HB2 TRP 12 5.264 -9.051 -19.085 80 2HB TRP 12 HB3 TRP 12 3.719 -8.272 -18.810 81 HD1 TRP 12 HD1 TRP 12 6.085 -9.067 -21.696 82 HE1 TRP 12 HE1 TRP 12 4.784 -9.764 -23.780 83 HE3 TRP 12 HE3 TRP 12 1.351 -8.331 -19.932 84 HZ2 TRP 12 HZ2 TRP 12 2.001 -10.031 -24.561 85 HZ3 TRP 12 HZ3 TRP 12 -0.612 -8.883 -21.337 86 HH2 TRP 12 HH2 TRP 12 -0.301 -9.725 -23.656 87 H LYS 13 H LYS 13 3.354 -6.253 -17.800 88 HA LYS 13 HA LYS 13 2.726 -3.694 -19.078 89 1HB LYS 13 HB2 LYS 13 0.730 -6.000 -18.935 90 2HB LYS 13 HB3 LYS 13 0.265 -4.306 -19.144 91 1HG LYS 13 HG2 LYS 13 1.654 -4.221 -21.239 92 2HG LYS 13 HG3 LYS 13 1.930 -5.964 -21.073 93 1HD LYS 13 HD2 LYS 13 -0.567 -6.309 -21.113 94 2HD LYS 13 HD3 LYS 13 -0.754 -4.571 -21.432 95 1HE LYS 13 HE2 LYS 13 0.677 -4.821 -23.472 96 2HE LYS 13 HE3 LYS 13 0.798 -6.558 -23.157 97 1HZ LYS 13 HZ1 LYS 13 -0.915 -6.068 -24.782 98 2HZ LYS 13 HZ2 LYS 13 -1.612 -6.706 -23.454 99 3HZ LYS 13 HZ3 LYS 13 -1.715 -5.099 -23.748 100 H VAL 14 H VAL 14 1.197 -2.460 -17.704 101 HA VAL 14 HA VAL 14 0.937 -3.400 -14.897 102 HB VAL 14 HB VAL 14 2.161 -0.727 -15.736 103 1HG1 VAL 14 HG11 VAL 14 0.834 -0.419 -13.696 104 2HG1 VAL 14 HG12 VAL 14 1.575 -1.860 -12.956 105 3HG1 VAL 14 HG13 VAL 14 2.548 -0.411 -13.279 106 1HG2 VAL 14 HG21 VAL 14 3.826 -2.522 -15.927 107 2HG2 VAL 14 HG22 VAL 14 4.169 -1.543 -14.506 108 3HG2 VAL 14 HG23 VAL 14 3.375 -3.132 -14.319 109 H HIS 15 H HIS 15 -0.954 -2.618 -13.944 110 HA HIS 15 HA HIS 15 -2.807 -1.214 -15.827 111 1HB HIS 15 HB2 HIS 15 -3.660 -3.229 -13.764 112 2HB HIS 15 HB3 HIS 15 -4.480 -2.740 -15.243 113 HD1 HIS 15 HD1 HIS 15 -2.228 -3.437 -17.406 114 HD2 HIS 15 HD2 HIS 15 -3.107 -5.708 -13.978 115 HE1 HIS 15 HE1 HIS 15 -1.193 -5.747 -17.775 116 H VAL 16 H VAL 16 -1.499 -1.199 -12.573 117 HA VAL 16 HA VAL 16 -3.621 0.433 -11.431 118 HB VAL 16 HB VAL 16 -1.906 0.796 -9.613 119 1HG1 VAL 16 HG11 VAL 16 -3.646 -0.885 -9.415 120 2HG1 VAL 16 HG12 VAL 16 -2.692 -2.041 -10.359 121 3HG1 VAL 16 HG13 VAL 16 -2.136 -1.525 -8.747 122 1HG2 VAL 16 HG21 VAL 16 0.064 -0.500 -9.463 123 2HG2 VAL 16 HG22 VAL 16 -0.289 -1.401 -10.953 124 3HG2 VAL 16 HG23 VAL 16 0.140 0.326 -11.021 125 H LYS 17 H LYS 17 -3.257 2.581 -10.583 126 HA LYS 17 HA LYS 17 -1.145 4.227 -11.653 127 1HB LYS 17 HB2 LYS 17 -2.660 5.978 -12.518 128 2HB LYS 17 HB3 LYS 17 -2.767 4.500 -13.469 129 1HG LYS 17 HG2 LYS 17 -4.887 3.895 -12.335 130 2HG LYS 17 HG3 LYS 17 -4.779 5.355 -11.332 131 1HD LYS 17 HD2 LYS 17 -4.884 6.765 -13.368 132 2HD LYS 17 HD3 LYS 17 -4.998 5.300 -14.372 133 1HE LYS 17 HE2 LYS 17 -7.089 4.659 -13.187 134 2HE LYS 17 HE3 LYS 17 -6.975 6.116 -12.191 135 1HZ LYS 17 HZ1 LYS 17 -7.323 6.090 -15.135 136 2HZ LYS 17 HZ2 LYS 17 -8.485 6.427 -14.046 137 3HZ LYS 17 HZ3 LYS 17 -7.219 7.437 -14.213 138 H ALA 18 H ALA 18 -1.135 6.300 -10.353 139 HA ALA 18 HA ALA 18 -1.757 5.931 -7.607 140 1HB ALA 18 HB1 ALA 18 -1.364 8.521 -9.171 141 2HB ALA 18 HB2 ALA 18 -1.324 8.354 -7.406 142 3HB ALA 18 HB3 ALA 18 -0.083 7.560 -8.393 143 H GLY 19 H GLY 19 -3.600 6.218 -6.448 144 1HA GLY 19 HA2 GLY 19 -5.669 7.082 -5.878 145 2HA GLY 19 HA3 GLY 19 -5.863 7.788 -7.488 146 H ASP 20 H ASP 20 -4.895 4.684 -8.218 147 HA ASP 20 HA ASP 20 -7.581 3.694 -8.696 148 1HB ASP 20 HB2 ASP 20 -5.520 3.141 -10.092 149 2HB ASP 20 HB3 ASP 20 -4.963 2.150 -8.744 150 H GLN 21 H GLN 21 -8.196 1.468 -7.816 151 HA GLN 21 HA GLN 21 -7.380 1.115 -4.967 152 1HB GLN 21 HB2 GLN 21 -9.656 2.089 -5.099 153 2HB GLN 21 HB3 GLN 21 -10.172 0.750 -6.138 154 1HG GLN 21 HG2 GLN 21 -9.717 -0.865 -4.335 155 2HG GLN 21 HG3 GLN 21 -9.093 0.416 -3.298 156 1HE2 GLN 21 HE21 GLN 21 -11.049 -1.242 -2.343 157 2HE2 GLN 21 HE22 GLN 21 -12.567 -0.389 -2.217 158 H ILE 22 H ILE 22 -7.070 -0.999 -4.346 159 HA ILE 22 HA ILE 22 -7.424 -3.116 -6.370 160 HB ILE 22 HB ILE 22 -5.233 -3.992 -6.050 161 1HG1 ILE 22 HG12 ILE 22 -4.902 -1.906 -3.860 162 2HG1 ILE 22 HG13 ILE 22 -4.883 -3.666 -3.705 163 1HG2 ILE 22 HG21 ILE 22 -3.835 -2.287 -7.047 164 2HG2 ILE 22 HG22 ILE 22 -5.470 -2.095 -7.673 165 3HG2 ILE 22 HG23 ILE 22 -4.861 -0.993 -6.420 166 1HD1 ILE 22 HD11 ILE 22 -2.801 -1.882 -4.956 167 2HD1 ILE 22 HD12 ILE 22 -2.638 -2.924 -3.528 168 3HD1 ILE 22 HD13 ILE 22 -2.772 -3.651 -5.142 169 H GLU 23 H GLU 23 -7.396 -5.269 -5.403 170 HA GLU 23 HA GLU 23 -8.126 -5.385 -2.552 171 1HB GLU 23 HB2 GLU 23 -10.201 -5.236 -3.846 172 2HB GLU 23 HB3 GLU 23 -9.680 -6.584 -4.876 173 1HG GLU 23 HG2 GLU 23 -9.706 -8.093 -2.910 174 2HG GLU 23 HG3 GLU 23 -10.134 -6.739 -1.861 175 H LYS 24 H LYS 24 -7.303 -7.358 -1.630 176 HA LYS 24 HA LYS 24 -5.031 -8.493 -2.716 177 1HB LYS 24 HB2 LYS 24 -5.786 -8.717 -0.378 178 2HB LYS 24 HB3 LYS 24 -7.051 -9.847 -0.871 179 1HG LYS 24 HG2 LYS 24 -5.432 -11.506 -1.555 180 2HG LYS 24 HG3 LYS 24 -4.100 -10.341 -1.429 181 1HD LYS 24 HD2 LYS 24 -4.433 -10.197 1.022 182 2HD LYS 24 HD3 LYS 24 -5.815 -11.288 0.913 183 1HE LYS 24 HE2 LYS 24 -3.828 -12.444 1.738 184 2HE LYS 24 HE3 LYS 24 -4.379 -13.140 0.212 185 1HZ LYS 24 HZ1 LYS 24 -2.219 -11.119 0.305 186 2HZ LYS 24 HZ2 LYS 24 -1.915 -12.731 0.465 187 3HZ LYS 24 HZ3 LYS 24 -2.577 -12.154 -0.907 188 H GLY 25 H GLY 25 -4.606 -9.734 -4.461 189 1HA GLY 25 HA2 GLY 25 -4.840 -11.640 -5.800 190 2HA GLY 25 HA3 GLY 25 -6.539 -11.789 -5.352 191 H GLN 26 H GLN 26 -6.406 -8.558 -6.076 192 HA GLN 26 HA GLN 26 -7.494 -8.791 -8.722 193 1HB GLN 26 HB2 GLN 26 -7.895 -6.944 -7.032 194 2HB GLN 26 HB3 GLN 26 -6.240 -6.370 -7.343 195 1HG GLN 26 HG2 GLN 26 -6.843 -5.932 -9.697 196 2HG GLN 26 HG3 GLN 26 -8.462 -6.583 -9.431 197 1HE2 GLN 26 HE22 GLN 26 -6.704 -3.694 -9.546 198 2HE2 GLN 26 HE21 GLN 26 -7.748 -2.689 -8.554 199 H GLU 27 H GLU 27 -6.396 -8.712 -10.702 200 HA GLU 27 HA GLU 27 -3.504 -8.963 -10.798 201 1HB GLU 27 HB2 GLU 27 -5.095 -10.008 -12.417 202 2HB GLU 27 HB3 GLU 27 -5.562 -8.399 -12.978 203 1HG GLU 27 HG2 GLU 27 -3.183 -8.014 -13.696 204 2HG GLU 27 HG3 GLU 27 -2.783 -9.648 -13.162 205 H VAL 28 H VAL 28 -2.029 -7.331 -10.993 206 HA VAL 28 HA VAL 28 -2.980 -4.548 -11.490 207 HB VAL 28 HB VAL 28 -1.339 -3.834 -9.715 208 1HG1 VAL 28 HG11 VAL 28 -3.803 -3.881 -9.315 209 2HG1 VAL 28 HG12 VAL 28 -3.666 -5.543 -8.719 210 3HG1 VAL 28 HG13 VAL 28 -2.864 -4.224 -7.849 211 1HG2 VAL 28 HG21 VAL 28 -1.520 -6.714 -8.794 212 2HG2 VAL 28 HG22 VAL 28 -0.056 -5.966 -9.476 213 3HG2 VAL 28 HG23 VAL 28 -0.735 -5.382 -7.940 214 H ALA 29 H ALA 29 -0.531 -7.022 -12.089 215 HA ALA 29 HA ALA 29 0.336 -5.451 -14.358 216 1HB ALA 29 HB1 ALA 29 2.357 -6.198 -12.177 217 2HB ALA 29 HB2 ALA 29 2.766 -5.594 -13.790 218 3HB ALA 29 HB3 ALA 29 1.896 -4.553 -12.660 219 H ILE 30 H ILE 30 2.190 -6.844 -15.447 220 HA ILE 30 HA ILE 30 1.808 -9.747 -15.032 221 HB ILE 30 HB ILE 30 1.519 -8.272 -17.682 222 1HG1 ILE 30 HG12 ILE 30 -0.374 -10.239 -16.308 223 2HG1 ILE 30 HG13 ILE 30 -0.553 -8.491 -16.264 224 1HG2 ILE 30 HG21 ILE 30 1.390 -10.522 -18.768 225 2HG2 ILE 30 HG22 ILE 30 2.958 -10.263 -18.053 226 3HG2 ILE 30 HG23 ILE 30 1.769 -11.282 -17.213 227 1HD1 ILE 30 HD11 ILE 30 -0.793 -8.430 -18.734 228 2HD1 ILE 30 HD12 ILE 30 -0.798 -10.214 -18.744 229 3HD1 ILE 30 HD13 ILE 30 -2.068 -9.328 -17.893 230 H LEU 31 H LEU 31 3.684 -10.862 -15.535 231 HA LEU 31 HA LEU 31 6.194 -9.279 -15.863 232 1HB LEU 31 HB2 LEU 31 5.820 -9.885 -13.584 233 2HB LEU 31 HB3 LEU 31 5.357 -11.540 -13.988 234 HG LEU 31 HG LEU 31 7.528 -11.188 -12.833 235 1HD1 LEU 31 HD11 LEU 31 7.809 -12.618 -15.495 236 2HD1 LEU 31 HD12 LEU 31 8.772 -12.853 -14.032 237 3HD1 LEU 31 HD13 LEU 31 7.049 -13.267 -14.038 238 1HD2 LEU 31 HD21 LEU 31 9.420 -10.320 -13.865 239 2HD2 LEU 31 HD22 LEU 31 8.670 -10.309 -15.480 240 3HD2 LEU 31 HD23 LEU 31 8.137 -9.155 -14.245 241 H GLU 32 H GLU 32 7.519 -10.080 -17.455 242 HA GLU 32 HA GLU 32 6.790 -12.628 -18.817 243 1HB GLU 32 HB2 GLU 32 6.845 -10.601 -20.225 244 2HB GLU 32 HB3 GLU 32 8.502 -10.264 -19.709 245 1HG GLU 32 HG2 GLU 32 9.188 -12.492 -20.698 246 2HG GLU 32 HG3 GLU 32 7.536 -12.696 -21.280 247 H SER 33 H SER 33 8.112 -14.331 -18.365 248 HA SER 33 HA SER 33 10.930 -14.139 -18.082 249 1HB SER 33 HB2 SER 33 10.149 -13.313 -15.769 250 2HB SER 33 HB3 SER 33 9.492 -14.933 -15.506 251 HG SER 33 HG SER 33 11.749 -14.275 -14.840 252 H MET 34 H MET 34 11.772 -16.427 -17.555 253 HA MET 34 HA MET 34 11.830 -18.637 -18.106 254 1HB MET 34 HB2 MET 34 9.062 -18.593 -16.839 255 2HB MET 34 HB3 MET 34 10.095 -20.009 -17.010 256 1HG MET 34 HG2 MET 34 11.709 -19.171 -15.476 257 2HG MET 34 HG3 MET 34 10.996 -17.562 -15.445 258 1HE MET 34 HE1 MET 34 8.008 -17.691 -14.968 259 2HE MET 34 HE2 MET 34 7.912 -17.794 -13.200 260 3HE MET 34 HE3 MET 34 9.120 -16.739 -13.960 261 H LYS 35 H LYS 35 10.934 -16.931 -20.258 262 HA LYS 35 HA LYS 35 9.893 -16.834 -22.245 263 1HB LYS 35 HB2 LYS 35 10.150 -19.865 -22.196 264 2HB LYS 35 HB3 LYS 35 9.856 -18.863 -23.621 265 1HG LYS 35 HG2 LYS 35 12.029 -17.704 -23.263 266 2HG LYS 35 HG3 LYS 35 12.357 -18.769 -21.881 267 1HD LYS 35 HD2 LYS 35 12.232 -20.749 -23.368 268 2HD LYS 35 HD3 LYS 35 11.915 -19.684 -24.757 269 1HE LYS 35 HE2 LYS 35 14.094 -18.547 -24.375 270 2HE LYS 35 HE3 LYS 35 14.409 -19.607 -22.997 271 1HZ LYS 35 HZ1 LYS 35 15.517 -20.393 -24.988 272 2HZ LYS 35 HZ2 LYS 35 14.405 -21.491 -24.528 273 3HZ LYS 35 HZ3 LYS 35 14.112 -20.509 -25.804 274 H MET 36 H MET 36 8.137 -16.710 -20.005 275 HA MET 36 HA MET 36 5.567 -17.421 -21.268 276 1HB MET 36 HB2 MET 36 6.454 -18.111 -18.424 277 2HB MET 36 HB3 MET 36 4.774 -18.131 -18.961 278 1HG MET 36 HG2 MET 36 5.315 -19.834 -20.661 279 2HG MET 36 HG3 MET 36 6.977 -19.895 -20.079 280 1HE MET 36 HE1 MET 36 7.767 -20.926 -17.830 281 2HE MET 36 HE2 MET 36 6.754 -19.804 -16.890 282 3HE MET 36 HE3 MET 36 6.685 -21.547 -16.565 283 H GLU 37 H GLU 37 3.808 -16.314 -19.822 284 HA GLU 37 HA GLU 37 4.784 -13.767 -18.660 285 1HB GLU 37 HB2 GLU 37 2.192 -14.146 -20.216 286 2HB GLU 37 HB3 GLU 37 2.676 -12.721 -19.308 287 1HG GLU 37 HG2 GLU 37 3.169 -12.115 -21.485 288 2HG GLU 37 HG3 GLU 37 4.736 -12.567 -20.824 289 H ILE 38 H ILE 38 3.854 -13.308 -16.685 290 HA ILE 38 HA ILE 38 2.167 -15.398 -15.414 291 HB ILE 38 HB ILE 38 4.717 -14.092 -14.338 292 1HG1 ILE 38 HG12 ILE 38 5.269 -16.752 -14.231 293 2HG1 ILE 38 HG13 ILE 38 4.212 -16.770 -15.630 294 1HG2 ILE 38 HG21 ILE 38 4.448 -15.626 -12.418 295 2HG2 ILE 38 HG22 ILE 38 3.111 -14.495 -12.535 296 3HG2 ILE 38 HG23 ILE 38 2.893 -16.181 -13.072 297 1HD1 ILE 38 HD11 ILE 38 6.502 -16.582 -16.370 298 2HD1 ILE 38 HD12 ILE 38 5.780 -14.997 -16.665 299 3HD1 ILE 38 HD13 ILE 38 6.827 -15.245 -15.256 300 HA PRO 39 HA PRO 39 0.130 -11.500 -14.354 301 1HB PRO 39 HB2 PRO 39 -1.788 -12.393 -12.617 302 2HB PRO 39 HB3 PRO 39 -1.873 -12.661 -14.385 303 1HG PRO 39 HG2 PRO 39 -0.887 -14.585 -12.261 304 2HG PRO 39 HG3 PRO 39 -2.027 -14.907 -13.606 305 1HD PRO 39 HD2 PRO 39 0.636 -15.510 -13.765 306 2HD PRO 39 HD3 PRO 39 -0.284 -14.952 -15.194 307 H ILE 40 H ILE 40 0.285 -10.007 -12.672 308 HA ILE 40 HA ILE 40 1.571 -10.876 -10.125 309 HB ILE 40 HB ILE 40 1.998 -8.349 -11.744 310 1HG1 ILE 40 HG12 ILE 40 3.259 -10.179 -12.706 311 2HG1 ILE 40 HG13 ILE 40 4.294 -8.953 -11.999 312 1HG2 ILE 40 HG21 ILE 40 3.699 -7.768 -9.981 313 2HG2 ILE 40 HG22 ILE 40 2.017 -7.699 -9.436 314 3HG2 ILE 40 HG23 ILE 40 3.034 -9.076 -8.988 315 1HD1 ILE 40 HD11 ILE 40 5.130 -11.199 -11.544 316 2HD1 ILE 40 HD12 ILE 40 4.712 -10.392 -10.028 317 3HD1 ILE 40 HD13 ILE 40 3.637 -11.640 -10.707 318 H VAL 41 H VAL 41 0.284 -10.527 -8.476 319 HA VAL 41 HA VAL 41 -2.176 -8.935 -8.886 320 HB VAL 41 HB VAL 41 -3.154 -10.561 -7.205 321 1HG1 VAL 41 HG11 VAL 41 -3.540 -12.347 -8.866 322 2HG1 VAL 41 HG12 VAL 41 -3.745 -10.734 -9.531 323 3HG1 VAL 41 HG13 VAL 41 -2.267 -11.658 -9.903 324 1HG2 VAL 41 HG21 VAL 41 -0.996 -11.504 -6.345 325 2HG2 VAL 41 HG22 VAL 41 -2.144 -12.732 -6.898 326 3HG2 VAL 41 HG23 VAL 41 -0.761 -12.307 -7.920 327 H ALA 42 H ALA 42 -3.133 -7.995 -7.031 328 HA ALA 42 HA ALA 42 -1.378 -6.507 -5.353 329 1HB ALA 42 HB1 ALA 42 -3.625 -5.746 -6.019 330 2HB ALA 42 HB2 ALA 42 -4.354 -7.113 -5.161 331 3HB ALA 42 HB3 ALA 42 -3.511 -5.849 -4.246 332 H ASP 43 H ASP 43 -0.249 -7.324 -3.676 333 HA ASP 43 HA ASP 43 -0.709 -9.842 -2.424 334 1HB ASP 43 HB2 ASP 43 1.481 -8.783 -2.412 335 2HB ASP 43 HB3 ASP 43 0.846 -7.371 -1.564 336 H ARG 44 H ARG 44 -2.084 -6.664 -1.863 337 HA ARG 44 HA ARG 44 -3.885 -7.636 0.193 338 1HB ARG 44 HB2 ARG 44 -3.226 -5.927 1.842 339 2HB ARG 44 HB3 ARG 44 -1.950 -7.107 1.561 340 1HG ARG 44 HG2 ARG 44 -0.945 -5.337 -0.108 341 2HG ARG 44 HG3 ARG 44 -2.086 -4.209 0.625 342 1HD ARG 44 HD2 ARG 44 0.076 -3.995 1.676 343 2HD ARG 44 HD3 ARG 44 -1.062 -4.688 2.854 344 HE ARG 44 HE ARG 44 0.394 -6.727 1.369 345 1HH1 ARG 44 HH21 ARG 44 0.750 -4.548 4.171 346 2HH1 ARG 44 HH22 ARG 44 1.931 -5.548 4.932 347 1HH2 ARG 44 HH11 ARG 44 1.838 -7.967 2.296 348 2HH2 ARG 44 HH12 ARG 44 2.601 -7.600 3.833 349 H SER 45 H SER 45 -5.637 -6.066 0.510 350 HA SER 45 HA SER 45 -6.244 -4.485 -1.796 351 1HB SER 45 HB2 SER 45 -7.565 -4.392 0.946 352 2HB SER 45 HB3 SER 45 -8.304 -4.052 -0.624 353 HG SER 45 HG SER 45 -8.737 -6.189 0.299 354 H GLY 46 H GLY 46 -6.635 -2.114 -1.812 355 1HA GLY 46 HA2 GLY 46 -6.254 -0.329 0.230 356 2HA GLY 46 HA3 GLY 46 -4.611 -0.589 -0.369 357 H ILE 47 H ILE 47 -5.096 1.838 -0.661 358 HA ILE 47 HA ILE 47 -6.095 2.367 -3.421 359 HB ILE 47 HB ILE 47 -5.453 4.253 -1.112 360 1HG1 ILE 47 HG12 ILE 47 -7.606 3.132 -0.773 361 2HG1 ILE 47 HG13 ILE 47 -7.806 4.846 -1.084 362 1HG2 ILE 47 HG21 ILE 47 -4.817 5.384 -3.139 363 2HG2 ILE 47 HG22 ILE 47 -6.314 4.903 -3.960 364 3HG2 ILE 47 HG23 ILE 47 -6.357 6.058 -2.610 365 1HD1 ILE 47 HD11 ILE 47 -8.269 2.632 -3.127 366 2HD1 ILE 47 HD12 ILE 47 -9.521 3.511 -2.237 367 3HD1 ILE 47 HD13 ILE 47 -8.514 4.368 -3.416 368 H VAL 48 H VAL 48 -4.595 2.833 -4.931 369 HA VAL 48 HA VAL 48 -1.777 2.321 -4.457 370 HB VAL 48 HB VAL 48 -3.236 3.473 -6.854 371 1HG1 VAL 48 HG11 VAL 48 -0.807 3.904 -6.956 372 2HG1 VAL 48 HG12 VAL 48 -0.461 2.209 -6.586 373 3HG1 VAL 48 HG13 VAL 48 -1.247 2.650 -8.116 374 1HG2 VAL 48 HG21 VAL 48 -3.061 1.132 -7.741 375 2HG2 VAL 48 HG22 VAL 48 -2.567 0.595 -6.118 376 3HG2 VAL 48 HG23 VAL 48 -4.169 1.294 -6.389 377 H LYS 49 H LYS 49 -0.550 3.826 -3.369 378 HA LYS 49 HA LYS 49 -1.279 6.685 -3.433 379 1HB LYS 49 HB2 LYS 49 -0.352 5.611 -1.373 380 2HB LYS 49 HB3 LYS 49 1.164 5.310 -2.235 381 1HG LYS 49 HG2 LYS 49 1.418 7.786 -2.558 382 2HG LYS 49 HG3 LYS 49 -0.129 8.039 -1.739 383 1HD LYS 49 HD2 LYS 49 1.689 8.503 -0.208 384 2HD LYS 49 HD3 LYS 49 0.819 7.059 0.346 385 1HE LYS 49 HE2 LYS 49 2.548 5.608 -0.642 386 2HE LYS 49 HE3 LYS 49 3.386 7.015 -1.316 387 1HZ LYS 49 HZ1 LYS 49 4.396 6.191 0.696 388 2HZ LYS 49 HZ2 LYS 49 3.868 7.732 0.931 389 3HZ LYS 49 HZ3 LYS 49 3.021 6.475 1.573 390 H GLU 50 H GLU 50 1.284 4.426 -4.676 391 HA GLU 50 HA GLU 50 1.750 6.232 -6.938 392 1HB GLU 50 HB2 GLU 50 3.125 7.148 -5.020 393 2HB GLU 50 HB3 GLU 50 3.991 5.613 -4.946 394 1HG GLU 50 HG2 GLU 50 4.902 5.965 -7.172 395 2HG GLU 50 HG3 GLU 50 3.842 7.351 -7.448 396 H VAL 51 H VAL 51 2.972 5.142 -8.619 397 HA VAL 51 HA VAL 51 3.320 2.200 -8.240 398 HB VAL 51 HB VAL 51 2.890 3.718 -10.852 399 1HG1 VAL 51 HG11 VAL 51 2.815 0.729 -10.192 400 2HG1 VAL 51 HG12 VAL 51 2.454 1.459 -11.769 401 3HG1 VAL 51 HG13 VAL 51 4.088 1.566 -11.112 402 1HG2 VAL 51 HG21 VAL 51 0.620 2.696 -10.876 403 2HG2 VAL 51 HG22 VAL 51 0.875 2.113 -9.213 404 3HG2 VAL 51 HG23 VAL 51 0.798 3.855 -9.563 405 H LYS 52 H LYS 52 5.371 1.432 -8.559 406 HA LYS 52 HA LYS 52 7.460 3.561 -8.614 407 1HB LYS 52 HB2 LYS 52 7.581 0.762 -7.458 408 2HB LYS 52 HB3 LYS 52 8.734 2.069 -7.179 409 1HG LYS 52 HG2 LYS 52 5.863 1.889 -6.180 410 2HG LYS 52 HG3 LYS 52 7.305 1.674 -5.226 411 1HD LYS 52 HD2 LYS 52 6.607 4.326 -6.545 412 2HD LYS 52 HD3 LYS 52 6.051 3.830 -4.947 413 1HE LYS 52 HE2 LYS 52 8.588 3.356 -4.457 414 2HE LYS 52 HE3 LYS 52 8.881 4.411 -5.850 415 1HZ LYS 52 HZ1 LYS 52 7.389 5.091 -3.375 416 2HZ LYS 52 HZ2 LYS 52 8.849 5.697 -3.829 417 3HZ LYS 52 HZ3 LYS 52 7.493 6.093 -4.680 418 H LYS 53 H LYS 53 6.226 1.532 -10.866 419 HA LYS 53 HA LYS 53 8.829 1.080 -12.199 420 1HB LYS 53 HB2 LYS 53 6.678 -1.014 -11.629 421 2HB LYS 53 HB3 LYS 53 7.904 -1.213 -12.878 422 1HG LYS 53 HG2 LYS 53 8.622 -0.813 -9.963 423 2HG LYS 53 HG3 LYS 53 8.379 -2.395 -10.722 424 1HD LYS 53 HD2 LYS 53 10.126 -1.887 -12.389 425 2HD LYS 53 HD3 LYS 53 10.428 -0.319 -11.611 426 1HE LYS 53 HE2 LYS 53 11.184 -1.402 -9.569 427 2HE LYS 53 HE3 LYS 53 10.706 -2.985 -10.154 428 1HZ LYS 53 HZ1 LYS 53 12.875 -1.301 -11.257 429 2HZ LYS 53 HZ2 LYS 53 12.989 -2.775 -10.494 430 3HZ LYS 53 HZ3 LYS 53 12.349 -2.667 -11.996 431 H LYS 54 H LYS 54 8.125 0.046 -14.518 432 HA LYS 54 HA LYS 54 5.779 1.392 -15.599 433 1HB LYS 54 HB2 LYS 54 7.012 2.583 -17.333 434 2HB LYS 54 HB3 LYS 54 7.461 3.180 -15.738 435 1HG LYS 54 HG2 LYS 54 9.551 1.819 -15.814 436 2HG LYS 54 HG3 LYS 54 9.121 1.245 -17.430 437 1HD LYS 54 HD2 LYS 54 9.602 4.158 -16.671 438 2HD LYS 54 HD3 LYS 54 10.791 3.084 -17.424 439 1HE LYS 54 HE2 LYS 54 9.271 2.780 -19.380 440 2HE LYS 54 HE3 LYS 54 8.118 3.905 -18.650 441 1HZ LYS 54 HZ1 LYS 54 9.815 5.633 -18.788 442 2HZ LYS 54 HZ2 LYS 54 10.880 4.594 -19.467 443 3HZ LYS 54 HZ3 LYS 54 9.523 5.009 -20.262 444 H GLU 55 H GLU 55 5.430 0.666 -17.850 445 HA GLU 55 HA GLU 55 5.657 -2.155 -17.962 446 1HB GLU 55 HB2 GLU 55 4.969 -0.227 -20.223 447 2HB GLU 55 HB3 GLU 55 4.605 -1.961 -20.150 448 1HG GLU 55 HG2 GLU 55 3.289 -1.486 -18.028 449 2HG GLU 55 HG3 GLU 55 3.472 0.234 -18.357 450 H GLY 56 H GLY 56 7.142 -3.464 -18.827 451 1HA GLY 56 HA2 GLY 56 8.804 -4.238 -20.206 452 2HA GLY 56 HA3 GLY 56 9.032 -2.623 -20.887 453 H ASP 57 H ASP 57 9.167 -2.120 -17.541 454 HA ASP 57 HA ASP 57 12.047 -1.841 -17.628 455 1HB ASP 57 HB2 ASP 57 10.551 -0.361 -16.292 456 2HB ASP 57 HB3 ASP 57 10.210 -1.717 -15.210 457 H PHE 58 H PHE 58 13.542 -2.893 -16.151 458 HA PHE 58 HA PHE 58 13.228 -5.795 -15.966 459 1HB PHE 58 HB2 PHE 58 15.419 -4.742 -16.384 460 2HB PHE 58 HB3 PHE 58 15.288 -3.842 -14.880 461 HD1 PHE 58 HD1 PHE 58 15.833 -7.208 -16.360 462 HD2 PHE 58 HD2 PHE 58 15.780 -4.881 -12.725 463 HE1 PHE 58 HE1 PHE 58 17.010 -9.037 -15.172 464 HE2 PHE 58 HE2 PHE 58 16.969 -6.710 -11.545 465 HZ PHE 58 HZ PHE 58 17.608 -8.781 -12.772 466 H VAL 59 H VAL 59 12.836 -6.978 -14.064 467 HA VAL 59 HA VAL 59 12.372 -5.554 -11.543 468 HB VAL 59 HB VAL 59 10.178 -6.881 -11.317 469 1HG1 VAL 59 HG11 VAL 59 8.843 -5.058 -12.231 470 2HG1 VAL 59 HG12 VAL 59 10.284 -4.453 -11.412 471 3HG1 VAL 59 HG13 VAL 59 10.213 -4.485 -13.193 472 1HG2 VAL 59 HG21 VAL 59 10.366 -8.223 -13.393 473 2HG2 VAL 59 HG22 VAL 59 8.871 -7.258 -13.329 474 3HG2 VAL 59 HG23 VAL 59 10.212 -6.737 -14.358 475 H ASN 60 H ASN 60 12.040 -7.121 -9.746 476 HA ASN 60 HA ASN 60 13.328 -9.691 -10.220 477 1HB ASN 60 HB2 ASN 60 14.933 -7.490 -9.632 478 2HB ASN 60 HB3 ASN 60 14.648 -8.204 -8.045 479 1HD2 ASN 60 HD22 ASN 60 15.422 -9.136 -11.455 480 2HD2 ASN 60 HD21 ASN 60 16.543 -10.412 -11.023 481 H GLU 61 H GLU 61 13.604 -10.909 -8.145 482 HA GLU 61 HA GLU 61 11.081 -11.151 -6.821 483 1HB GLU 61 HB2 GLU 61 12.579 -13.026 -7.169 484 2HB GLU 61 HB3 GLU 61 13.875 -12.240 -6.285 485 1HG GLU 61 HG2 GLU 61 12.464 -12.339 -4.198 486 2HG GLU 61 HG3 GLU 61 11.197 -13.147 -5.115 487 H GLY 62 H GLY 62 10.301 -9.608 -5.515 488 1HA GLY 62 HA2 GLY 62 10.139 -8.463 -3.515 489 2HA GLY 62 HA3 GLY 62 11.873 -8.654 -3.219 490 H ASP 63 H ASP 63 11.301 -7.513 -6.462 491 HA ASP 63 HA ASP 63 12.239 -4.826 -5.762 492 1HB ASP 63 HB2 ASP 63 12.944 -6.214 -7.811 493 2HB ASP 63 HB3 ASP 63 11.335 -5.904 -8.461 494 H VAL 64 H VAL 64 10.821 -3.074 -5.600 495 HA VAL 64 HA VAL 64 8.099 -3.702 -5.031 496 HB VAL 64 HB VAL 64 9.459 -0.994 -5.360 497 1HG1 VAL 64 HG11 VAL 64 7.605 -0.225 -3.823 498 2HG1 VAL 64 HG12 VAL 64 7.049 -0.693 -5.432 499 3HG1 VAL 64 HG13 VAL 64 6.816 -1.798 -4.070 500 1HG2 VAL 64 HG21 VAL 64 8.996 -2.732 -2.890 501 2HG2 VAL 64 HG22 VAL 64 10.569 -2.330 -3.609 502 3HG2 VAL 64 HG23 VAL 64 9.601 -1.060 -2.865 503 H LEU 65 H LEU 65 6.234 -3.315 -6.131 504 HA LEU 65 HA LEU 65 6.375 -2.487 -8.994 505 1HB LEU 65 HB2 LEU 65 5.308 -4.684 -8.664 506 2HB LEU 65 HB3 LEU 65 4.280 -4.037 -7.402 507 HG LEU 65 HG LEU 65 3.136 -2.577 -9.075 508 1HD1 LEU 65 HD11 LEU 65 4.880 -2.219 -10.714 509 2HD1 LEU 65 HD12 LEU 65 4.966 -3.962 -11.063 510 3HD1 LEU 65 HD13 LEU 65 3.520 -3.015 -11.500 511 1HD2 LEU 65 HD21 LEU 65 3.234 -5.484 -9.947 512 2HD2 LEU 65 HD22 LEU 65 2.306 -4.881 -8.558 513 3HD2 LEU 65 HD23 LEU 65 1.898 -4.334 -10.190 514 H LEU 66 H LEU 66 4.544 -2.051 -5.861 515 HA LEU 66 HA LEU 66 4.120 0.747 -6.564 516 1HB LEU 66 HB2 LEU 66 1.781 0.804 -6.548 517 2HB LEU 66 HB3 LEU 66 2.274 -0.286 -7.813 518 HG LEU 66 HG LEU 66 1.500 -1.445 -5.111 519 1HD1 LEU 66 HD11 LEU 66 -0.255 0.145 -5.535 520 2HD1 LEU 66 HD12 LEU 66 -0.433 -0.402 -7.215 521 3HD1 LEU 66 HD13 LEU 66 -0.857 -1.484 -5.874 522 1HD2 LEU 66 HD21 LEU 66 2.285 -2.982 -6.885 523 2HD2 LEU 66 HD22 LEU 66 0.581 -3.261 -6.519 524 3HD2 LEU 66 HD23 LEU 66 1.028 -2.372 -7.987 525 H GLU 67 H GLU 67 2.840 1.901 -4.902 526 HA GLU 67 HA GLU 67 3.425 0.901 -2.168 527 1HB GLU 67 HB2 GLU 67 5.175 2.440 -3.115 528 2HB GLU 67 HB3 GLU 67 3.934 3.690 -3.300 529 1HG GLU 67 HG2 GLU 67 3.541 3.613 -0.837 530 2HG GLU 67 HG3 GLU 67 4.800 2.383 -0.683 531 H LEU 68 H LEU 68 1.825 1.537 -0.653 532 HA LEU 68 HA LEU 68 -0.732 2.461 -1.890 533 1HB LEU 68 HB2 LEU 68 -0.323 0.466 0.370 534 2HB LEU 68 HB3 LEU 68 -1.859 0.944 -0.339 535 HG LEU 68 HG LEU 68 0.338 -0.646 -1.732 536 1HD1 LEU 68 HD11 LEU 68 -1.247 -2.499 -1.644 537 2HD1 LEU 68 HD12 LEU 68 -0.956 -1.894 -0.006 538 3HD1 LEU 68 HD13 LEU 68 -2.459 -1.475 -0.853 539 1HD2 LEU 68 HD21 LEU 68 -1.252 -0.939 -3.556 540 2HD2 LEU 68 HD22 LEU 68 -2.393 0.191 -2.785 541 3HD2 LEU 68 HD23 LEU 68 -0.800 0.749 -3.362 542 H SER 69 H SER 69 -2.182 3.597 -0.553 543 HA SER 69 HA SER 69 -1.001 5.368 1.409 544 1HB SER 69 HB2 SER 69 -3.918 4.794 0.731 545 2HB SER 69 HB3 SER 69 -3.291 6.218 1.585 546 HG SER 69 HG SER 69 -3.634 6.677 -0.609 547 H ASN 70 H ASN 70 -1.129 5.235 3.656 548 HA ASN 70 HA ASN 70 -3.042 3.521 4.992 549 1HB ASN 70 HB2 ASN 70 -1.303 1.819 4.731 550 2HB ASN 70 HB3 ASN 70 -0.052 2.967 5.218 551 1HD2 ASN 70 HD22 ASN 70 0.688 2.302 7.238 552 2HD2 ASN 70 HD21 ASN 70 -0.373 2.088 8.616 553 H SER 71 H SER 71 -3.487 4.453 7.036 554 HA SER 71 HA SER 71 -2.869 7.193 7.233 555 1HB SER 71 HB2 SER 71 -4.103 6.834 9.505 556 2HB SER 71 HB3 SER 71 -4.960 6.558 7.982 557 HG SER 71 HG SER 71 -5.295 4.867 9.488 558 H THR 72 H THR 72 -1.232 4.415 8.739 559 HA THR 72 HA THR 72 -0.006 5.862 10.849 560 HB THR 72 HB THR 72 1.292 3.480 9.536 561 HG1 THR 72 HG1 THR 72 -1.112 3.359 11.040 562 1HG2 THR 72 HG21 THR 72 1.562 2.706 11.869 563 2HG2 THR 72 HG22 THR 72 2.293 4.299 11.621 564 3HG2 THR 72 HG23 THR 72 0.729 4.167 12.454 565 H GLN 73 H GLN 73 0.651 5.933 7.419 566 HA GLN 73 HA GLN 73 3.494 6.351 7.495 567 1HB GLN 73 HB2 GLN 73 1.384 7.096 5.424 568 2HB GLN 73 HB3 GLN 73 3.124 7.260 5.185 569 1HG GLN 73 HG2 GLN 73 3.460 4.851 5.418 570 2HG GLN 73 HG3 GLN 73 1.764 4.611 5.830 571 1HE2 GLN 73 HE22 GLN 73 2.045 3.000 3.962 572 2HE2 GLN 73 HE21 GLN 73 1.589 3.616 2.386 Start of MODEL 17 1 1H THR 2 H1 THR 2 4.221 -2.566 1.323 2 2H THR 2 H2 THR 2 3.951 -0.961 1.170 3 3H THR 2 H3 THR 2 2.728 -2.037 0.902 4 HA THR 2 HA THR 2 3.638 -1.182 -1.195 5 HB THR 2 HB THR 2 5.966 -2.288 -1.707 6 HG1 THR 2 HG1 THR 2 7.275 -2.532 0.042 7 1HG2 THR 2 HG21 THR 2 5.631 0.144 -1.683 8 2HG2 THR 2 HG22 THR 2 5.791 0.174 0.091 9 3HG2 THR 2 HG23 THR 2 7.168 -0.289 -0.930 10 H VAL 3 H VAL 3 3.937 -2.650 -3.132 11 HA VAL 3 HA VAL 3 3.453 -5.513 -2.560 12 HB VAL 3 HB VAL 3 1.976 -3.985 -4.742 13 1HG1 VAL 3 HG11 VAL 3 2.410 -6.357 -5.270 14 2HG1 VAL 3 HG12 VAL 3 1.688 -6.836 -3.718 15 3HG1 VAL 3 HG13 VAL 3 0.699 -6.072 -4.990 16 1HG2 VAL 3 HG21 VAL 3 0.838 -5.031 -2.112 17 2HG2 VAL 3 HG22 VAL 3 0.967 -3.328 -2.599 18 3HG2 VAL 3 HG23 VAL 3 -0.113 -4.406 -3.484 19 H SER 4 H SER 4 4.646 -6.796 -4.025 20 HA SER 4 HA SER 4 6.555 -5.385 -5.821 21 1HB SER 4 HB2 SER 4 7.205 -7.438 -3.668 22 2HB SER 4 HB3 SER 4 8.362 -6.609 -4.716 23 HG SER 4 HG SER 4 8.164 -5.690 -2.586 24 H ILE 5 H ILE 5 7.667 -6.748 -7.278 25 HA ILE 5 HA ILE 5 6.084 -8.935 -8.392 26 HB ILE 5 HB ILE 5 8.825 -7.776 -9.123 27 1HG1 ILE 5 HG12 ILE 5 7.363 -7.093 -11.237 28 2HG1 ILE 5 HG13 ILE 5 6.002 -7.253 -10.144 29 1HG2 ILE 5 HG21 ILE 5 8.587 -9.003 -11.248 30 2HG2 ILE 5 HG22 ILE 5 8.640 -10.101 -9.895 31 3HG2 ILE 5 HG23 ILE 5 7.078 -9.741 -10.674 32 1HD1 ILE 5 HD11 ILE 5 6.964 -5.451 -8.720 33 2HD1 ILE 5 HD12 ILE 5 8.406 -5.406 -9.741 34 3HD1 ILE 5 HD13 ILE 5 6.824 -4.927 -10.400 35 H GLN 6 H GLN 6 6.787 -11.176 -8.371 36 HA GLN 6 HA GLN 6 8.376 -11.782 -5.931 37 1HB GLN 6 HB2 GLN 6 6.385 -13.629 -7.264 38 2HB GLN 6 HB3 GLN 6 7.080 -13.723 -5.656 39 1HG GLN 6 HG2 GLN 6 5.051 -12.904 -5.063 40 2HG GLN 6 HG3 GLN 6 5.870 -11.369 -5.305 41 1HE2 GLN 6 HE22 GLN 6 4.556 -9.917 -6.489 42 2HE2 GLN 6 HE21 GLN 6 3.403 -10.436 -7.704 43 H MET 7 H MET 7 9.195 -11.681 -9.110 44 HA MET 7 HA MET 7 11.195 -13.750 -8.788 45 1HB MET 7 HB2 MET 7 10.641 -15.094 -10.682 46 2HB MET 7 HB3 MET 7 9.226 -15.035 -9.650 47 1HG MET 7 HG2 MET 7 8.842 -12.898 -11.455 48 2HG MET 7 HG3 MET 7 9.609 -14.157 -12.413 49 1HE MET 7 HE1 MET 7 5.332 -13.960 -10.811 50 2HE MET 7 HE2 MET 7 6.681 -13.730 -9.674 51 3HE MET 7 HE3 MET 7 6.506 -12.661 -11.084 52 H ALA 8 H ALA 8 12.761 -13.668 -10.664 53 HA ALA 8 HA ALA 8 13.263 -10.918 -11.492 54 1HB ALA 8 HB1 ALA 8 14.646 -13.523 -12.229 55 2HB ALA 8 HB2 ALA 8 15.250 -11.880 -12.539 56 3HB ALA 8 HB3 ALA 8 15.084 -12.462 -10.864 57 H GLY 9 H GLY 9 12.914 -9.970 -13.477 58 1HA GLY 9 HA2 GLY 9 12.670 -11.312 -15.921 59 2HA GLY 9 HA3 GLY 9 11.036 -11.213 -15.273 60 H ASN 10 H ASN 10 10.375 -9.806 -16.957 61 HA ASN 10 HA ASN 10 11.098 -6.934 -16.550 62 1HB ASN 10 HB2 ASN 10 11.221 -8.507 -19.152 63 2HB ASN 10 HB3 ASN 10 10.620 -6.855 -19.160 64 1HD2 ASN 10 HD22 ASN 10 13.330 -7.894 -16.991 65 2HD2 ASN 10 HD21 ASN 10 14.538 -7.007 -17.896 66 H LEU 11 H LEU 11 9.341 -5.670 -16.597 67 HA LEU 11 HA LEU 11 6.818 -6.971 -16.145 68 1HB LEU 11 HB2 LEU 11 7.864 -4.154 -16.274 69 2HB LEU 11 HB3 LEU 11 6.134 -4.395 -16.416 70 HG LEU 11 HG LEU 11 7.763 -5.619 -14.164 71 1HD1 LEU 11 HD11 LEU 11 6.253 -2.985 -14.235 72 2HD1 LEU 11 HD12 LEU 11 6.923 -3.739 -12.770 73 3HD1 LEU 11 HD13 LEU 11 8.005 -3.210 -14.077 74 1HD2 LEU 11 HD21 LEU 11 5.510 -5.647 -13.008 75 2HD2 LEU 11 HD22 LEU 11 4.783 -5.182 -14.565 76 3HD2 LEU 11 HD23 LEU 11 5.616 -6.736 -14.389 77 H TRP 12 H TRP 12 5.386 -7.658 -17.577 78 HA TRP 12 HA TRP 12 5.690 -7.136 -20.434 79 1HB TRP 12 HB2 TRP 12 4.872 -9.305 -19.250 80 2HB TRP 12 HB3 TRP 12 3.352 -8.461 -19.016 81 HD1 TRP 12 HD1 TRP 12 5.722 -9.336 -21.875 82 HE1 TRP 12 HE1 TRP 12 4.415 -10.024 -23.966 83 HE3 TRP 12 HE3 TRP 12 1.004 -8.613 -20.094 84 HZ2 TRP 12 HZ2 TRP 12 1.622 -10.239 -24.754 85 HZ3 TRP 12 HZ3 TRP 12 -0.971 -9.076 -21.517 86 HH2 TRP 12 HH2 TRP 12 -0.674 -9.887 -23.849 87 H LYS 13 H LYS 13 3.286 -6.422 -17.843 88 HA LYS 13 HA LYS 13 2.518 -3.872 -19.106 89 1HB LYS 13 HB2 LYS 13 0.635 -6.189 -18.476 90 2HB LYS 13 HB3 LYS 13 0.075 -4.547 -18.787 91 1HG LYS 13 HG2 LYS 13 1.549 -6.277 -20.812 92 2HG LYS 13 HG3 LYS 13 -0.200 -6.113 -20.694 93 1HD LYS 13 HD2 LYS 13 -0.058 -3.714 -21.160 94 2HD LYS 13 HD3 LYS 13 1.719 -3.815 -21.250 95 1HE LYS 13 HE2 LYS 13 1.535 -5.438 -23.118 96 2HE LYS 13 HE3 LYS 13 -0.229 -5.336 -23.040 97 1HZ LYS 13 HZ1 LYS 13 -0.053 -2.988 -23.639 98 2HZ LYS 13 HZ2 LYS 13 1.579 -3.085 -23.716 99 3HZ LYS 13 HZ3 LYS 13 0.659 -3.916 -24.772 100 H VAL 14 H VAL 14 1.249 -2.570 -17.551 101 HA VAL 14 HA VAL 14 1.046 -3.506 -14.767 102 HB VAL 14 HB VAL 14 2.331 -0.867 -15.614 103 1HG1 VAL 14 HG11 VAL 14 2.576 -0.473 -13.148 104 2HG1 VAL 14 HG12 VAL 14 0.897 -0.463 -13.675 105 3HG1 VAL 14 HG13 VAL 14 1.554 -1.895 -12.844 106 1HG2 VAL 14 HG21 VAL 14 3.453 -3.231 -14.048 107 2HG2 VAL 14 HG22 VAL 14 3.965 -2.703 -15.667 108 3HG2 VAL 14 HG23 VAL 14 4.269 -1.667 -14.271 109 H HIS 15 H HIS 15 -0.902 -2.727 -13.898 110 HA HIS 15 HA HIS 15 -2.686 -1.346 -15.866 111 1HB HIS 15 HB2 HIS 15 -3.611 -3.226 -13.701 112 2HB HIS 15 HB3 HIS 15 -4.415 -2.785 -15.202 113 HD1 HIS 15 HD1 HIS 15 -2.163 -3.661 -17.313 114 HD2 HIS 15 HD2 HIS 15 -3.251 -5.749 -13.826 115 HE1 HIS 15 HE1 HIS 15 -1.299 -6.056 -17.587 116 H VAL 16 H VAL 16 -1.433 -1.231 -12.598 117 HA VAL 16 HA VAL 16 -3.560 0.434 -11.526 118 HB VAL 16 HB VAL 16 -1.940 0.810 -9.674 119 1HG1 VAL 16 HG11 VAL 16 -2.038 -1.499 -8.823 120 2HG1 VAL 16 HG12 VAL 16 -3.552 -1.017 -9.600 121 3HG1 VAL 16 HG13 VAL 16 -2.426 -2.087 -10.455 122 1HG2 VAL 16 HG21 VAL 16 0.150 -0.220 -9.502 123 2HG2 VAL 16 HG22 VAL 16 -0.094 -1.238 -10.942 124 3HG2 VAL 16 HG23 VAL 16 0.173 0.514 -11.098 125 H LYS 17 H LYS 17 -3.088 2.580 -10.638 126 HA LYS 17 HA LYS 17 -0.995 4.176 -11.774 127 1HB LYS 17 HB2 LYS 17 -2.541 5.959 -12.612 128 2HB LYS 17 HB3 LYS 17 -2.526 4.501 -13.573 129 1HG LYS 17 HG2 LYS 17 -4.687 4.006 -11.878 130 2HG LYS 17 HG3 LYS 17 -4.737 5.756 -12.020 131 1HD LYS 17 HD2 LYS 17 -6.148 4.843 -13.748 132 2HD LYS 17 HD3 LYS 17 -4.692 5.445 -14.539 133 1HE LYS 17 HE2 LYS 17 -5.006 3.351 -15.555 134 2HE LYS 17 HE3 LYS 17 -3.775 3.024 -14.339 135 1HZ LYS 17 HZ1 LYS 17 -5.307 1.311 -14.170 136 2HZ LYS 17 HZ2 LYS 17 -5.733 2.228 -12.894 137 3HZ LYS 17 HZ3 LYS 17 -6.626 2.284 -14.265 138 H ALA 18 H ALA 18 -0.823 6.162 -10.414 139 HA ALA 18 HA ALA 18 -1.515 5.660 -7.687 140 1HB ALA 18 HB1 ALA 18 0.420 7.015 -8.365 141 2HB ALA 18 HB2 ALA 18 -0.668 8.263 -9.028 142 3HB ALA 18 HB3 ALA 18 -0.660 7.926 -7.283 143 H GLY 19 H GLY 19 -3.292 6.176 -6.534 144 1HA GLY 19 HA2 GLY 19 -5.238 7.365 -5.972 145 2HA GLY 19 HA3 GLY 19 -5.420 7.920 -7.640 146 H ASP 20 H ASP 20 -4.696 4.749 -8.155 147 HA ASP 20 HA ASP 20 -7.460 4.003 -8.607 148 1HB ASP 20 HB2 ASP 20 -5.257 3.415 -9.890 149 2HB ASP 20 HB3 ASP 20 -5.125 2.078 -8.749 150 H GLN 21 H GLN 21 -8.059 1.641 -7.909 151 HA GLN 21 HA GLN 21 -7.517 1.228 -4.992 152 1HB GLN 21 HB2 GLN 21 -9.826 2.022 -5.358 153 2HB GLN 21 HB3 GLN 21 -10.051 0.840 -6.640 154 1HG GLN 21 HG2 GLN 21 -11.224 -0.013 -4.803 155 2HG GLN 21 HG3 GLN 21 -9.793 -1.009 -4.917 156 1HE2 GLN 21 HE22 GLN 21 -8.693 -1.338 -2.925 157 2HE2 GLN 21 HE21 GLN 21 -8.932 -0.311 -1.532 158 H ILE 22 H ILE 22 -6.818 -0.810 -4.496 159 HA ILE 22 HA ILE 22 -7.284 -2.965 -6.464 160 HB ILE 22 HB ILE 22 -5.145 -3.909 -6.214 161 1HG1 ILE 22 HG12 ILE 22 -4.487 -1.751 -4.168 162 2HG1 ILE 22 HG13 ILE 22 -4.664 -3.487 -3.877 163 1HG2 ILE 22 HG21 ILE 22 -5.393 -2.062 -7.876 164 2HG2 ILE 22 HG22 ILE 22 -4.710 -0.934 -6.690 165 3HG2 ILE 22 HG23 ILE 22 -3.736 -2.264 -7.321 166 1HD1 ILE 22 HD11 ILE 22 -2.454 -2.081 -5.407 167 2HD1 ILE 22 HD12 ILE 22 -2.333 -3.076 -3.939 168 3HD1 ILE 22 HD13 ILE 22 -2.702 -3.837 -5.490 169 H GLU 23 H GLU 23 -7.218 -5.121 -5.434 170 HA GLU 23 HA GLU 23 -8.019 -5.150 -2.604 171 1HB GLU 23 HB2 GLU 23 -10.063 -4.843 -3.907 172 2HB GLU 23 HB3 GLU 23 -9.643 -6.223 -4.944 173 1HG GLU 23 HG2 GLU 23 -9.807 -7.738 -2.989 174 2HG GLU 23 HG3 GLU 23 -10.132 -6.362 -1.933 175 H LYS 24 H LYS 24 -7.394 -7.180 -1.669 176 HA LYS 24 HA LYS 24 -5.152 -8.440 -2.661 177 1HB LYS 24 HB2 LYS 24 -6.097 -8.590 -0.342 178 2HB LYS 24 HB3 LYS 24 -7.297 -9.749 -0.931 179 1HG LYS 24 HG2 LYS 24 -5.443 -11.285 -1.620 180 2HG LYS 24 HG3 LYS 24 -4.269 -10.105 -1.024 181 1HD LYS 24 HD2 LYS 24 -5.365 -10.320 1.283 182 2HD LYS 24 HD3 LYS 24 -6.382 -11.591 0.595 183 1HE LYS 24 HE2 LYS 24 -4.681 -12.821 1.595 184 2HE LYS 24 HE3 LYS 24 -4.174 -12.761 -0.095 185 1HZ LYS 24 HZ1 LYS 24 -2.702 -10.857 0.575 186 2HZ LYS 24 HZ2 LYS 24 -3.126 -11.111 2.132 187 3HZ LYS 24 HZ3 LYS 24 -2.321 -12.267 1.319 188 H GLY 25 H GLY 25 -4.734 -9.707 -4.411 189 1HA GLY 25 HA2 GLY 25 -5.004 -11.605 -5.737 190 2HA GLY 25 HA3 GLY 25 -6.709 -11.715 -5.301 191 H GLN 26 H GLN 26 -6.493 -8.493 -6.069 192 HA GLN 26 HA GLN 26 -7.567 -8.734 -8.719 193 1HB GLN 26 HB2 GLN 26 -7.919 -6.855 -7.044 194 2HB GLN 26 HB3 GLN 26 -6.251 -6.327 -7.374 195 1HG GLN 26 HG2 GLN 26 -6.867 -5.919 -9.735 196 2HG GLN 26 HG3 GLN 26 -8.503 -6.512 -9.433 197 1HE2 GLN 26 HE22 GLN 26 -6.667 -3.689 -9.643 198 2HE2 GLN 26 HE21 GLN 26 -7.661 -2.628 -8.656 199 H GLU 27 H GLU 27 -6.450 -8.690 -10.689 200 HA GLU 27 HA GLU 27 -3.562 -9.023 -10.746 201 1HB GLU 27 HB2 GLU 27 -5.169 -10.053 -12.365 202 2HB GLU 27 HB3 GLU 27 -5.573 -8.440 -12.965 203 1HG GLU 27 HG2 GLU 27 -3.179 -8.146 -13.654 204 2HG GLU 27 HG3 GLU 27 -2.827 -9.770 -13.062 205 H VAL 28 H VAL 28 -2.047 -7.425 -10.973 206 HA VAL 28 HA VAL 28 -2.939 -4.620 -11.462 207 HB VAL 28 HB VAL 28 -1.273 -3.958 -9.681 208 1HG1 VAL 28 HG11 VAL 28 -3.660 -5.597 -8.715 209 2HG1 VAL 28 HG12 VAL 28 -2.810 -4.327 -7.819 210 3HG1 VAL 28 HG13 VAL 28 -3.725 -3.921 -9.286 211 1HG2 VAL 28 HG21 VAL 28 -0.690 -5.538 -7.930 212 2HG2 VAL 28 HG22 VAL 28 -1.533 -6.841 -8.779 213 3HG2 VAL 28 HG23 VAL 28 -0.056 -6.137 -9.475 214 H ALA 29 H ALA 29 -0.528 -7.142 -12.040 215 HA ALA 29 HA ALA 29 0.405 -5.554 -14.276 216 1HB ALA 29 HB1 ALA 29 1.971 -4.703 -12.583 217 2HB ALA 29 HB2 ALA 29 2.367 -6.340 -12.044 218 3HB ALA 29 HB3 ALA 29 2.831 -5.806 -13.660 219 H ILE 30 H ILE 30 2.196 -6.951 -15.414 220 HA ILE 30 HA ILE 30 1.793 -9.852 -15.046 221 HB ILE 30 HB ILE 30 1.490 -8.383 -17.702 222 1HG1 ILE 30 HG12 ILE 30 -0.515 -10.252 -16.370 223 2HG1 ILE 30 HG13 ILE 30 -0.576 -8.505 -16.213 224 1HG2 ILE 30 HG21 ILE 30 1.246 -10.653 -18.726 225 2HG2 ILE 30 HG22 ILE 30 2.828 -10.466 -18.007 226 3HG2 ILE 30 HG23 ILE 30 1.580 -11.390 -17.147 227 1HD1 ILE 30 HD11 ILE 30 -2.130 -9.151 -17.911 228 2HD1 ILE 30 HD12 ILE 30 -0.811 -8.239 -18.661 229 3HD1 ILE 30 HD13 ILE 30 -0.886 -10.014 -18.824 230 H LEU 31 H LEU 31 3.706 -10.914 -15.456 231 HA LEU 31 HA LEU 31 6.151 -9.259 -15.936 232 1HB LEU 31 HB2 LEU 31 5.890 -9.814 -13.642 233 2HB LEU 31 HB3 LEU 31 5.441 -11.487 -13.981 234 HG LEU 31 HG LEU 31 7.654 -11.049 -12.925 235 1HD1 LEU 31 HD11 LEU 31 8.858 -12.759 -14.080 236 2HD1 LEU 31 HD12 LEU 31 7.139 -13.184 -14.030 237 3HD1 LEU 31 HD13 LEU 31 7.859 -12.591 -15.531 238 1HD2 LEU 31 HD21 LEU 31 8.164 -9.071 -14.486 239 2HD2 LEU 31 HD22 LEU 31 9.476 -10.188 -14.058 240 3HD2 LEU 31 HD23 LEU 31 8.695 -10.296 -15.650 241 H GLU 32 H GLU 32 7.464 -10.015 -17.554 242 HA GLU 32 HA GLU 32 6.824 -12.609 -18.851 243 1HB GLU 32 HB2 GLU 32 6.793 -10.582 -20.284 244 2HB GLU 32 HB3 GLU 32 8.455 -10.216 -19.808 245 1HG GLU 32 HG2 GLU 32 9.147 -12.458 -20.769 246 2HG GLU 32 HG3 GLU 32 7.491 -12.674 -21.333 247 H SER 33 H SER 33 8.197 -14.251 -18.389 248 HA SER 33 HA SER 33 11.011 -13.978 -18.162 249 1HB SER 33 HB2 SER 33 10.244 -13.147 -15.842 250 2HB SER 33 HB3 SER 33 9.655 -14.787 -15.547 251 HG SER 33 HG SER 33 11.882 -14.094 -14.901 252 H MET 34 H MET 34 11.924 -16.239 -17.610 253 HA MET 34 HA MET 34 12.028 -18.453 -18.135 254 1HB MET 34 HB2 MET 34 9.272 -18.469 -16.843 255 2HB MET 34 HB3 MET 34 10.347 -19.855 -17.001 256 1HG MET 34 HG2 MET 34 11.949 -18.935 -15.495 257 2HG MET 34 HG3 MET 34 11.169 -17.357 -15.472 258 1HE MET 34 HE1 MET 34 8.111 -17.704 -13.201 259 2HE MET 34 HE2 MET 34 9.258 -16.605 -13.994 260 3HE MET 34 HE3 MET 34 8.182 -17.627 -14.972 261 H LYS 35 H LYS 35 11.052 -16.790 -20.292 262 HA LYS 35 HA LYS 35 9.986 -16.752 -22.274 263 1HB LYS 35 HB2 LYS 35 10.242 -19.781 -22.202 264 2HB LYS 35 HB3 LYS 35 10.013 -18.783 -23.631 265 1HG LYS 35 HG2 LYS 35 12.484 -18.792 -21.848 266 2HG LYS 35 HG3 LYS 35 12.317 -19.557 -23.426 267 1HD LYS 35 HD2 LYS 35 11.928 -17.316 -24.465 268 2HD LYS 35 HD3 LYS 35 12.206 -16.557 -22.879 269 1HE LYS 35 HE2 LYS 35 14.470 -17.566 -22.789 270 2HE LYS 35 HE3 LYS 35 14.199 -18.326 -24.362 271 1HZ LYS 35 HZ1 LYS 35 14.024 -16.108 -25.332 272 2HZ LYS 35 HZ2 LYS 35 14.277 -15.403 -23.878 273 3HZ LYS 35 HZ3 LYS 35 15.455 -16.282 -24.577 274 H MET 36 H MET 36 8.261 -16.651 -19.999 275 HA MET 36 HA MET 36 5.695 -17.438 -21.227 276 1HB MET 36 HB2 MET 36 6.632 -18.073 -18.387 277 2HB MET 36 HB3 MET 36 4.947 -18.146 -18.903 278 1HG MET 36 HG2 MET 36 5.516 -19.851 -20.591 279 2HG MET 36 HG3 MET 36 7.186 -19.858 -20.029 280 1HE MET 36 HE1 MET 36 6.997 -19.740 -16.840 281 2HE MET 36 HE2 MET 36 6.983 -21.481 -16.496 282 3HE MET 36 HE3 MET 36 8.031 -20.842 -17.780 283 H GLU 37 H GLU 37 3.921 -16.367 -19.784 284 HA GLU 37 HA GLU 37 4.829 -13.779 -18.655 285 1HB GLU 37 HB2 GLU 37 2.235 -14.256 -20.184 286 2HB GLU 37 HB3 GLU 37 2.688 -12.804 -19.303 287 1HG GLU 37 HG2 GLU 37 3.136 -12.227 -21.498 288 2HG GLU 37 HG3 GLU 37 4.723 -12.611 -20.845 289 H ILE 38 H ILE 38 3.917 -13.348 -16.663 290 HA ILE 38 HA ILE 38 2.275 -15.469 -15.384 291 HB ILE 38 HB ILE 38 4.799 -14.119 -14.299 292 1HG1 ILE 38 HG12 ILE 38 5.447 -16.745 -14.239 293 2HG1 ILE 38 HG13 ILE 38 4.369 -16.801 -15.620 294 1HG2 ILE 38 HG21 ILE 38 4.564 -15.698 -12.410 295 2HG2 ILE 38 HG22 ILE 38 3.191 -14.608 -12.513 296 3HG2 ILE 38 HG23 ILE 38 3.032 -16.287 -13.085 297 1HD1 ILE 38 HD11 ILE 38 6.920 -15.159 -15.287 298 2HD1 ILE 38 HD12 ILE 38 6.653 -16.527 -16.380 299 3HD1 ILE 38 HD13 ILE 38 5.851 -14.983 -16.687 300 HA PRO 39 HA PRO 39 0.170 -11.618 -14.307 301 1HB PRO 39 HB2 PRO 39 -1.727 -12.548 -12.566 302 2HB PRO 39 HB3 PRO 39 -1.807 -12.823 -14.334 303 1HG PRO 39 HG2 PRO 39 -0.774 -14.719 -12.208 304 2HG PRO 39 HG3 PRO 39 -1.912 -15.070 -13.547 305 1HD PRO 39 HD2 PRO 39 0.760 -15.616 -13.715 306 2HD PRO 39 HD3 PRO 39 -0.175 -15.075 -15.143 307 H ILE 40 H ILE 40 0.256 -10.129 -12.618 308 HA ILE 40 HA ILE 40 1.569 -10.936 -10.063 309 HB ILE 40 HB ILE 40 1.853 -8.400 -11.686 310 1HG1 ILE 40 HG12 ILE 40 3.186 -10.146 -12.699 311 2HG1 ILE 40 HG13 ILE 40 4.172 -8.868 -12.016 312 1HG2 ILE 40 HG21 ILE 40 3.058 -9.048 -8.981 313 2HG2 ILE 40 HG22 ILE 40 3.523 -7.669 -9.994 314 3HG2 ILE 40 HG23 ILE 40 1.881 -7.782 -9.356 315 1HD1 ILE 40 HD11 ILE 40 3.691 -11.584 -10.713 316 2HD1 ILE 40 HD12 ILE 40 5.138 -11.066 -11.589 317 3HD1 ILE 40 HD13 ILE 40 4.716 -10.281 -10.063 318 H VAL 41 H VAL 41 0.213 -10.647 -8.430 319 HA VAL 41 HA VAL 41 -2.244 -9.045 -8.845 320 HB VAL 41 HB VAL 41 -3.220 -10.660 -7.141 321 1HG1 VAL 41 HG11 VAL 41 -2.413 -11.749 -9.865 322 2HG1 VAL 41 HG12 VAL 41 -3.679 -12.419 -8.804 323 3HG1 VAL 41 HG13 VAL 41 -3.864 -10.798 -9.455 324 1HG2 VAL 41 HG21 VAL 41 -0.875 -12.441 -7.923 325 2HG2 VAL 41 HG22 VAL 41 -1.059 -11.646 -6.337 326 3HG2 VAL 41 HG23 VAL 41 -2.240 -12.850 -6.873 327 H ALA 42 H ALA 42 -3.178 -8.061 -7.020 328 HA ALA 42 HA ALA 42 -1.434 -6.600 -5.324 329 1HB ALA 42 HB1 ALA 42 -3.693 -5.870 -6.064 330 2HB ALA 42 HB2 ALA 42 -4.408 -7.191 -5.131 331 3HB ALA 42 HB3 ALA 42 -3.564 -5.880 -4.290 332 H ASP 43 H ASP 43 -0.285 -7.500 -3.663 333 HA ASP 43 HA ASP 43 -0.926 -9.975 -2.377 334 1HB ASP 43 HB2 ASP 43 1.353 -9.054 -2.478 335 2HB ASP 43 HB3 ASP 43 0.859 -7.672 -1.493 336 H ARG 44 H ARG 44 -2.055 -6.709 -1.852 337 HA ARG 44 HA ARG 44 -3.924 -7.591 0.182 338 1HB ARG 44 HB2 ARG 44 -3.319 -5.762 1.757 339 2HB ARG 44 HB3 ARG 44 -2.099 -7.023 1.684 340 1HG ARG 44 HG2 ARG 44 -0.541 -5.691 0.542 341 2HG ARG 44 HG3 ARG 44 -1.758 -4.578 -0.083 342 1HD ARG 44 HD2 ARG 44 -1.006 -4.781 2.847 343 2HD ARG 44 HD3 ARG 44 -0.330 -3.603 1.702 344 HE ARG 44 HE ARG 44 -3.009 -3.238 1.355 345 1HH1 ARG 44 HH21 ARG 44 -1.061 -3.161 4.346 346 2HH1 ARG 44 HH22 ARG 44 -2.236 -2.205 5.191 347 1HH2 ARG 44 HH11 ARG 44 -4.482 -2.051 2.465 348 2HH2 ARG 44 HH12 ARG 44 -4.205 -1.584 4.140 349 H SER 45 H SER 45 -5.563 -5.863 0.544 350 HA SER 45 HA SER 45 -6.143 -4.342 -1.834 351 1HB SER 45 HB2 SER 45 -7.426 -4.224 0.924 352 2HB SER 45 HB3 SER 45 -8.183 -3.813 -0.625 353 HG SER 45 HG SER 45 -8.695 -5.948 0.257 354 H GLY 46 H GLY 46 -6.424 -1.989 -1.920 355 1HA GLY 46 HA2 GLY 46 -6.236 -0.187 0.113 356 2HA GLY 46 HA3 GLY 46 -4.542 -0.414 -0.338 357 H ILE 47 H ILE 47 -5.357 2.055 -0.645 358 HA ILE 47 HA ILE 47 -6.106 2.522 -3.476 359 HB ILE 47 HB ILE 47 -5.510 4.363 -1.125 360 1HG1 ILE 47 HG12 ILE 47 -7.758 3.332 -1.094 361 2HG1 ILE 47 HG13 ILE 47 -7.796 5.079 -1.257 362 1HG2 ILE 47 HG21 ILE 47 -6.147 6.265 -2.640 363 2HG2 ILE 47 HG22 ILE 47 -4.596 5.517 -3.021 364 3HG2 ILE 47 HG23 ILE 47 -6.017 5.151 -4.020 365 1HD1 ILE 47 HD11 ILE 47 -8.237 3.103 -3.539 366 2HD1 ILE 47 HD12 ILE 47 -9.485 4.018 -2.678 367 3HD1 ILE 47 HD13 ILE 47 -8.307 4.874 -3.675 368 H VAL 48 H VAL 48 -4.551 2.937 -4.971 369 HA VAL 48 HA VAL 48 -1.768 2.325 -4.425 370 HB VAL 48 HB VAL 48 -3.038 3.484 -6.910 371 1HG1 VAL 48 HG11 VAL 48 -0.460 1.877 -6.490 372 2HG1 VAL 48 HG12 VAL 48 -1.096 2.478 -8.037 373 3HG1 VAL 48 HG13 VAL 48 -0.532 3.622 -6.814 374 1HG2 VAL 48 HG21 VAL 48 -3.066 1.144 -7.733 375 2HG2 VAL 48 HG22 VAL 48 -2.587 0.569 -6.115 376 3HG2 VAL 48 HG23 VAL 48 -4.157 1.364 -6.372 377 H LYS 49 H LYS 49 -0.707 3.730 -3.135 378 HA LYS 49 HA LYS 49 -1.209 6.611 -3.173 379 1HB LYS 49 HB2 LYS 49 -0.609 5.472 -1.108 380 2HB LYS 49 HB3 LYS 49 0.909 4.889 -1.810 381 1HG LYS 49 HG2 LYS 49 1.751 7.178 -1.967 382 2HG LYS 49 HG3 LYS 49 0.199 7.825 -1.387 383 1HD LYS 49 HD2 LYS 49 0.472 6.682 0.761 384 2HD LYS 49 HD3 LYS 49 1.951 5.895 0.213 385 1HE LYS 49 HE2 LYS 49 1.565 8.904 0.590 386 2HE LYS 49 HE3 LYS 49 2.384 7.810 1.711 387 1HZ LYS 49 HZ1 LYS 49 4.050 8.821 0.423 388 2HZ LYS 49 HZ2 LYS 49 3.937 7.287 -0.168 389 3HZ LYS 49 HZ3 LYS 49 3.293 8.546 -0.995 390 H GLU 50 H GLU 50 1.252 4.283 -4.474 391 HA GLU 50 HA GLU 50 1.910 6.244 -6.532 392 1HB GLU 50 HB2 GLU 50 3.344 6.797 -4.430 393 2HB GLU 50 HB3 GLU 50 4.204 5.292 -4.764 394 1HG GLU 50 HG2 GLU 50 4.927 6.138 -6.934 395 2HG GLU 50 HG3 GLU 50 3.865 7.542 -6.793 396 H VAL 51 H VAL 51 3.495 5.224 -8.136 397 HA VAL 51 HA VAL 51 3.520 2.256 -8.048 398 HB VAL 51 HB VAL 51 3.027 3.903 -10.566 399 1HG1 VAL 51 HG11 VAL 51 2.808 0.900 -10.008 400 2HG1 VAL 51 HG12 VAL 51 2.430 1.701 -11.547 401 3HG1 VAL 51 HG13 VAL 51 4.087 1.693 -10.951 402 1HG2 VAL 51 HG21 VAL 51 0.701 2.999 -10.516 403 2HG2 VAL 51 HG22 VAL 51 1.013 2.374 -8.882 404 3HG2 VAL 51 HG23 VAL 51 1.008 4.131 -9.196 405 H LYS 52 H LYS 52 5.525 1.444 -8.565 406 HA LYS 52 HA LYS 52 7.698 3.489 -8.675 407 1HB LYS 52 HB2 LYS 52 7.720 0.576 -7.790 408 2HB LYS 52 HB3 LYS 52 9.044 1.723 -7.604 409 1HG LYS 52 HG2 LYS 52 6.360 1.802 -6.164 410 2HG LYS 52 HG3 LYS 52 7.920 1.308 -5.508 411 1HD LYS 52 HD2 LYS 52 8.802 3.610 -5.836 412 2HD LYS 52 HD3 LYS 52 7.181 4.131 -6.383 413 1HE LYS 52 HE2 LYS 52 6.190 3.460 -4.276 414 2HE LYS 52 HE3 LYS 52 7.706 2.738 -3.720 415 1HZ LYS 52 HZ1 LYS 52 8.664 4.945 -3.631 416 2HZ LYS 52 HZ2 LYS 52 7.280 5.631 -4.211 417 3HZ LYS 52 HZ3 LYS 52 7.277 4.880 -2.743 418 H LYS 53 H LYS 53 6.143 1.572 -10.889 419 HA LYS 53 HA LYS 53 8.577 0.962 -12.473 420 1HB LYS 53 HB2 LYS 53 6.365 -0.982 -11.642 421 2HB LYS 53 HB3 LYS 53 7.554 -1.311 -12.890 422 1HG LYS 53 HG2 LYS 53 8.283 -0.813 -9.989 423 2HG LYS 53 HG3 LYS 53 8.057 -2.408 -10.717 424 1HD LYS 53 HD2 LYS 53 9.835 -1.932 -12.361 425 2HD LYS 53 HD3 LYS 53 10.105 -0.339 -11.621 426 1HE LYS 53 HE2 LYS 53 10.812 -1.362 -9.525 427 2HE LYS 53 HE3 LYS 53 10.420 -2.968 -10.119 428 1HZ LYS 53 HZ1 LYS 53 12.703 -2.668 -10.401 429 2HZ LYS 53 HZ2 LYS 53 12.094 -2.576 -11.916 430 3HZ LYS 53 HZ3 LYS 53 12.549 -1.194 -11.155 431 H LYS 54 H LYS 54 7.708 -0.141 -14.633 432 HA LYS 54 HA LYS 54 5.226 0.985 -15.627 433 1HB LYS 54 HB2 LYS 54 6.237 2.203 -17.467 434 2HB LYS 54 HB3 LYS 54 6.792 2.901 -15.948 435 1HG LYS 54 HG2 LYS 54 8.978 1.804 -16.174 436 2HG LYS 54 HG3 LYS 54 8.420 0.888 -17.565 437 1HD LYS 54 HD2 LYS 54 7.960 3.272 -18.638 438 2HD LYS 54 HD3 LYS 54 9.061 3.826 -17.373 439 1HE LYS 54 HE2 LYS 54 10.457 3.416 -19.241 440 2HE LYS 54 HE3 LYS 54 10.698 2.018 -18.190 441 1HZ LYS 54 HZ1 LYS 54 9.026 0.838 -19.639 442 2HZ LYS 54 HZ2 LYS 54 9.016 2.136 -20.629 443 3HZ LYS 54 HZ3 LYS 54 10.389 1.286 -20.440 444 H GLU 55 H GLU 55 4.943 0.220 -17.930 445 HA GLU 55 HA GLU 55 5.511 -2.528 -18.308 446 1HB GLU 55 HB2 GLU 55 5.005 -0.488 -20.519 447 2HB GLU 55 HB3 GLU 55 4.714 -2.222 -20.549 448 1HG GLU 55 HG2 GLU 55 2.578 -1.569 -20.180 449 2HG GLU 55 HG3 GLU 55 3.083 -1.642 -18.498 450 H GLY 56 H GLY 56 7.180 -3.609 -19.352 451 1HA GLY 56 HA2 GLY 56 9.030 -3.974 -20.599 452 2HA GLY 56 HA3 GLY 56 9.124 -2.254 -21.003 453 H ASP 57 H ASP 57 8.988 -2.160 -17.660 454 HA ASP 57 HA ASP 57 11.856 -1.695 -17.550 455 1HB ASP 57 HB2 ASP 57 10.181 -0.309 -16.309 456 2HB ASP 57 HB3 ASP 57 9.879 -1.691 -15.246 457 H PHE 58 H PHE 58 13.283 -2.677 -16.028 458 HA PHE 58 HA PHE 58 13.140 -5.601 -15.889 459 1HB PHE 58 HB2 PHE 58 15.292 -4.543 -16.249 460 2HB PHE 58 HB3 PHE 58 15.061 -3.484 -14.866 461 HD1 PHE 58 HD1 PHE 58 15.612 -4.168 -12.625 462 HD2 PHE 58 HD2 PHE 58 15.748 -7.019 -15.864 463 HE1 PHE 58 HE1 PHE 58 16.853 -5.757 -11.180 464 HE2 PHE 58 HE2 PHE 58 16.986 -8.602 -14.413 465 HZ PHE 58 HZ PHE 58 17.572 -7.961 -12.081 466 H VAL 59 H VAL 59 12.834 -6.830 -13.997 467 HA VAL 59 HA VAL 59 12.306 -5.461 -11.467 468 HB VAL 59 HB VAL 59 10.213 -6.872 -11.171 469 1HG1 VAL 59 HG11 VAL 59 10.179 -4.435 -11.455 470 2HG1 VAL 59 HG12 VAL 59 9.997 -4.632 -13.218 471 3HG1 VAL 59 HG13 VAL 59 8.740 -5.211 -12.112 472 1HG2 VAL 59 HG21 VAL 59 10.483 -8.328 -13.163 473 2HG2 VAL 59 HG22 VAL 59 8.917 -7.491 -13.114 474 3HG2 VAL 59 HG23 VAL 59 10.181 -6.928 -14.219 475 H ASN 60 H ASN 60 12.079 -7.032 -9.682 476 HA ASN 60 HA ASN 60 13.415 -9.576 -10.170 477 1HB ASN 60 HB2 ASN 60 14.975 -7.382 -9.501 478 2HB ASN 60 HB3 ASN 60 14.629 -8.093 -7.922 479 1HD2 ASN 60 HD22 ASN 60 15.514 -9.043 -11.292 480 2HD2 ASN 60 HD21 ASN 60 16.639 -10.305 -10.826 481 H GLU 61 H GLU 61 13.640 -10.817 -8.078 482 HA GLU 61 HA GLU 61 11.071 -11.109 -6.847 483 1HB GLU 61 HB2 GLU 61 12.602 -12.962 -7.137 484 2HB GLU 61 HB3 GLU 61 13.865 -12.155 -6.222 485 1HG GLU 61 HG2 GLU 61 12.405 -12.267 -4.171 486 2HG GLU 61 HG3 GLU 61 11.169 -13.092 -5.117 487 H GLY 62 H GLY 62 10.215 -9.610 -5.535 488 1HA GLY 62 HA2 GLY 62 9.984 -8.484 -3.530 489 2HA GLY 62 HA3 GLY 62 11.722 -8.596 -3.219 490 H ASP 63 H ASP 63 11.116 -7.492 -6.469 491 HA ASP 63 HA ASP 63 12.008 -4.797 -5.757 492 1HB ASP 63 HB2 ASP 63 12.785 -6.150 -7.775 493 2HB ASP 63 HB3 ASP 63 11.184 -5.890 -8.472 494 H VAL 64 H VAL 64 10.605 -3.103 -5.487 495 HA VAL 64 HA VAL 64 7.879 -3.719 -5.016 496 HB VAL 64 HB VAL 64 9.248 -1.003 -5.160 497 1HG1 VAL 64 HG11 VAL 64 6.808 -0.766 -5.161 498 2HG1 VAL 64 HG12 VAL 64 6.662 -1.902 -3.811 499 3HG1 VAL 64 HG13 VAL 64 7.434 -0.316 -3.577 500 1HG2 VAL 64 HG21 VAL 64 8.843 -2.903 -2.802 501 2HG2 VAL 64 HG22 VAL 64 10.402 -2.446 -3.523 502 3HG2 VAL 64 HG23 VAL 64 9.441 -1.234 -2.682 503 H LEU 65 H LEU 65 6.094 -3.493 -6.192 504 HA LEU 65 HA LEU 65 6.187 -2.508 -8.985 505 1HB LEU 65 HB2 LEU 65 4.932 -4.628 -8.545 506 2HB LEU 65 HB3 LEU 65 3.988 -3.822 -7.306 507 HG LEU 65 HG LEU 65 2.995 -2.317 -9.033 508 1HD1 LEU 65 HD11 LEU 65 4.773 -2.328 -10.729 509 2HD1 LEU 65 HD12 LEU 65 4.523 -4.067 -11.015 510 3HD1 LEU 65 HD13 LEU 65 3.259 -2.889 -11.428 511 1HD2 LEU 65 HD21 LEU 65 1.551 -4.005 -10.055 512 2HD2 LEU 65 HD22 LEU 65 2.714 -5.284 -9.636 513 3HD2 LEU 65 HD23 LEU 65 1.862 -4.394 -8.356 514 H LEU 66 H LEU 66 4.527 -1.989 -5.782 515 HA LEU 66 HA LEU 66 4.085 0.832 -6.457 516 1HB LEU 66 HB2 LEU 66 1.653 0.717 -6.410 517 2HB LEU 66 HB3 LEU 66 2.309 -0.257 -7.699 518 HG LEU 66 HG LEU 66 2.001 -2.281 -6.131 519 1HD1 LEU 66 HD11 LEU 66 0.042 -1.970 -4.525 520 2HD1 LEU 66 HD12 LEU 66 1.553 -1.274 -3.972 521 3HD1 LEU 66 HD13 LEU 66 0.305 -0.218 -4.672 522 1HD2 LEU 66 HD21 LEU 66 -0.432 -0.794 -7.158 523 2HD2 LEU 66 HD22 LEU 66 0.613 -1.911 -8.081 524 3HD2 LEU 66 HD23 LEU 66 -0.363 -2.528 -6.755 525 H GLU 67 H GLU 67 2.689 1.892 -4.770 526 HA GLU 67 HA GLU 67 3.346 0.916 -2.039 527 1HB GLU 67 HB2 GLU 67 4.987 2.595 -2.892 528 2HB GLU 67 HB3 GLU 67 3.659 3.730 -3.173 529 1HG GLU 67 HG2 GLU 67 3.166 3.681 -0.714 530 2HG GLU 67 HG3 GLU 67 4.559 2.613 -0.488 531 H LEU 68 H LEU 68 1.718 1.534 -0.492 532 HA LEU 68 HA LEU 68 -0.883 2.313 -1.723 533 1HB LEU 68 HB2 LEU 68 -0.296 0.164 0.360 534 2HB LEU 68 HB3 LEU 68 -1.905 0.695 -0.103 535 HG LEU 68 HG LEU 68 0.075 -0.703 -1.937 536 1HD1 LEU 68 HD11 LEU 68 -2.520 -1.683 -0.678 537 2HD1 LEU 68 HD12 LEU 68 -1.495 -2.588 -1.809 538 3HD1 LEU 68 HD13 LEU 68 -0.874 -2.169 -0.204 539 1HD2 LEU 68 HD21 LEU 68 -1.880 -0.860 -3.489 540 2HD2 LEU 68 HD22 LEU 68 -2.799 0.210 -2.416 541 3HD2 LEU 68 HD23 LEU 68 -1.319 0.775 -3.231 542 H SER 69 H SER 69 -2.341 3.404 -0.428 543 HA SER 69 HA SER 69 -1.377 5.010 1.758 544 1HB SER 69 HB2 SER 69 -4.229 4.319 0.932 545 2HB SER 69 HB3 SER 69 -3.710 5.706 1.910 546 HG SER 69 HG SER 69 -4.009 6.317 -0.256 547 H ASN 70 H ASN 70 -2.386 4.901 3.979 548 HA ASN 70 HA ASN 70 -2.162 2.339 5.224 549 1HB ASN 70 HB2 ASN 70 -1.885 4.458 6.463 550 2HB ASN 70 HB3 ASN 70 -3.577 4.875 6.158 551 1HD2 ASN 70 HD22 ASN 70 -4.983 4.352 7.812 552 2HD2 ASN 70 HD21 ASN 70 -4.740 3.076 8.974 553 H SER 71 H SER 71 -3.808 0.938 6.059 554 HA SER 71 HA SER 71 -5.874 0.296 4.342 555 1HB SER 71 HB2 SER 71 -5.686 -0.374 7.301 556 2HB SER 71 HB3 SER 71 -6.442 -1.347 6.023 557 HG SER 71 HG SER 71 -4.272 -1.986 6.672 558 H THR 72 H THR 72 -5.985 2.719 6.883 559 HA THR 72 HA THR 72 -8.861 3.177 6.335 560 HB THR 72 HB THR 72 -8.929 3.927 8.804 561 HG1 THR 72 HG1 THR 72 -7.441 3.007 10.159 562 1HG2 THR 72 HG21 THR 72 -9.475 1.683 9.615 563 2HG2 THR 72 HG22 THR 72 -10.070 1.880 7.960 564 3HG2 THR 72 HG23 THR 72 -8.593 0.938 8.263 565 H GLN 73 H GLN 73 -9.427 5.408 6.304 566 HA GLN 73 HA GLN 73 -7.320 7.433 6.548 567 1HB GLN 73 HB2 GLN 73 -8.842 6.898 3.946 568 2HB GLN 73 HB3 GLN 73 -7.874 8.331 4.289 569 1HG GLN 73 HG2 GLN 73 -5.848 6.869 4.544 570 2HG GLN 73 HG3 GLN 73 -6.827 5.477 4.063 571 1HE2 GLN 73 HE22 GLN 73 -5.454 8.578 2.928 572 2HE2 GLN 73 HE21 GLN 73 -5.627 8.235 1.227 Start of MODEL 18 1 1H THR 2 H1 THR 2 3.612 -2.879 1.202 2 2H THR 2 H2 THR 2 3.367 -1.267 1.058 3 3H THR 2 H3 THR 2 2.170 -2.330 0.641 4 HA THR 2 HA THR 2 3.308 -1.436 -1.333 5 HB THR 2 HB THR 2 5.672 -2.615 -1.589 6 HG1 THR 2 HG1 THR 2 6.762 -2.825 0.314 7 1HG2 THR 2 HG21 THR 2 5.381 -0.187 -1.678 8 2HG2 THR 2 HG22 THR 2 5.317 -0.098 0.100 9 3HG2 THR 2 HG23 THR 2 6.803 -0.608 -0.725 10 H VAL 3 H VAL 3 3.794 -2.881 -3.261 11 HA VAL 3 HA VAL 3 3.254 -5.755 -2.800 12 HB VAL 3 HB VAL 3 1.909 -4.028 -4.924 13 1HG1 VAL 3 HG11 VAL 3 1.731 -7.040 -4.493 14 2HG1 VAL 3 HG12 VAL 3 0.781 -6.086 -5.662 15 3HG1 VAL 3 HG13 VAL 3 2.517 -6.219 -5.856 16 1HG2 VAL 3 HG21 VAL 3 0.731 -3.806 -2.785 17 2HG2 VAL 3 HG22 VAL 3 -0.234 -4.768 -3.899 18 3HG2 VAL 3 HG23 VAL 3 0.683 -5.568 -2.596 19 H SER 4 H SER 4 4.654 -6.966 -4.123 20 HA SER 4 HA SER 4 6.608 -5.474 -5.802 21 1HB SER 4 HB2 SER 4 7.204 -7.483 -3.593 22 2HB SER 4 HB3 SER 4 8.395 -6.632 -4.578 23 HG SER 4 HG SER 4 8.040 -5.682 -2.487 24 H ILE 5 H ILE 5 7.857 -6.817 -7.201 25 HA ILE 5 HA ILE 5 6.324 -8.987 -8.406 26 HB ILE 5 HB ILE 5 9.149 -7.973 -9.008 27 1HG1 ILE 5 HG12 ILE 5 7.821 -7.100 -11.133 28 2HG1 ILE 5 HG13 ILE 5 6.422 -7.128 -10.073 29 1HG2 ILE 5 HG21 ILE 5 8.657 -10.275 -9.872 30 2HG2 ILE 5 HG22 ILE 5 7.247 -9.628 -10.734 31 3HG2 ILE 5 HG23 ILE 5 8.893 -9.113 -11.157 32 1HD1 ILE 5 HD11 ILE 5 7.510 -5.451 -8.618 33 2HD1 ILE 5 HD12 ILE 5 9.010 -5.578 -9.561 34 3HD1 ILE 5 HD13 ILE 5 7.539 -4.911 -10.293 35 H GLN 6 H GLN 6 6.851 -11.222 -8.234 36 HA GLN 6 HA GLN 6 8.418 -11.849 -5.792 37 1HB GLN 6 HB2 GLN 6 6.478 -13.696 -7.209 38 2HB GLN 6 HB3 GLN 6 7.095 -13.785 -5.568 39 1HG GLN 6 HG2 GLN 6 5.031 -12.973 -5.085 40 2HG GLN 6 HG3 GLN 6 5.861 -11.436 -5.280 41 1HE2 GLN 6 HE22 GLN 6 4.675 -9.979 -6.585 42 2HE2 GLN 6 HE21 GLN 6 3.580 -10.493 -7.857 43 H MET 7 H MET 7 9.331 -11.705 -8.924 44 HA MET 7 HA MET 7 11.252 -13.865 -8.707 45 1HB MET 7 HB2 MET 7 10.560 -15.106 -10.653 46 2HB MET 7 HB3 MET 7 9.204 -15.030 -9.539 47 1HG MET 7 HG2 MET 7 8.630 -12.854 -11.085 48 2HG MET 7 HG3 MET 7 9.558 -13.813 -12.232 49 1HE MET 7 HE1 MET 7 6.152 -12.870 -11.321 50 2HE MET 7 HE2 MET 7 5.239 -14.326 -10.902 51 3HE MET 7 HE3 MET 7 6.487 -13.720 -9.795 52 H ALA 8 H ALA 8 12.750 -13.786 -10.657 53 HA ALA 8 HA ALA 8 13.287 -11.016 -11.444 54 1HB ALA 8 HB1 ALA 8 15.264 -11.997 -12.515 55 2HB ALA 8 HB2 ALA 8 15.111 -12.566 -10.834 56 3HB ALA 8 HB3 ALA 8 14.652 -13.632 -12.187 57 H GLY 9 H GLY 9 12.978 -10.085 -13.479 58 1HA GLY 9 HA2 GLY 9 12.679 -11.485 -15.884 59 2HA GLY 9 HA3 GLY 9 11.052 -11.306 -15.229 60 H ASN 10 H ASN 10 10.403 -9.906 -16.906 61 HA ASN 10 HA ASN 10 11.323 -7.087 -16.604 62 1HB ASN 10 HB2 ASN 10 11.129 -8.702 -19.157 63 2HB ASN 10 HB3 ASN 10 10.622 -7.017 -19.162 64 1HD2 ASN 10 HD22 ASN 10 13.392 -8.099 -17.105 65 2HD2 ASN 10 HD21 ASN 10 14.592 -7.320 -18.115 66 H LEU 11 H LEU 11 9.604 -5.729 -16.419 67 HA LEU 11 HA LEU 11 7.110 -7.007 -15.731 68 1HB LEU 11 HB2 LEU 11 8.343 -5.019 -14.609 69 2HB LEU 11 HB3 LEU 11 7.712 -4.021 -15.903 70 HG LEU 11 HG LEU 11 6.381 -3.836 -13.891 71 1HD1 LEU 11 HD11 LEU 11 5.218 -3.695 -16.071 72 2HD1 LEU 11 HD12 LEU 11 4.773 -5.413 -15.928 73 3HD1 LEU 11 HD13 LEU 11 4.182 -4.285 -14.747 74 1HD2 LEU 11 HD21 LEU 11 5.148 -5.647 -12.871 75 2HD2 LEU 11 HD22 LEU 11 5.707 -6.806 -14.078 76 3HD2 LEU 11 HD23 LEU 11 6.858 -6.088 -12.930 77 H TRP 12 H TRP 12 5.558 -7.490 -17.213 78 HA TRP 12 HA TRP 12 5.957 -6.795 -19.978 79 1HB TRP 12 HB2 TRP 12 5.068 -8.981 -18.943 80 2HB TRP 12 HB3 TRP 12 3.541 -8.149 -18.725 81 HD1 TRP 12 HD1 TRP 12 6.003 -8.864 -21.587 82 HE1 TRP 12 HE1 TRP 12 4.747 -9.560 -23.690 83 HE3 TRP 12 HE3 TRP 12 1.223 -8.348 -19.847 84 HZ2 TRP 12 HZ2 TRP 12 1.982 -9.914 -24.508 85 HZ3 TRP 12 HZ3 TRP 12 -0.704 -8.941 -21.283 86 HH2 TRP 12 HH2 TRP 12 -0.338 -9.721 -23.617 87 H LYS 13 H LYS 13 3.210 -6.163 -17.676 88 HA LYS 13 HA LYS 13 2.623 -3.590 -18.972 89 1HB LYS 13 HB2 LYS 13 0.702 -5.955 -18.915 90 2HB LYS 13 HB3 LYS 13 0.196 -4.279 -19.167 91 1HG LYS 13 HG2 LYS 13 1.716 -4.179 -21.181 92 2HG LYS 13 HG3 LYS 13 2.006 -5.916 -20.980 93 1HD LYS 13 HD2 LYS 13 -0.488 -6.286 -21.155 94 2HD LYS 13 HD3 LYS 13 -0.665 -4.557 -21.522 95 1HE LYS 13 HE2 LYS 13 0.891 -4.843 -23.466 96 2HE LYS 13 HE3 LYS 13 1.000 -6.572 -23.105 97 1HZ LYS 13 HZ1 LYS 13 -1.388 -6.739 -23.543 98 2HZ LYS 13 HZ2 LYS 13 -1.479 -5.140 -23.881 99 3HZ LYS 13 HZ3 LYS 13 -0.614 -6.130 -24.841 100 H VAL 14 H VAL 14 1.041 -2.363 -17.684 101 HA VAL 14 HA VAL 14 0.785 -3.256 -14.845 102 HB VAL 14 HB VAL 14 1.755 -0.538 -15.860 103 1HG1 VAL 14 HG11 VAL 14 0.321 -0.105 -13.924 104 2HG1 VAL 14 HG12 VAL 14 1.106 -1.423 -13.008 105 3HG1 VAL 14 HG13 VAL 14 2.010 0.042 -13.440 106 1HG2 VAL 14 HG21 VAL 14 3.029 -2.626 -14.054 107 2HG2 VAL 14 HG22 VAL 14 3.521 -2.242 -15.735 108 3HG2 VAL 14 HG23 VAL 14 3.751 -1.050 -14.460 109 H HIS 15 H HIS 15 -1.119 -2.633 -13.877 110 HA HIS 15 HA HIS 15 -3.208 -1.482 -15.664 111 1HB HIS 15 HB2 HIS 15 -3.690 -3.714 -13.691 112 2HB HIS 15 HB3 HIS 15 -4.660 -3.246 -15.079 113 HD1 HIS 15 HD1 HIS 15 -2.489 -3.529 -17.415 114 HD2 HIS 15 HD2 HIS 15 -2.901 -6.090 -14.108 115 HE1 HIS 15 HE1 HIS 15 -1.326 -5.721 -18.036 116 H VAL 16 H VAL 16 -1.635 -0.136 -13.481 117 HA VAL 16 HA VAL 16 -3.898 0.772 -11.800 118 HB VAL 16 HB VAL 16 -2.302 0.996 -9.893 119 1HG1 VAL 16 HG11 VAL 16 -3.972 -0.794 -9.904 120 2HG1 VAL 16 HG12 VAL 16 -2.824 -1.877 -10.719 121 3HG1 VAL 16 HG13 VAL 16 -2.487 -1.278 -9.074 122 1HG2 VAL 16 HG21 VAL 16 -0.186 0.681 -11.290 123 2HG2 VAL 16 HG22 VAL 16 -0.261 -0.148 -9.742 124 3HG2 VAL 16 HG23 VAL 16 -0.535 -1.063 -11.243 125 H LYS 17 H LYS 17 -3.416 2.856 -10.759 126 HA LYS 17 HA LYS 17 -1.243 4.456 -11.794 127 1HB LYS 17 HB2 LYS 17 -2.690 6.346 -12.444 128 2HB LYS 17 HB3 LYS 17 -2.934 4.953 -13.496 129 1HG LYS 17 HG2 LYS 17 -5.028 4.383 -12.295 130 2HG LYS 17 HG3 LYS 17 -4.783 5.754 -11.196 131 1HD LYS 17 HD2 LYS 17 -4.903 7.317 -13.117 132 2HD LYS 17 HD3 LYS 17 -5.159 5.942 -14.215 133 1HE LYS 17 HE2 LYS 17 -7.222 5.336 -12.963 134 2HE LYS 17 HE3 LYS 17 -6.965 6.702 -11.871 135 1HZ LYS 17 HZ1 LYS 17 -7.233 8.187 -13.774 136 2HZ LYS 17 HZ2 LYS 17 -7.469 6.923 -14.784 137 3HZ LYS 17 HZ3 LYS 17 -8.548 7.243 -13.608 138 H ALA 18 H ALA 18 -0.979 6.344 -10.308 139 HA ALA 18 HA ALA 18 -1.647 5.817 -7.592 140 1HB ALA 18 HB1 ALA 18 -0.895 8.126 -7.175 141 2HB ALA 18 HB2 ALA 18 0.234 7.279 -8.252 142 3HB ALA 18 HB3 ALA 18 -0.915 8.466 -8.918 143 H GLY 19 H GLY 19 -3.441 6.315 -6.397 144 1HA GLY 19 HA2 GLY 19 -5.404 7.433 -5.815 145 2HA GLY 19 HA3 GLY 19 -5.533 8.126 -7.437 146 H ASP 20 H ASP 20 -4.868 4.999 -8.211 147 HA ASP 20 HA ASP 20 -7.643 4.181 -8.551 148 1HB ASP 20 HB2 ASP 20 -5.712 3.588 -10.098 149 2HB ASP 20 HB3 ASP 20 -5.109 2.523 -8.826 150 H GLN 21 H GLN 21 -8.199 1.855 -7.704 151 HA GLN 21 HA GLN 21 -7.170 1.404 -4.945 152 1HB GLN 21 HB2 GLN 21 -9.395 2.532 -4.842 153 2HB GLN 21 HB3 GLN 21 -10.090 1.229 -5.816 154 1HG GLN 21 HG2 GLN 21 -9.511 -0.416 -4.063 155 2HG GLN 21 HG3 GLN 21 -8.761 0.845 -3.088 156 1HE2 GLN 21 HE22 GLN 21 -10.843 -0.873 -2.168 157 2HE2 GLN 21 HE21 GLN 21 -12.257 0.103 -1.854 158 H ILE 22 H ILE 22 -6.899 -0.759 -4.443 159 HA ILE 22 HA ILE 22 -7.607 -2.789 -6.482 160 HB ILE 22 HB ILE 22 -5.425 -3.782 -6.388 161 1HG1 ILE 22 HG12 ILE 22 -4.655 -1.612 -4.386 162 2HG1 ILE 22 HG13 ILE 22 -4.795 -3.347 -4.082 163 1HG2 ILE 22 HG21 ILE 22 -5.051 -0.804 -6.906 164 2HG2 ILE 22 HG22 ILE 22 -4.125 -2.134 -7.604 165 3HG2 ILE 22 HG23 ILE 22 -5.827 -1.945 -8.026 166 1HD1 ILE 22 HD11 ILE 22 -2.495 -2.956 -4.279 167 2HD1 ILE 22 HD12 ILE 22 -2.935 -3.665 -5.826 168 3HD1 ILE 22 HD13 ILE 22 -2.693 -1.912 -5.709 169 H GLU 23 H GLU 23 -7.367 -5.029 -5.535 170 HA GLU 23 HA GLU 23 -8.003 -5.112 -2.647 171 1HB GLU 23 HB2 GLU 23 -10.091 -4.923 -3.861 172 2HB GLU 23 HB3 GLU 23 -9.636 -6.271 -4.935 173 1HG GLU 23 HG2 GLU 23 -9.671 -7.817 -3.007 174 2HG GLU 23 HG3 GLU 23 -9.991 -6.474 -1.908 175 H LYS 24 H LYS 24 -7.230 -6.968 -1.679 176 HA LYS 24 HA LYS 24 -5.034 -8.315 -2.562 177 1HB LYS 24 HB2 LYS 24 -6.133 -8.195 -0.274 178 2HB LYS 24 HB3 LYS 24 -7.204 -9.501 -0.778 179 1HG LYS 24 HG2 LYS 24 -5.201 -10.977 -1.099 180 2HG LYS 24 HG3 LYS 24 -4.164 -9.627 -0.616 181 1HD LYS 24 HD2 LYS 24 -5.594 -9.544 1.573 182 2HD LYS 24 HD3 LYS 24 -6.252 -11.091 1.048 183 1HE LYS 24 HE2 LYS 24 -4.554 -11.640 2.564 184 2HE LYS 24 HE3 LYS 24 -3.838 -11.961 0.980 185 1HZ LYS 24 HZ1 LYS 24 -3.418 -9.458 2.544 186 2HZ LYS 24 HZ2 LYS 24 -2.378 -10.732 2.532 187 3HZ LYS 24 HZ3 LYS 24 -2.636 -9.881 1.160 188 H GLY 25 H GLY 25 -4.673 -9.603 -4.315 189 1HA GLY 25 HA2 GLY 25 -4.906 -11.646 -5.441 190 2HA GLY 25 HA3 GLY 25 -6.615 -11.732 -5.008 191 H GLN 26 H GLN 26 -6.463 -8.591 -5.995 192 HA GLN 26 HA GLN 26 -7.505 -9.086 -8.638 193 1HB GLN 26 HB2 GLN 26 -7.944 -7.045 -7.094 194 2HB GLN 26 HB3 GLN 26 -6.326 -6.488 -7.572 195 1HG GLN 26 HG2 GLN 26 -7.313 -6.842 -10.040 196 2HG GLN 26 HG3 GLN 26 -8.858 -6.756 -9.214 197 1HE2 GLN 26 HE22 GLN 26 -6.147 -4.989 -10.450 198 2HE2 GLN 26 HE21 GLN 26 -6.673 -3.389 -9.941 199 H GLU 27 H GLU 27 -6.392 -8.924 -10.622 200 HA GLU 27 HA GLU 27 -3.480 -9.088 -10.686 201 1HB GLU 27 HB2 GLU 27 -5.068 -10.176 -12.319 202 2HB GLU 27 HB3 GLU 27 -5.513 -8.569 -12.902 203 1HG GLU 27 HG2 GLU 27 -3.107 -8.213 -13.566 204 2HG GLU 27 HG3 GLU 27 -2.744 -9.849 -13.019 205 H VAL 28 H VAL 28 -2.053 -7.384 -11.042 206 HA VAL 28 HA VAL 28 -3.142 -4.672 -11.585 207 HB VAL 28 HB VAL 28 -1.585 -3.766 -9.835 208 1HG1 VAL 28 HG11 VAL 28 -3.811 -5.566 -8.782 209 2HG1 VAL 28 HG12 VAL 28 -3.106 -4.152 -7.985 210 3HG1 VAL 28 HG13 VAL 28 -4.024 -3.944 -9.481 211 1HG2 VAL 28 HG21 VAL 28 -0.133 -5.747 -9.478 212 2HG2 VAL 28 HG22 VAL 28 -0.901 -5.207 -7.973 213 3HG2 VAL 28 HG23 VAL 28 -1.533 -6.626 -8.821 214 H ALA 29 H ALA 29 -0.566 -7.024 -12.050 215 HA ALA 29 HA ALA 29 0.290 -5.467 -14.334 216 1HB ALA 29 HB1 ALA 29 2.733 -5.682 -13.665 217 2HB ALA 29 HB2 ALA 29 1.819 -4.510 -12.704 218 3HB ALA 29 HB3 ALA 29 2.207 -6.101 -12.028 219 H ILE 30 H ILE 30 2.099 -6.855 -15.413 220 HA ILE 30 HA ILE 30 1.791 -9.768 -14.926 221 HB ILE 30 HB ILE 30 1.407 -8.327 -17.580 222 1HG1 ILE 30 HG12 ILE 30 -0.331 -10.446 -16.230 223 2HG1 ILE 30 HG13 ILE 30 -0.609 -8.720 -16.085 224 1HG2 ILE 30 HG21 ILE 30 1.822 -11.325 -17.151 225 2HG2 ILE 30 HG22 ILE 30 1.388 -10.560 -18.690 226 3HG2 ILE 30 HG23 ILE 30 2.951 -10.238 -17.988 227 1HD1 ILE 30 HD11 ILE 30 -2.109 -9.555 -17.735 228 2HD1 ILE 30 HD12 ILE 30 -0.907 -8.539 -18.547 229 3HD1 ILE 30 HD13 ILE 30 -0.808 -10.316 -18.654 230 H LEU 31 H LEU 31 3.704 -10.875 -15.454 231 HA LEU 31 HA LEU 31 6.167 -9.230 -15.862 232 1HB LEU 31 HB2 LEU 31 5.942 -9.800 -13.575 233 2HB LEU 31 HB3 LEU 31 5.424 -11.455 -13.915 234 HG LEU 31 HG LEU 31 7.648 -11.129 -12.878 235 1HD1 LEU 31 HD11 LEU 31 7.052 -13.218 -14.025 236 2HD1 LEU 31 HD12 LEU 31 7.794 -12.624 -15.514 237 3HD1 LEU 31 HD13 LEU 31 8.785 -12.859 -14.071 238 1HD2 LEU 31 HD21 LEU 31 9.502 -10.301 -13.980 239 2HD2 LEU 31 HD22 LEU 31 8.727 -10.349 -15.579 240 3HD2 LEU 31 HD23 LEU 31 8.230 -9.135 -14.388 241 H GLU 32 H GLU 32 7.511 -10.025 -17.453 242 HA GLU 32 HA GLU 32 6.786 -12.586 -18.790 243 1HB GLU 32 HB2 GLU 32 6.762 -10.555 -20.202 244 2HB GLU 32 HB3 GLU 32 8.434 -10.205 -19.744 245 1HG GLU 32 HG2 GLU 32 9.100 -12.433 -20.745 246 2HG GLU 32 HG3 GLU 32 7.434 -12.644 -21.278 247 H SER 33 H SER 33 8.139 -14.267 -18.354 248 HA SER 33 HA SER 33 10.960 -14.040 -18.141 249 1HB SER 33 HB2 SER 33 10.208 -13.195 -15.819 250 2HB SER 33 HB3 SER 33 9.609 -14.832 -15.518 251 HG SER 33 HG SER 33 11.836 -14.170 -14.870 252 H MET 34 H MET 34 11.833 -16.320 -17.575 253 HA MET 34 HA MET 34 11.899 -18.536 -18.099 254 1HB MET 34 HB2 MET 34 9.131 -18.503 -16.832 255 2HB MET 34 HB3 MET 34 10.183 -19.907 -16.982 256 1HG MET 34 HG2 MET 34 11.794 -19.010 -15.467 257 2HG MET 34 HG3 MET 34 11.031 -17.424 -15.442 258 1HE MET 34 HE1 MET 34 8.029 -17.678 -14.960 259 2HE MET 34 HE2 MET 34 7.957 -17.746 -13.189 260 3HE MET 34 HE3 MET 34 9.111 -16.658 -13.984 261 H LYS 35 H LYS 35 10.943 -16.832 -20.254 262 HA LYS 35 HA LYS 35 9.919 -16.781 -22.250 263 1HB LYS 35 HB2 LYS 35 10.277 -19.807 -22.155 264 2HB LYS 35 HB3 LYS 35 9.807 -18.880 -23.567 265 1HG LYS 35 HG2 LYS 35 12.048 -19.279 -23.887 266 2HG LYS 35 HG3 LYS 35 11.960 -17.585 -23.409 267 1HD LYS 35 HD2 LYS 35 12.847 -18.130 -21.182 268 2HD LYS 35 HD3 LYS 35 12.647 -19.860 -21.493 269 1HE LYS 35 HE2 LYS 35 14.976 -19.319 -21.710 270 2HE LYS 35 HE3 LYS 35 14.343 -19.728 -23.305 271 1HZ LYS 35 HZ1 LYS 35 14.260 -17.351 -23.804 272 2HZ LYS 35 HZ2 LYS 35 14.817 -16.972 -22.311 273 3HZ LYS 35 HZ3 LYS 35 15.765 -17.775 -23.361 274 H MET 36 H MET 36 8.181 -16.644 -19.999 275 HA MET 36 HA MET 36 5.609 -17.394 -21.232 276 1HB MET 36 HB2 MET 36 6.526 -18.057 -18.392 277 2HB MET 36 HB3 MET 36 4.841 -18.098 -18.913 278 1HG MET 36 HG2 MET 36 5.389 -19.808 -20.607 279 2HG MET 36 HG3 MET 36 7.053 -19.848 -20.031 280 1HE MET 36 HE1 MET 36 6.792 -21.474 -16.504 281 2HE MET 36 HE2 MET 36 7.861 -20.848 -17.777 282 3HE MET 36 HE3 MET 36 6.838 -19.733 -16.841 283 H GLU 37 H GLU 37 3.847 -16.298 -19.785 284 HA GLU 37 HA GLU 37 4.802 -13.742 -18.626 285 1HB GLU 37 HB2 GLU 37 2.214 -14.131 -20.187 286 2HB GLU 37 HB3 GLU 37 2.698 -12.703 -19.285 287 1HG GLU 37 HG2 GLU 37 3.195 -12.100 -21.460 288 2HG GLU 37 HG3 GLU 37 4.760 -12.566 -20.810 289 H ILE 38 H ILE 38 3.902 -13.331 -16.628 290 HA ILE 38 HA ILE 38 2.181 -15.419 -15.403 291 HB ILE 38 HB ILE 38 4.749 -14.213 -14.254 292 1HG1 ILE 38 HG12 ILE 38 5.325 -16.859 -14.329 293 2HG1 ILE 38 HG13 ILE 38 4.273 -16.806 -15.729 294 1HG2 ILE 38 HG21 ILE 38 2.931 -16.411 -13.181 295 2HG2 ILE 38 HG22 ILE 38 4.462 -15.884 -12.459 296 3HG2 ILE 38 HG23 ILE 38 3.105 -14.767 -12.516 297 1HD1 ILE 38 HD11 ILE 38 6.589 -16.556 -16.414 298 2HD1 ILE 38 HD12 ILE 38 5.825 -14.986 -16.674 299 3HD1 ILE 38 HD13 ILE 38 6.854 -15.245 -15.255 300 HA PRO 39 HA PRO 39 0.220 -11.548 -14.218 301 1HB PRO 39 HB2 PRO 39 -1.584 -12.407 -12.340 302 2HB PRO 39 HB3 PRO 39 -1.774 -12.708 -14.094 303 1HG PRO 39 HG2 PRO 39 -0.641 -14.587 -12.002 304 2HG PRO 39 HG3 PRO 39 -1.870 -14.939 -13.261 305 1HD PRO 39 HD2 PRO 39 0.763 -15.549 -13.603 306 2HD PRO 39 HD3 PRO 39 -0.239 -14.979 -14.971 307 H ILE 40 H ILE 40 0.326 -10.022 -12.553 308 HA ILE 40 HA ILE 40 1.712 -10.759 -10.020 309 HB ILE 40 HB ILE 40 1.999 -8.277 -11.733 310 1HG1 ILE 40 HG12 ILE 40 3.353 -10.085 -12.612 311 2HG1 ILE 40 HG13 ILE 40 4.314 -8.754 -11.998 312 1HG2 ILE 40 HG21 ILE 40 3.108 -8.792 -8.952 313 2HG2 ILE 40 HG22 ILE 40 3.654 -7.488 -10.025 314 3HG2 ILE 40 HG23 ILE 40 1.984 -7.519 -9.452 315 1HD1 ILE 40 HD11 ILE 40 5.317 -10.892 -11.413 316 2HD1 ILE 40 HD12 ILE 40 4.838 -10.038 -9.945 317 3HD1 ILE 40 HD13 ILE 40 3.858 -11.400 -10.546 318 H VAL 41 H VAL 41 0.337 -10.505 -8.406 319 HA VAL 41 HA VAL 41 -2.157 -8.977 -8.856 320 HB VAL 41 HB VAL 41 -3.052 -10.512 -7.038 321 1HG1 VAL 41 HG11 VAL 41 -2.190 -11.791 -9.662 322 2HG1 VAL 41 HG12 VAL 41 -3.436 -12.410 -8.547 323 3HG1 VAL 41 HG13 VAL 41 -3.679 -10.864 -9.344 324 1HG2 VAL 41 HG21 VAL 41 -0.620 -12.230 -7.687 325 2HG2 VAL 41 HG22 VAL 41 -0.844 -11.323 -6.169 326 3HG2 VAL 41 HG23 VAL 41 -1.964 -12.622 -6.602 327 H ALA 42 H ALA 42 -3.120 -7.949 -7.072 328 HA ALA 42 HA ALA 42 -1.449 -6.374 -5.363 329 1HB ALA 42 HB1 ALA 42 -3.725 -5.721 -6.164 330 2HB ALA 42 HB2 ALA 42 -4.413 -7.059 -5.248 331 3HB ALA 42 HB3 ALA 42 -3.626 -5.723 -4.384 332 H ASP 43 H ASP 43 -0.197 -7.502 -3.882 333 HA ASP 43 HA ASP 43 -1.053 -9.907 -2.570 334 1HB ASP 43 HB2 ASP 43 1.309 -9.282 -2.916 335 2HB ASP 43 HB3 ASP 43 1.115 -7.905 -1.828 336 H ARG 44 H ARG 44 -1.929 -6.619 -2.013 337 HA ARG 44 HA ARG 44 -3.696 -7.412 0.118 338 1HB ARG 44 HB2 ARG 44 -3.003 -5.413 1.547 339 2HB ARG 44 HB3 ARG 44 -2.036 -6.869 1.694 340 1HG ARG 44 HG2 ARG 44 -1.137 -4.748 -0.254 341 2HG ARG 44 HG3 ARG 44 -0.953 -4.438 1.460 342 1HD ARG 44 HD2 ARG 44 0.004 -7.140 0.911 343 2HD ARG 44 HD3 ARG 44 0.733 -6.028 -0.250 344 HE ARG 44 HE ARG 44 0.982 -4.794 2.246 345 1HH1 ARG 44 HH21 ARG 44 2.218 -7.866 0.858 346 2HH1 ARG 44 HH22 ARG 44 3.776 -7.653 1.575 347 1HH2 ARG 44 HH11 ARG 44 2.791 -4.834 3.470 348 2HH2 ARG 44 HH12 ARG 44 4.122 -5.894 3.127 349 H SER 45 H SER 45 -5.368 -5.800 0.400 350 HA SER 45 HA SER 45 -5.993 -4.271 -1.943 351 1HB SER 45 HB2 SER 45 -7.208 -4.128 0.837 352 2HB SER 45 HB3 SER 45 -8.018 -3.774 -0.697 353 HG SER 45 HG SER 45 -8.472 -5.882 0.269 354 H GLY 46 H GLY 46 -6.393 -1.899 -1.968 355 1HA GLY 46 HA2 GLY 46 -6.164 -0.133 0.090 356 2HA GLY 46 HA3 GLY 46 -4.479 -0.314 -0.426 357 H ILE 47 H ILE 47 -5.159 2.112 -0.660 358 HA ILE 47 HA ILE 47 -6.120 2.703 -3.413 359 HB ILE 47 HB ILE 47 -5.137 4.509 -1.156 360 1HG1 ILE 47 HG12 ILE 47 -7.332 3.585 -0.596 361 2HG1 ILE 47 HG13 ILE 47 -7.409 5.310 -0.901 362 1HG2 ILE 47 HG21 ILE 47 -4.599 5.573 -3.249 363 2HG2 ILE 47 HG22 ILE 47 -6.212 5.243 -3.906 364 3HG2 ILE 47 HG23 ILE 47 -6.003 6.391 -2.564 365 1HD1 ILE 47 HD11 ILE 47 -8.256 3.147 -2.870 366 2HD1 ILE 47 HD12 ILE 47 -9.339 4.132 -1.873 367 3HD1 ILE 47 HD13 ILE 47 -8.377 4.898 -3.150 368 H VAL 48 H VAL 48 -4.593 3.053 -4.987 369 HA VAL 48 HA VAL 48 -1.821 2.309 -4.532 370 HB VAL 48 HB VAL 48 -3.112 3.550 -6.965 371 1HG1 VAL 48 HG11 VAL 48 -0.605 3.590 -6.935 372 2HG1 VAL 48 HG12 VAL 48 -0.587 1.836 -6.635 373 3HG1 VAL 48 HG13 VAL 48 -1.237 2.479 -8.158 374 1HG2 VAL 48 HG21 VAL 48 -4.303 1.467 -6.438 375 2HG2 VAL 48 HG22 VAL 48 -3.254 1.224 -7.828 376 3HG2 VAL 48 HG23 VAL 48 -2.761 0.606 -6.232 377 H LYS 49 H LYS 49 -0.720 3.634 -3.230 378 HA LYS 49 HA LYS 49 -1.124 6.524 -3.162 379 1HB LYS 49 HB2 LYS 49 -0.493 5.211 -1.161 380 2HB LYS 49 HB3 LYS 49 1.030 4.736 -1.934 381 1HG LYS 49 HG2 LYS 49 1.773 7.079 -1.969 382 2HG LYS 49 HG3 LYS 49 0.209 7.602 -1.305 383 1HD LYS 49 HD2 LYS 49 0.649 6.315 0.771 384 2HD LYS 49 HD3 LYS 49 2.151 5.697 0.081 385 1HE LYS 49 HE2 LYS 49 2.727 7.459 1.592 386 2HE LYS 49 HE3 LYS 49 3.053 8.013 -0.051 387 1HZ LYS 49 HZ1 LYS 49 0.669 8.744 1.559 388 2HZ LYS 49 HZ2 LYS 49 1.952 9.704 1.283 389 3HZ LYS 49 HZ3 LYS 49 0.983 9.287 0.045 390 H GLU 50 H GLU 50 1.220 4.162 -4.597 391 HA GLU 50 HA GLU 50 1.800 6.114 -6.668 392 1HB GLU 50 HB2 GLU 50 3.362 6.673 -4.668 393 2HB GLU 50 HB3 GLU 50 4.182 5.156 -5.020 394 1HG GLU 50 HG2 GLU 50 4.809 5.955 -7.233 395 2HG GLU 50 HG3 GLU 50 3.762 7.366 -7.075 396 H VAL 51 H VAL 51 3.242 5.070 -8.373 397 HA VAL 51 HA VAL 51 3.158 2.092 -8.297 398 HB VAL 51 HB VAL 51 2.868 3.860 -10.770 399 1HG1 VAL 51 HG11 VAL 51 2.217 1.742 -11.873 400 2HG1 VAL 51 HG12 VAL 51 3.857 1.633 -11.229 401 3HG1 VAL 51 HG13 VAL 51 2.511 0.845 -10.371 402 1HG2 VAL 51 HG21 VAL 51 0.515 3.056 -10.865 403 2HG2 VAL 51 HG22 VAL 51 0.730 2.285 -9.276 404 3HG2 VAL 51 HG23 VAL 51 0.797 4.057 -9.439 405 H LYS 52 H LYS 52 5.131 1.153 -8.749 406 HA LYS 52 HA LYS 52 7.426 3.067 -8.763 407 1HB LYS 52 HB2 LYS 52 7.273 0.307 -7.528 408 2HB LYS 52 HB3 LYS 52 8.533 1.514 -7.272 409 1HG LYS 52 HG2 LYS 52 5.649 1.612 -6.291 410 2HG LYS 52 HG3 LYS 52 7.059 1.271 -5.324 411 1HD LYS 52 HD2 LYS 52 6.619 3.962 -6.685 412 2HD LYS 52 HD3 LYS 52 6.029 3.543 -5.079 413 1HE LYS 52 HE2 LYS 52 8.515 2.844 -4.593 414 2HE LYS 52 HE3 LYS 52 8.892 3.853 -6.000 415 1HZ LYS 52 HZ1 LYS 52 7.475 4.689 -3.529 416 2HZ LYS 52 HZ2 LYS 52 8.981 5.166 -3.994 417 3HZ LYS 52 HZ3 LYS 52 7.653 5.661 -4.842 418 H LYS 53 H LYS 53 5.997 1.202 -11.011 419 HA LYS 53 HA LYS 53 8.542 0.717 -12.371 420 1HB LYS 53 HB2 LYS 53 6.396 -1.436 -11.998 421 2HB LYS 53 HB3 LYS 53 7.675 -1.559 -13.194 422 1HG LYS 53 HG2 LYS 53 8.105 -1.413 -10.200 423 2HG LYS 53 HG3 LYS 53 8.160 -2.873 -11.176 424 1HD LYS 53 HD2 LYS 53 10.100 -2.130 -12.398 425 2HD LYS 53 HD3 LYS 53 10.051 -0.525 -11.686 426 1HE LYS 53 HE2 LYS 53 10.537 -3.069 -10.104 427 2HE LYS 53 HE3 LYS 53 11.790 -1.978 -10.702 428 1HZ LYS 53 HZ1 LYS 53 9.698 -1.355 -8.722 429 2HZ LYS 53 HZ2 LYS 53 11.296 -1.527 -8.449 430 3HZ LYS 53 HZ3 LYS 53 10.727 -0.222 -9.330 431 H LYS 54 H LYS 54 7.898 -0.128 -14.680 432 HA LYS 54 HA LYS 54 5.566 1.209 -15.781 433 1HB LYS 54 HB2 LYS 54 6.860 2.493 -17.419 434 2HB LYS 54 HB3 LYS 54 7.231 3.030 -15.782 435 1HG LYS 54 HG2 LYS 54 9.353 1.711 -15.833 436 2HG LYS 54 HG3 LYS 54 8.976 1.181 -17.484 437 1HD LYS 54 HD2 LYS 54 9.001 3.538 -18.249 438 2HD LYS 54 HD3 LYS 54 9.386 4.069 -16.596 439 1HE LYS 54 HE2 LYS 54 11.471 2.714 -16.653 440 2HE LYS 54 HE3 LYS 54 11.088 2.185 -18.296 441 1HZ LYS 54 HZ1 LYS 54 12.648 4.025 -18.299 442 2HZ LYS 54 HZ2 LYS 54 11.262 4.499 -19.010 443 3HZ LYS 54 HZ3 LYS 54 11.615 4.989 -17.491 444 H GLU 55 H GLU 55 5.353 0.550 -18.078 445 HA GLU 55 HA GLU 55 5.723 -2.281 -18.281 446 1HB GLU 55 HB2 GLU 55 4.910 -0.318 -20.473 447 2HB GLU 55 HB3 GLU 55 4.575 -2.057 -20.398 448 1HG GLU 55 HG2 GLU 55 3.304 -1.576 -18.221 449 2HG GLU 55 HG3 GLU 55 3.443 0.137 -18.600 450 H GLY 56 H GLY 56 7.406 -3.399 -19.087 451 1HA GLY 56 HA2 GLY 56 9.043 -3.921 -20.647 452 2HA GLY 56 HA3 GLY 56 9.269 -2.213 -21.045 453 H ASP 57 H ASP 57 9.216 -2.167 -17.699 454 HA ASP 57 HA ASP 57 12.083 -1.773 -17.651 455 1HB ASP 57 HB2 ASP 57 10.396 -0.438 -16.351 456 2HB ASP 57 HB3 ASP 57 10.167 -1.837 -15.296 457 H PHE 58 H PHE 58 13.557 -2.810 -16.154 458 HA PHE 58 HA PHE 58 13.345 -5.741 -16.039 459 1HB PHE 58 HB2 PHE 58 15.515 -4.671 -16.448 460 2HB PHE 58 HB3 PHE 58 15.365 -3.725 -14.974 461 HD1 PHE 58 HD1 PHE 58 15.863 -4.679 -12.786 462 HD2 PHE 58 HD2 PHE 58 15.986 -7.129 -16.336 463 HE1 PHE 58 HE1 PHE 58 17.063 -6.448 -11.529 464 HE2 PHE 58 HE2 PHE 58 17.177 -8.898 -15.073 465 HZ PHE 58 HZ PHE 58 17.742 -8.552 -12.677 466 H VAL 59 H VAL 59 13.030 -6.953 -14.095 467 HA VAL 59 HA VAL 59 12.549 -5.505 -11.589 468 HB VAL 59 HB VAL 59 10.423 -6.864 -11.252 469 1HG1 VAL 59 HG11 VAL 59 8.988 -5.177 -12.247 470 2HG1 VAL 59 HG12 VAL 59 10.451 -4.450 -11.570 471 3HG1 VAL 59 HG13 VAL 59 10.290 -4.650 -13.328 472 1HG2 VAL 59 HG21 VAL 59 10.618 -8.384 -13.191 473 2HG2 VAL 59 HG22 VAL 59 9.096 -7.468 -13.196 474 3HG2 VAL 59 HG23 VAL 59 10.407 -7.005 -14.294 475 H ASN 60 H ASN 60 12.339 -6.995 -9.747 476 HA ASN 60 HA ASN 60 13.553 -9.613 -10.178 477 1HB ASN 60 HB2 ASN 60 15.220 -7.450 -9.620 478 2HB ASN 60 HB3 ASN 60 14.913 -8.132 -8.023 479 1HD2 ASN 60 HD22 ASN 60 15.654 -9.146 -11.417 480 2HD2 ASN 60 HD21 ASN 60 16.748 -10.439 -10.966 481 H GLU 61 H GLU 61 13.744 -10.825 -8.081 482 HA GLU 61 HA GLU 61 11.187 -10.953 -6.827 483 1HB GLU 61 HB2 GLU 61 12.617 -12.889 -7.091 484 2HB GLU 61 HB3 GLU 61 13.921 -12.135 -6.191 485 1HG GLU 61 HG2 GLU 61 12.434 -12.140 -4.142 486 2HG GLU 61 HG3 GLU 61 11.193 -12.960 -5.085 487 H GLY 62 H GLY 62 10.391 -9.496 -5.446 488 1HA GLY 62 HA2 GLY 62 10.250 -8.427 -3.389 489 2HA GLY 62 HA3 GLY 62 12.007 -8.492 -3.191 490 H ASP 63 H ASP 63 11.432 -7.387 -6.362 491 HA ASP 63 HA ASP 63 12.092 -4.628 -5.651 492 1HB ASP 63 HB2 ASP 63 12.928 -5.918 -7.703 493 2HB ASP 63 HB3 ASP 63 11.304 -5.748 -8.367 494 H VAL 64 H VAL 64 10.583 -2.937 -5.550 495 HA VAL 64 HA VAL 64 7.888 -3.770 -5.018 496 HB VAL 64 HB VAL 64 8.972 -0.931 -5.191 497 1HG1 VAL 64 HG11 VAL 64 7.153 -0.464 -3.549 498 2HG1 VAL 64 HG12 VAL 64 6.504 -1.057 -5.078 499 3HG1 VAL 64 HG13 VAL 64 6.606 -2.150 -3.688 500 1HG2 VAL 64 HG21 VAL 64 9.289 -1.124 -2.714 501 2HG2 VAL 64 HG22 VAL 64 8.939 -2.864 -2.825 502 3HG2 VAL 64 HG23 VAL 64 10.382 -2.179 -3.606 503 H LEU 65 H LEU 65 6.067 -3.564 -6.213 504 HA LEU 65 HA LEU 65 6.258 -2.701 -9.046 505 1HB LEU 65 HB2 LEU 65 5.337 -4.959 -8.490 506 2HB LEU 65 HB3 LEU 65 4.095 -4.234 -7.506 507 HG LEU 65 HG LEU 65 3.492 -5.061 -9.782 508 1HD1 LEU 65 HD11 LEU 65 1.980 -3.596 -8.546 509 2HD1 LEU 65 HD12 LEU 65 2.690 -2.178 -9.369 510 3HD1 LEU 65 HD13 LEU 65 1.838 -3.416 -10.296 511 1HD2 LEU 65 HD21 LEU 65 5.442 -4.087 -11.024 512 2HD2 LEU 65 HD22 LEU 65 3.877 -3.712 -11.761 513 3HD2 LEU 65 HD23 LEU 65 4.714 -2.476 -10.815 514 H LEU 66 H LEU 66 4.225 -2.345 -6.080 515 HA LEU 66 HA LEU 66 3.862 0.502 -6.737 516 1HB LEU 66 HB2 LEU 66 1.455 0.518 -6.634 517 2HB LEU 66 HB3 LEU 66 2.046 -0.447 -7.958 518 HG LEU 66 HG LEU 66 1.613 -2.508 -6.526 519 1HD1 LEU 66 HD11 LEU 66 1.391 -1.651 -4.282 520 2HD1 LEU 66 HD12 LEU 66 0.188 -0.454 -4.808 521 3HD1 LEU 66 HD13 LEU 66 -0.198 -2.193 -4.773 522 1HD2 LEU 66 HD21 LEU 66 -0.780 -2.541 -7.035 523 2HD2 LEU 66 HD22 LEU 66 -0.761 -0.776 -7.274 524 3HD2 LEU 66 HD23 LEU 66 0.149 -1.859 -8.358 525 H GLU 67 H GLU 67 2.535 1.636 -5.040 526 HA GLU 67 HA GLU 67 3.329 0.727 -2.322 527 1HB GLU 67 HB2 GLU 67 4.927 2.330 -3.389 528 2HB GLU 67 HB3 GLU 67 3.603 3.487 -3.587 529 1HG GLU 67 HG2 GLU 67 3.332 3.557 -1.110 530 2HG GLU 67 HG3 GLU 67 4.688 2.435 -0.943 531 H LEU 68 H LEU 68 1.761 1.330 -0.715 532 HA LEU 68 HA LEU 68 -0.866 2.167 -1.841 533 1HB LEU 68 HB2 LEU 68 -0.246 -0.070 0.130 534 2HB LEU 68 HB3 LEU 68 -1.868 0.485 -0.251 535 HG LEU 68 HG LEU 68 0.038 -0.834 -2.207 536 1HD1 LEU 68 HD11 LEU 68 -2.544 -1.841 -0.946 537 2HD1 LEU 68 HD12 LEU 68 -1.523 -2.714 -2.101 538 3HD1 LEU 68 HD13 LEU 68 -0.907 -2.345 -0.481 539 1HD2 LEU 68 HD21 LEU 68 -1.364 0.725 -3.397 540 2HD2 LEU 68 HD22 LEU 68 -1.968 -0.876 -3.716 541 3HD2 LEU 68 HD23 LEU 68 -2.834 0.155 -2.566 542 H SER 69 H SER 69 -2.471 2.690 -0.186 543 HA SER 69 HA SER 69 -1.796 4.723 1.633 544 1HB SER 69 HB2 SER 69 -4.175 4.197 2.425 545 2HB SER 69 HB3 SER 69 -3.981 4.565 0.710 546 HG SER 69 HG SER 69 -5.244 2.584 1.501 547 H ASN 70 H ASN 70 -1.316 1.331 2.041 548 HA ASN 70 HA ASN 70 -1.183 1.501 4.988 549 1HB ASN 70 HB2 ASN 70 -2.561 -0.474 5.248 550 2HB ASN 70 HB3 ASN 70 -3.498 0.718 4.361 551 1HD2 ASN 70 HD22 ASN 70 -3.846 0.351 2.008 552 2HD2 ASN 70 HD21 ASN 70 -3.682 -1.295 1.387 553 H SER 71 H SER 71 -0.081 -0.418 5.896 554 HA SER 71 HA SER 71 2.217 -1.253 4.373 555 1HB SER 71 HB2 SER 71 2.430 -2.738 6.505 556 2HB SER 71 HB3 SER 71 2.568 -0.980 6.670 557 HG SER 71 HG SER 71 1.179 -1.866 8.251 558 H THR 72 H THR 72 -0.529 -3.067 5.846 559 HA THR 72 HA THR 72 -0.623 -4.981 3.615 560 HB THR 72 HB THR 72 -0.132 -5.880 6.484 561 HG1 THR 72 HG1 THR 72 1.973 -6.136 6.027 562 1HG2 THR 72 HG21 THR 72 0.548 -8.022 5.369 563 2HG2 THR 72 HG22 THR 72 -1.145 -7.618 5.088 564 3HG2 THR 72 HG23 THR 72 0.055 -7.341 3.804 565 H GLN 73 H GLN 73 -2.568 -6.275 3.674 566 HA GLN 73 HA GLN 73 -4.485 -6.000 5.817 567 1HB GLN 73 HB2 GLN 73 -5.145 -5.169 2.942 568 2HB GLN 73 HB3 GLN 73 -6.351 -5.628 4.144 569 1HG GLN 73 HG2 GLN 73 -5.518 -3.785 5.640 570 2HG GLN 73 HG3 GLN 73 -4.470 -3.250 4.326 571 1HE2 GLN 73 HE21 GLN 73 -5.525 -2.510 2.262 572 2HE2 GLN 73 HE22 GLN 73 -7.130 -1.816 2.384 Start of MODEL 19 1 1H THR 2 H1 THR 2 5.940 -2.689 0.913 2 2H THR 2 H2 THR 2 5.739 -4.281 0.542 3 3H THR 2 H3 THR 2 6.007 -3.181 -0.648 4 HA THR 2 HA THR 2 3.665 -3.358 1.106 5 HB THR 2 HB THR 2 4.098 -1.324 -1.103 6 HG1 THR 2 HG1 THR 2 4.526 0.082 0.540 7 1HG2 THR 2 HG21 THR 2 1.960 -1.623 1.065 8 2HG2 THR 2 HG22 THR 2 2.151 -0.210 0.014 9 3HG2 THR 2 HG23 THR 2 1.712 -1.772 -0.691 10 H VAL 3 H VAL 3 4.032 -2.984 -2.544 11 HA VAL 3 HA VAL 3 3.105 -5.792 -2.780 12 HB VAL 3 HB VAL 3 2.085 -3.456 -4.425 13 1HG1 VAL 3 HG11 VAL 3 0.590 -5.136 -5.475 14 2HG1 VAL 3 HG12 VAL 3 2.288 -5.523 -5.755 15 3HG1 VAL 3 HG13 VAL 3 1.379 -6.419 -4.520 16 1HG2 VAL 3 HG21 VAL 3 0.613 -5.137 -2.361 17 2HG2 VAL 3 HG22 VAL 3 0.906 -3.387 -2.312 18 3HG2 VAL 3 HG23 VAL 3 -0.182 -4.059 -3.529 19 H SER 4 H SER 4 4.543 -6.856 -4.025 20 HA SER 4 HA SER 4 6.540 -5.359 -5.645 21 1HB SER 4 HB2 SER 4 7.099 -7.477 -3.533 22 2HB SER 4 HB3 SER 4 8.304 -6.584 -4.472 23 HG SER 4 HG SER 4 7.983 -5.738 -2.339 24 H ILE 5 H ILE 5 7.833 -6.745 -6.975 25 HA ILE 5 HA ILE 5 6.379 -8.986 -8.189 26 HB ILE 5 HB ILE 5 9.152 -7.841 -8.759 27 1HG1 ILE 5 HG12 ILE 5 7.620 -6.024 -9.120 28 2HG1 ILE 5 HG13 ILE 5 8.073 -6.670 -10.675 29 1HG2 ILE 5 HG21 ILE 5 8.926 -10.039 -9.742 30 2HG2 ILE 5 HG22 ILE 5 7.335 -9.645 -10.425 31 3HG2 ILE 5 HG23 ILE 5 8.804 -8.860 -11.029 32 1HD1 ILE 5 HD11 ILE 5 5.718 -6.149 -10.678 33 2HD1 ILE 5 HD12 ILE 5 5.923 -7.893 -10.838 34 3HD1 ILE 5 HD13 ILE 5 5.434 -7.186 -9.276 35 H GLN 6 H GLN 6 7.418 -11.135 -8.302 36 HA GLN 6 HA GLN 6 8.922 -11.811 -5.816 37 1HB GLN 6 HB2 GLN 6 7.309 -13.598 -5.410 38 2HB GLN 6 HB3 GLN 6 6.535 -12.021 -5.465 39 1HG GLN 6 HG2 GLN 6 5.959 -12.582 -7.951 40 2HG GLN 6 HG3 GLN 6 6.423 -14.236 -7.551 41 1HE2 GLN 6 HE22 GLN 6 4.280 -11.512 -6.580 42 2HE2 GLN 6 HE21 GLN 6 2.974 -12.515 -5.998 43 H MET 7 H MET 7 9.540 -11.684 -8.871 44 HA MET 7 HA MET 7 11.184 -14.065 -8.980 45 1HB MET 7 HB2 MET 7 10.291 -14.849 -11.117 46 2HB MET 7 HB3 MET 7 9.056 -14.962 -9.872 47 1HG MET 7 HG2 MET 7 9.248 -12.722 -11.916 48 2HG MET 7 HG3 MET 7 8.268 -14.163 -12.115 49 1HE MET 7 HE1 MET 7 6.110 -14.743 -10.610 50 2HE MET 7 HE2 MET 7 4.985 -13.365 -10.518 51 3HE MET 7 HE3 MET 7 5.766 -13.760 -12.059 52 H ALA 8 H ALA 8 12.726 -13.834 -10.826 53 HA ALA 8 HA ALA 8 13.300 -11.022 -11.492 54 1HB ALA 8 HB1 ALA 8 15.302 -11.944 -12.541 55 2HB ALA 8 HB2 ALA 8 15.129 -12.551 -10.876 56 3HB ALA 8 HB3 ALA 8 14.715 -13.599 -12.260 57 H GLY 9 H GLY 9 12.954 -10.041 -13.482 58 1HA GLY 9 HA2 GLY 9 12.710 -11.395 -15.934 59 2HA GLY 9 HA3 GLY 9 11.079 -11.249 -15.284 60 H ASN 10 H ASN 10 10.444 -9.836 -16.964 61 HA ASN 10 HA ASN 10 11.293 -7.004 -16.581 62 1HB ASN 10 HB2 ASN 10 11.255 -8.557 -19.181 63 2HB ASN 10 HB3 ASN 10 10.684 -6.893 -19.167 64 1HD2 ASN 10 HD22 ASN 10 13.406 -7.910 -17.025 65 2HD2 ASN 10 HD21 ASN 10 14.615 -7.064 -17.968 66 H LEU 11 H LEU 11 9.498 -5.701 -16.482 67 HA LEU 11 HA LEU 11 7.075 -7.144 -15.875 68 1HB LEU 11 HB2 LEU 11 8.166 -5.138 -14.666 69 2HB LEU 11 HB3 LEU 11 7.501 -4.135 -15.950 70 HG LEU 11 HG LEU 11 5.205 -4.912 -15.324 71 1HD1 LEU 11 HD11 LEU 11 6.667 -6.361 -13.056 72 2HD1 LEU 11 HD12 LEU 11 4.921 -6.049 -13.090 73 3HD1 LEU 11 HD13 LEU 11 5.639 -7.111 -14.290 74 1HD2 LEU 11 HD21 LEU 11 6.235 -2.866 -14.361 75 2HD2 LEU 11 HD22 LEU 11 5.154 -3.641 -13.195 76 3HD2 LEU 11 HD23 LEU 11 6.904 -3.835 -13.024 77 H TRP 12 H TRP 12 5.535 -7.648 -17.364 78 HA TRP 12 HA TRP 12 5.948 -6.957 -20.114 79 1HB TRP 12 HB2 TRP 12 5.019 -9.123 -19.113 80 2HB TRP 12 HB3 TRP 12 3.512 -8.267 -18.846 81 HD1 TRP 12 HD1 TRP 12 5.876 -9.063 -21.758 82 HE1 TRP 12 HE1 TRP 12 4.548 -9.651 -23.854 83 HE3 TRP 12 HE3 TRP 12 1.166 -8.283 -19.938 84 HZ2 TRP 12 HZ2 TRP 12 1.756 -9.827 -24.631 85 HZ3 TRP 12 HZ3 TRP 12 -0.816 -8.735 -21.352 86 HH2 TRP 12 HH2 TRP 12 -0.535 -9.502 -23.701 87 H LYS 13 H LYS 13 3.261 -6.240 -17.807 88 HA LYS 13 HA LYS 13 2.751 -3.641 -19.052 89 1HB LYS 13 HB2 LYS 13 0.693 -5.902 -18.990 90 2HB LYS 13 HB3 LYS 13 0.267 -4.197 -19.176 91 1HG LYS 13 HG2 LYS 13 1.707 -4.111 -21.245 92 2HG LYS 13 HG3 LYS 13 1.929 -5.864 -21.101 93 1HD LYS 13 HD2 LYS 13 -0.581 -6.128 -21.190 94 2HD LYS 13 HD3 LYS 13 -0.702 -4.383 -21.501 95 1HE LYS 13 HE2 LYS 13 0.768 -4.673 -23.511 96 2HE LYS 13 HE3 LYS 13 0.821 -6.414 -23.204 97 1HZ LYS 13 HZ1 LYS 13 -0.838 -5.859 -24.863 98 2HZ LYS 13 HZ2 LYS 13 -1.587 -6.474 -23.554 99 3HZ LYS 13 HZ3 LYS 13 -1.626 -4.865 -23.844 100 H VAL 14 H VAL 14 1.184 -2.420 -17.655 101 HA VAL 14 HA VAL 14 0.834 -3.448 -14.911 102 HB VAL 14 HB VAL 14 2.043 -0.721 -15.590 103 1HG1 VAL 14 HG11 VAL 14 0.663 -0.567 -13.576 104 2HG1 VAL 14 HG12 VAL 14 1.411 -2.040 -12.902 105 3HG1 VAL 14 HG13 VAL 14 2.361 -0.556 -13.110 106 1HG2 VAL 14 HG21 VAL 14 3.773 -2.406 -15.869 107 2HG2 VAL 14 HG22 VAL 14 4.042 -1.601 -14.325 108 3HG2 VAL 14 HG23 VAL 14 3.276 -3.212 -14.364 109 H HIS 15 H HIS 15 -1.077 -2.619 -13.993 110 HA HIS 15 HA HIS 15 -2.876 -1.247 -15.950 111 1HB HIS 15 HB2 HIS 15 -3.763 -3.242 -13.875 112 2HB HIS 15 HB3 HIS 15 -4.570 -2.762 -15.363 113 HD1 HIS 15 HD1 HIS 15 -2.318 -3.460 -17.510 114 HD2 HIS 15 HD2 HIS 15 -3.187 -5.722 -14.072 115 HE1 HIS 15 HE1 HIS 15 -1.283 -5.770 -17.875 116 H VAL 16 H VAL 16 -1.630 -1.139 -12.682 117 HA VAL 16 HA VAL 16 -3.797 0.489 -11.608 118 HB VAL 16 HB VAL 16 -2.157 0.899 -9.759 119 1HG1 VAL 16 HG11 VAL 16 -2.298 -1.380 -8.843 120 2HG1 VAL 16 HG12 VAL 16 -3.811 -0.871 -9.601 121 3HG1 VAL 16 HG13 VAL 16 -2.740 -1.997 -10.455 122 1HG2 VAL 16 HG21 VAL 16 -0.099 -0.149 -9.571 123 2HG2 VAL 16 HG22 VAL 16 -0.381 -1.253 -10.941 124 3HG2 VAL 16 HG23 VAL 16 -0.070 0.477 -11.212 125 H LYS 17 H LYS 17 -3.357 2.622 -10.694 126 HA LYS 17 HA LYS 17 -1.268 4.258 -11.815 127 1HB LYS 17 HB2 LYS 17 -2.771 6.069 -12.525 128 2HB LYS 17 HB3 LYS 17 -2.990 4.640 -13.530 129 1HG LYS 17 HG2 LYS 17 -5.053 4.051 -12.353 130 2HG LYS 17 HG3 LYS 17 -4.850 5.381 -11.215 131 1HD LYS 17 HD2 LYS 17 -5.247 5.668 -14.219 132 2HD LYS 17 HD3 LYS 17 -6.518 5.838 -13.015 133 1HE LYS 17 HE2 LYS 17 -4.047 7.627 -13.227 134 2HE LYS 17 HE3 LYS 17 -5.645 8.009 -13.861 135 1HZ LYS 17 HZ1 LYS 17 -5.337 9.056 -11.748 136 2HZ LYS 17 HZ2 LYS 17 -6.498 7.928 -11.579 137 3HZ LYS 17 HZ3 LYS 17 -4.988 7.660 -10.984 138 H ALA 18 H ALA 18 -1.174 6.286 -10.435 139 HA ALA 18 HA ALA 18 -1.765 5.876 -7.682 140 1HB ALA 18 HB1 ALA 18 -1.326 8.297 -7.451 141 2HB ALA 18 HB2 ALA 18 -0.095 7.521 -8.465 142 3HB ALA 18 HB3 ALA 18 -1.389 8.491 -9.215 143 H GLY 19 H GLY 19 -3.547 6.347 -6.454 144 1HA GLY 19 HA2 GLY 19 -5.622 7.179 -5.890 145 2HA GLY 19 HA3 GLY 19 -5.832 7.843 -7.516 146 H ASP 20 H ASP 20 -4.922 4.708 -8.190 147 HA ASP 20 HA ASP 20 -7.647 3.818 -8.656 148 1HB ASP 20 HB2 ASP 20 -5.653 3.252 -10.097 149 2HB ASP 20 HB3 ASP 20 -5.066 2.212 -8.790 150 H GLN 21 H GLN 21 -8.365 1.637 -7.824 151 HA GLN 21 HA GLN 21 -7.677 1.228 -4.936 152 1HB GLN 21 HB2 GLN 21 -10.007 1.983 -5.249 153 2HB GLN 21 HB3 GLN 21 -10.252 0.775 -6.505 154 1HG GLN 21 HG2 GLN 21 -11.354 -0.052 -4.604 155 2HG GLN 21 HG3 GLN 21 -9.923 -1.040 -4.769 156 1HE2 GLN 21 HE22 GLN 21 -8.760 -1.361 -2.813 157 2HE2 GLN 21 HE21 GLN 21 -8.945 -0.319 -1.422 158 H ILE 22 H ILE 22 -6.915 -0.788 -4.441 159 HA ILE 22 HA ILE 22 -7.395 -2.979 -6.371 160 HB ILE 22 HB ILE 22 -5.227 -3.861 -6.184 161 1HG1 ILE 22 HG12 ILE 22 -4.599 -1.727 -4.104 162 2HG1 ILE 22 HG13 ILE 22 -4.728 -3.470 -3.846 163 1HG2 ILE 22 HG21 ILE 22 -4.845 -0.873 -6.616 164 2HG2 ILE 22 HG22 ILE 22 -3.871 -2.184 -7.288 165 3HG2 ILE 22 HG23 ILE 22 -5.540 -1.987 -7.810 166 1HD1 ILE 22 HD11 ILE 22 -2.578 -1.972 -5.358 167 2HD1 ILE 22 HD12 ILE 22 -2.414 -3.011 -3.923 168 3HD1 ILE 22 HD13 ILE 22 -2.776 -3.729 -5.498 169 H GLU 23 H GLU 23 -7.242 -5.122 -5.331 170 HA GLU 23 HA GLU 23 -7.925 -5.158 -2.471 171 1HB GLU 23 HB2 GLU 23 -10.035 -4.957 -3.713 172 2HB GLU 23 HB3 GLU 23 -9.586 -6.340 -4.734 173 1HG GLU 23 HG2 GLU 23 -9.604 -7.812 -2.737 174 2HG GLU 23 HG3 GLU 23 -9.962 -6.427 -1.704 175 H LYS 24 H LYS 24 -7.078 -7.107 -1.544 176 HA LYS 24 HA LYS 24 -4.910 -8.341 -2.699 177 1HB LYS 24 HB2 LYS 24 -5.568 -8.477 -0.328 178 2HB LYS 24 HB3 LYS 24 -6.877 -9.593 -0.733 179 1HG LYS 24 HG2 LYS 24 -5.316 -11.305 -1.440 180 2HG LYS 24 HG3 LYS 24 -3.960 -10.164 -1.384 181 1HD LYS 24 HD2 LYS 24 -4.225 -9.953 1.076 182 2HD LYS 24 HD3 LYS 24 -5.619 -11.032 1.028 183 1HE LYS 24 HE2 LYS 24 -3.628 -12.193 1.825 184 2HE LYS 24 HE3 LYS 24 -4.217 -12.911 0.324 185 1HZ LYS 24 HZ1 LYS 24 -1.743 -12.515 0.520 186 2HZ LYS 24 HZ2 LYS 24 -2.431 -11.961 -0.850 187 3HZ LYS 24 HZ3 LYS 24 -2.041 -10.905 0.335 188 H GLY 25 H GLY 25 -4.595 -9.628 -4.434 189 1HA GLY 25 HA2 GLY 25 -4.931 -11.575 -5.697 190 2HA GLY 25 HA3 GLY 25 -6.619 -11.651 -5.195 191 H GLN 26 H GLN 26 -6.455 -8.462 -6.003 192 HA GLN 26 HA GLN 26 -7.601 -8.730 -8.619 193 1HB GLN 26 HB2 GLN 26 -7.921 -6.846 -6.936 194 2HB GLN 26 HB3 GLN 26 -6.274 -6.295 -7.335 195 1HG GLN 26 HG2 GLN 26 -6.985 -5.902 -9.666 196 2HG GLN 26 HG3 GLN 26 -8.595 -6.536 -9.310 197 1HE2 GLN 26 HE22 GLN 26 -6.820 -3.664 -9.562 198 2HE2 GLN 26 HE21 GLN 26 -7.817 -2.629 -8.550 199 H GLU 27 H GLU 27 -6.542 -8.652 -10.635 200 HA GLU 27 HA GLU 27 -3.647 -8.944 -10.761 201 1HB GLU 27 HB2 GLU 27 -5.255 -9.991 -12.362 202 2HB GLU 27 HB3 GLU 27 -5.708 -8.383 -12.941 203 1HG GLU 27 HG2 GLU 27 -3.341 -8.020 -13.677 204 2HG GLU 27 HG3 GLU 27 -2.926 -9.632 -13.091 205 H VAL 28 H VAL 28 -2.156 -7.329 -11.027 206 HA VAL 28 HA VAL 28 -3.096 -4.540 -11.513 207 HB VAL 28 HB VAL 28 -1.429 -3.819 -9.772 208 1HG1 VAL 28 HG11 VAL 28 -3.723 -5.531 -8.712 209 2HG1 VAL 28 HG12 VAL 28 -2.896 -4.215 -7.863 210 3HG1 VAL 28 HG13 VAL 28 -3.873 -3.869 -9.305 211 1HG2 VAL 28 HG21 VAL 28 -1.557 -6.707 -8.856 212 2HG2 VAL 28 HG22 VAL 28 -0.117 -5.927 -9.558 213 3HG2 VAL 28 HG23 VAL 28 -0.775 -5.368 -8.006 214 H ALA 29 H ALA 29 -0.657 -7.036 -12.109 215 HA ALA 29 HA ALA 29 0.213 -5.479 -14.388 216 1HB ALA 29 HB1 ALA 29 1.761 -4.551 -12.704 217 2HB ALA 29 HB2 ALA 29 2.219 -6.175 -12.174 218 3HB ALA 29 HB3 ALA 29 2.651 -5.614 -13.797 219 H ILE 30 H ILE 30 2.090 -6.880 -15.448 220 HA ILE 30 HA ILE 30 1.724 -9.782 -15.026 221 HB ILE 30 HB ILE 30 1.394 -8.310 -17.677 222 1HG1 ILE 30 HG12 ILE 30 -0.468 -10.293 -16.287 223 2HG1 ILE 30 HG13 ILE 30 -0.668 -8.546 -16.267 224 1HG2 ILE 30 HG21 ILE 30 2.863 -10.303 -18.027 225 2HG2 ILE 30 HG22 ILE 30 1.645 -11.325 -17.234 226 3HG2 ILE 30 HG23 ILE 30 1.310 -10.531 -18.786 227 1HD1 ILE 30 HD11 ILE 30 -2.177 -9.437 -17.876 228 2HD1 ILE 30 HD12 ILE 30 -0.926 -8.521 -18.731 229 3HD1 ILE 30 HD13 ILE 30 -0.894 -10.306 -18.723 230 H LEU 31 H LEU 31 3.662 -10.861 -15.499 231 HA LEU 31 HA LEU 31 6.107 -9.194 -15.947 232 1HB LEU 31 HB2 LEU 31 5.925 -9.765 -13.663 233 2HB LEU 31 HB3 LEU 31 5.411 -11.423 -13.991 234 HG LEU 31 HG LEU 31 7.646 -11.053 -12.984 235 1HD1 LEU 31 HD11 LEU 31 7.725 -12.628 -15.582 236 2HD1 LEU 31 HD12 LEU 31 8.795 -12.803 -14.186 237 3HD1 LEU 31 HD13 LEU 31 7.073 -13.186 -14.035 238 1HD2 LEU 31 HD21 LEU 31 9.480 -10.248 -14.097 239 2HD2 LEU 31 HD22 LEU 31 8.716 -10.340 -15.695 240 3HD2 LEU 31 HD23 LEU 31 8.206 -9.097 -14.538 241 H GLU 32 H GLU 32 7.516 -10.003 -17.489 242 HA GLU 32 HA GLU 32 6.803 -12.550 -18.852 243 1HB GLU 32 HB2 GLU 32 6.756 -10.518 -20.261 244 2HB GLU 32 HB3 GLU 32 8.422 -10.147 -19.801 245 1HG GLU 32 HG2 GLU 32 9.111 -12.373 -20.802 246 2HG GLU 32 HG3 GLU 32 7.450 -12.589 -21.350 247 H SER 33 H SER 33 8.169 -14.210 -18.441 248 HA SER 33 HA SER 33 10.986 -13.974 -18.252 249 1HB SER 33 HB2 SER 33 10.271 -13.141 -15.917 250 2HB SER 33 HB3 SER 33 9.669 -14.775 -15.616 251 HG SER 33 HG SER 33 11.905 -14.131 -14.992 252 H MET 34 H MET 34 11.870 -16.261 -17.694 253 HA MET 34 HA MET 34 11.932 -18.473 -18.243 254 1HB MET 34 HB2 MET 34 9.179 -18.449 -16.945 255 2HB MET 34 HB3 MET 34 10.221 -19.855 -17.126 256 1HG MET 34 HG2 MET 34 11.844 -19.009 -15.608 257 2HG MET 34 HG3 MET 34 11.130 -17.401 -15.576 258 1HE MET 34 HE1 MET 34 8.060 -17.632 -13.307 259 2HE MET 34 HE2 MET 34 9.257 -16.574 -14.080 260 3HE MET 34 HE3 MET 34 8.144 -17.539 -15.076 261 H LYS 35 H LYS 35 11.035 -16.782 -20.380 262 HA LYS 35 HA LYS 35 9.992 -16.678 -22.370 263 1HB LYS 35 HB2 LYS 35 10.154 -19.714 -22.330 264 2HB LYS 35 HB3 LYS 35 9.979 -18.694 -23.751 265 1HG LYS 35 HG2 LYS 35 12.420 -18.798 -21.930 266 2HG LYS 35 HG3 LYS 35 12.254 -19.540 -23.520 267 1HD LYS 35 HD2 LYS 35 11.949 -17.274 -24.536 268 2HD LYS 35 HD3 LYS 35 12.225 -16.544 -22.937 269 1HE LYS 35 HE2 LYS 35 14.457 -17.622 -22.825 270 2HE LYS 35 HE3 LYS 35 14.188 -18.354 -24.413 271 1HZ LYS 35 HZ1 LYS 35 15.507 -16.346 -24.581 272 2HZ LYS 35 HZ2 LYS 35 14.094 -16.118 -25.355 273 3HZ LYS 35 HZ3 LYS 35 14.345 -15.441 -23.887 274 H MET 36 H MET 36 8.231 -16.599 -20.095 275 HA MET 36 HA MET 36 5.659 -17.316 -21.359 276 1HB MET 36 HB2 MET 36 6.663 -18.083 -18.575 277 2HB MET 36 HB3 MET 36 4.952 -18.015 -18.961 278 1HG MET 36 HG2 MET 36 6.976 -19.799 -20.348 279 2HG MET 36 HG3 MET 36 5.873 -20.300 -19.077 280 1HE MET 36 HE1 MET 36 3.325 -20.693 -19.325 281 2HE MET 36 HE2 MET 36 3.043 -19.002 -19.801 282 3HE MET 36 HE3 MET 36 2.377 -20.322 -20.780 283 H GLU 37 H GLU 37 3.888 -16.259 -19.911 284 HA GLU 37 HA GLU 37 4.815 -13.713 -18.715 285 1HB GLU 37 HB2 GLU 37 2.239 -14.098 -20.294 286 2HB GLU 37 HB3 GLU 37 2.709 -12.678 -19.372 287 1HG GLU 37 HG2 GLU 37 3.216 -12.045 -21.534 288 2HG GLU 37 HG3 GLU 37 4.780 -12.513 -20.884 289 H ILE 38 H ILE 38 3.855 -13.295 -16.737 290 HA ILE 38 HA ILE 38 2.161 -15.415 -15.529 291 HB ILE 38 HB ILE 38 4.694 -14.164 -14.352 292 1HG1 ILE 38 HG12 ILE 38 5.305 -16.799 -14.395 293 2HG1 ILE 38 HG13 ILE 38 4.264 -16.776 -15.805 294 1HG2 ILE 38 HG21 ILE 38 4.399 -15.818 -12.537 295 2HG2 ILE 38 HG22 ILE 38 3.029 -14.721 -12.627 296 3HG2 ILE 38 HG23 ILE 38 2.887 -16.373 -13.277 297 1HD1 ILE 38 HD11 ILE 38 6.571 -16.500 -16.490 298 2HD1 ILE 38 HD12 ILE 38 5.801 -14.932 -16.746 299 3HD1 ILE 38 HD13 ILE 38 6.827 -15.188 -15.329 300 HA PRO 39 HA PRO 39 0.137 -11.554 -14.400 301 1HB PRO 39 HB2 PRO 39 -1.737 -12.440 -12.607 302 2HB PRO 39 HB3 PRO 39 -1.857 -12.723 -14.372 303 1HG PRO 39 HG2 PRO 39 -0.801 -14.619 -12.255 304 2HG PRO 39 HG3 PRO 39 -1.976 -14.964 -13.567 305 1HD PRO 39 HD2 PRO 39 0.676 -15.556 -13.799 306 2HD PRO 39 HD3 PRO 39 -0.275 -14.989 -15.205 307 H ILE 40 H ILE 40 0.175 -10.053 -12.704 308 HA ILE 40 HA ILE 40 1.512 -10.826 -10.152 309 HB ILE 40 HB ILE 40 1.786 -8.304 -11.802 310 1HG1 ILE 40 HG12 ILE 40 3.176 -10.091 -12.711 311 2HG1 ILE 40 HG13 ILE 40 4.106 -8.750 -12.084 312 1HG2 ILE 40 HG21 ILE 40 2.970 -8.872 -9.062 313 2HG2 ILE 40 HG22 ILE 40 3.314 -7.459 -10.091 314 3HG2 ILE 40 HG23 ILE 40 1.702 -7.695 -9.444 315 1HD1 ILE 40 HD11 ILE 40 3.678 -11.398 -10.629 316 2HD1 ILE 40 HD12 ILE 40 5.122 -10.922 -11.536 317 3HD1 ILE 40 HD13 ILE 40 4.692 -10.049 -10.061 318 H VAL 41 H VAL 41 0.182 -10.530 -8.522 319 HA VAL 41 HA VAL 41 -2.289 -8.947 -8.914 320 HB VAL 41 HB VAL 41 -3.244 -10.541 -7.188 321 1HG1 VAL 41 HG11 VAL 41 -2.427 -11.684 -9.889 322 2HG1 VAL 41 HG12 VAL 41 -3.688 -12.342 -8.817 323 3HG1 VAL 41 HG13 VAL 41 -3.886 -10.736 -9.502 324 1HG2 VAL 41 HG21 VAL 41 -0.881 -12.316 -7.932 325 2HG2 VAL 41 HG22 VAL 41 -1.077 -11.491 -6.364 326 3HG2 VAL 41 HG23 VAL 41 -2.245 -12.718 -6.876 327 H ALA 42 H ALA 42 -3.199 -7.983 -7.044 328 HA ALA 42 HA ALA 42 -1.406 -6.459 -5.447 329 1HB ALA 42 HB1 ALA 42 -3.718 -5.772 -6.055 330 2HB ALA 42 HB2 ALA 42 -4.357 -7.116 -5.100 331 3HB ALA 42 HB3 ALA 42 -3.502 -5.794 -4.286 332 H ASP 43 H ASP 43 -0.205 -7.246 -3.794 333 HA ASP 43 HA ASP 43 -0.677 -9.741 -2.468 334 1HB ASP 43 HB2 ASP 43 1.551 -8.761 -2.613 335 2HB ASP 43 HB3 ASP 43 1.023 -7.328 -1.730 336 H ARG 44 H ARG 44 -1.901 -6.491 -1.931 337 HA ARG 44 HA ARG 44 -3.656 -7.368 0.201 338 1HB ARG 44 HB2 ARG 44 -2.896 -5.699 1.826 339 2HB ARG 44 HB3 ARG 44 -1.638 -6.886 1.487 340 1HG ARG 44 HG2 ARG 44 -0.738 -5.086 -0.242 341 2HG ARG 44 HG3 ARG 44 -1.801 -3.979 0.629 342 1HD ARG 44 HD2 ARG 44 0.453 -3.814 1.474 343 2HD ARG 44 HD3 ARG 44 -0.581 -4.519 2.734 344 HE ARG 44 HE ARG 44 0.655 -6.594 1.153 345 1HH1 ARG 44 HH21 ARG 44 1.472 -4.280 3.737 346 2HH1 ARG 44 HH22 ARG 44 2.898 -5.166 4.214 347 1HH2 ARG 44 HH11 ARG 44 2.336 -7.744 1.829 348 2HH2 ARG 44 HH12 ARG 44 3.387 -7.237 3.146 349 H SER 45 H SER 45 -5.323 -5.732 0.583 350 HA SER 45 HA SER 45 -6.016 -4.249 -1.771 351 1HB SER 45 HB2 SER 45 -7.268 -4.158 1.008 352 2HB SER 45 HB3 SER 45 -8.064 -3.836 -0.541 353 HG SER 45 HG SER 45 -8.417 -5.980 0.405 354 H GLY 46 H GLY 46 -6.430 -1.916 -1.889 355 1HA GLY 46 HA2 GLY 46 -6.360 -0.065 0.086 356 2HA GLY 46 HA3 GLY 46 -4.643 -0.225 -0.301 357 H ILE 47 H ILE 47 -5.485 2.200 -0.683 358 HA ILE 47 HA ILE 47 -6.180 2.597 -3.534 359 HB ILE 47 HB ILE 47 -5.628 4.513 -1.231 360 1HG1 ILE 47 HG12 ILE 47 -7.857 3.435 -1.154 361 2HG1 ILE 47 HG13 ILE 47 -7.932 5.174 -1.376 362 1HG2 ILE 47 HG21 ILE 47 -6.165 5.181 -4.150 363 2HG2 ILE 47 HG22 ILE 47 -6.321 6.345 -2.814 364 3HG2 ILE 47 HG23 ILE 47 -4.753 5.624 -3.171 365 1HD1 ILE 47 HD11 ILE 47 -8.338 3.113 -3.588 366 2HD1 ILE 47 HD12 ILE 47 -9.604 4.029 -2.753 367 3HD1 ILE 47 HD13 ILE 47 -8.448 4.877 -3.784 368 H VAL 48 H VAL 48 -4.606 2.962 -5.019 369 HA VAL 48 HA VAL 48 -1.817 2.435 -4.433 370 HB VAL 48 HB VAL 48 -3.129 3.510 -6.924 371 1HG1 VAL 48 HG11 VAL 48 -1.146 2.559 -8.056 372 2HG1 VAL 48 HG12 VAL 48 -0.643 3.784 -6.889 373 3HG1 VAL 48 HG13 VAL 48 -0.460 2.059 -6.495 374 1HG2 VAL 48 HG21 VAL 48 -3.047 1.145 -7.702 375 2HG2 VAL 48 HG22 VAL 48 -2.542 0.636 -6.072 376 3HG2 VAL 48 HG23 VAL 48 -4.142 1.354 -6.346 377 H LYS 49 H LYS 49 -0.575 3.853 -3.378 378 HA LYS 49 HA LYS 49 -1.109 6.748 -3.442 379 1HB LYS 49 HB2 LYS 49 -0.246 5.642 -1.390 380 2HB LYS 49 HB3 LYS 49 1.227 5.170 -2.252 381 1HG LYS 49 HG2 LYS 49 1.761 7.556 -2.649 382 2HG LYS 49 HG3 LYS 49 0.272 8.043 -1.841 383 1HD LYS 49 HD2 LYS 49 2.643 6.590 -0.587 384 2HD LYS 49 HD3 LYS 49 2.269 8.296 -0.405 385 1HE LYS 49 HE2 LYS 49 0.659 5.943 0.678 386 2HE LYS 49 HE3 LYS 49 1.636 7.090 1.595 387 1HZ LYS 49 HZ1 LYS 49 0.052 8.845 0.737 388 2HZ LYS 49 HZ2 LYS 49 -0.940 7.617 0.245 389 3HZ LYS 49 HZ3 LYS 49 -0.566 7.803 1.820 390 H GLU 50 H GLU 50 1.302 4.331 -4.707 391 HA GLU 50 HA GLU 50 1.863 6.110 -6.967 392 1HB GLU 50 HB2 GLU 50 3.285 6.948 -5.018 393 2HB GLU 50 HB3 GLU 50 4.112 5.389 -5.022 394 1HG GLU 50 HG2 GLU 50 4.977 5.799 -7.260 395 2HG GLU 50 HG3 GLU 50 3.943 7.219 -7.457 396 H VAL 51 H VAL 51 3.286 4.991 -8.559 397 HA VAL 51 HA VAL 51 3.358 2.031 -8.227 398 HB VAL 51 HB VAL 51 2.963 3.541 -10.844 399 1HG1 VAL 51 HG11 VAL 51 2.588 0.594 -10.110 400 2HG1 VAL 51 HG12 VAL 51 2.315 1.329 -11.705 401 3HG1 VAL 51 HG13 VAL 51 3.947 1.262 -11.037 402 1HG2 VAL 51 HG21 VAL 51 0.851 2.168 -9.133 403 2HG2 VAL 51 HG22 VAL 51 0.924 3.906 -9.510 404 3HG2 VAL 51 HG23 VAL 51 0.607 2.749 -10.799 405 H LYS 52 H LYS 52 5.361 1.166 -8.547 406 HA LYS 52 HA LYS 52 7.570 3.149 -8.685 407 1HB LYS 52 HB2 LYS 52 7.505 0.276 -7.680 408 2HB LYS 52 HB3 LYS 52 8.849 1.403 -7.500 409 1HG LYS 52 HG2 LYS 52 6.110 1.619 -6.175 410 2HG LYS 52 HG3 LYS 52 7.627 1.146 -5.420 411 1HD LYS 52 HD2 LYS 52 8.564 3.404 -5.832 412 2HD LYS 52 HD3 LYS 52 7.007 3.912 -6.543 413 1HE LYS 52 HE2 LYS 52 5.838 3.459 -4.475 414 2HE LYS 52 HE3 LYS 52 7.291 2.772 -3.734 415 1HZ LYS 52 HZ1 LYS 52 7.043 5.606 -4.584 416 2HZ LYS 52 HZ2 LYS 52 6.795 5.059 -3.055 417 3HZ LYS 52 HZ3 LYS 52 8.289 4.940 -3.741 418 H LYS 53 H LYS 53 6.107 1.015 -10.833 419 HA LYS 53 HA LYS 53 8.576 0.679 -12.438 420 1HB LYS 53 HB2 LYS 53 6.605 -1.534 -11.685 421 2HB LYS 53 HB3 LYS 53 7.849 -1.683 -12.925 422 1HG LYS 53 HG2 LYS 53 8.458 -1.172 -9.991 423 2HG LYS 53 HG3 LYS 53 8.426 -2.759 -10.755 424 1HD LYS 53 HD2 LYS 53 10.198 -2.061 -12.335 425 2HD LYS 53 HD3 LYS 53 10.279 -0.466 -11.560 426 1HE LYS 53 HE2 LYS 53 11.005 -1.446 -9.453 427 2HE LYS 53 HE3 LYS 53 10.722 -3.074 -10.045 428 1HZ LYS 53 HZ1 LYS 53 12.832 -1.226 -10.971 429 2HZ LYS 53 HZ2 LYS 53 12.974 -2.703 -10.229 430 3HZ LYS 53 HZ3 LYS 53 12.448 -2.624 -11.768 431 H LYS 54 H LYS 54 7.806 -0.323 -14.663 432 HA LYS 54 HA LYS 54 5.252 0.791 -15.577 433 1HB LYS 54 HB2 LYS 54 6.288 2.275 -17.202 434 2HB LYS 54 HB3 LYS 54 6.811 2.714 -15.583 435 1HG LYS 54 HG2 LYS 54 8.933 1.256 -16.100 436 2HG LYS 54 HG3 LYS 54 8.388 1.318 -17.773 437 1HD LYS 54 HD2 LYS 54 9.942 3.083 -17.594 438 2HD LYS 54 HD3 LYS 54 8.372 3.879 -17.499 439 1HE LYS 54 HE2 LYS 54 9.689 4.881 -15.801 440 2HE LYS 54 HE3 LYS 54 8.596 3.794 -14.947 441 1HZ LYS 54 HZ1 LYS 54 10.860 3.623 -14.127 442 2HZ LYS 54 HZ2 LYS 54 10.470 2.184 -14.789 443 3HZ LYS 54 HZ3 LYS 54 11.438 3.233 -15.594 444 H GLU 55 H GLU 55 5.061 0.314 -18.017 445 HA GLU 55 HA GLU 55 5.542 -2.443 -18.507 446 1HB GLU 55 HB2 GLU 55 5.085 -0.304 -20.636 447 2HB GLU 55 HB3 GLU 55 4.750 -2.027 -20.730 448 1HG GLU 55 HG2 GLU 55 2.631 -1.348 -20.312 449 2HG GLU 55 HG3 GLU 55 3.147 -1.464 -18.635 450 H GLY 56 H GLY 56 7.322 -3.496 -19.216 451 1HA GLY 56 HA2 GLY 56 9.195 -3.934 -20.457 452 2HA GLY 56 HA3 GLY 56 9.327 -2.234 -20.929 453 H ASP 57 H ASP 57 8.945 -2.300 -17.537 454 HA ASP 57 HA ASP 57 11.699 -1.508 -17.151 455 1HB ASP 57 HB2 ASP 57 9.481 -0.843 -15.888 456 2HB ASP 57 HB3 ASP 57 9.860 -2.215 -14.859 457 H PHE 58 H PHE 58 13.194 -2.571 -15.624 458 HA PHE 58 HA PHE 58 13.204 -5.534 -15.832 459 1HB PHE 58 HB2 PHE 58 15.331 -4.374 -16.171 460 2HB PHE 58 HB3 PHE 58 15.121 -3.490 -14.667 461 HD1 PHE 58 HD1 PHE 58 15.928 -6.807 -16.135 462 HD2 PHE 58 HD2 PHE 58 15.619 -4.503 -12.500 463 HE1 PHE 58 HE1 PHE 58 17.160 -8.573 -14.908 464 HE2 PHE 58 HE2 PHE 58 16.860 -6.269 -11.279 465 HZ PHE 58 HZ PHE 58 17.649 -8.299 -12.486 466 H VAL 59 H VAL 59 12.881 -6.856 -13.974 467 HA VAL 59 HA VAL 59 12.326 -5.552 -11.403 468 HB VAL 59 HB VAL 59 10.220 -6.964 -11.226 469 1HG1 VAL 59 HG11 VAL 59 8.777 -5.200 -12.167 470 2HG1 VAL 59 HG12 VAL 59 10.168 -4.539 -11.303 471 3HG1 VAL 59 HG13 VAL 59 10.136 -4.555 -13.089 472 1HG2 VAL 59 HG21 VAL 59 10.475 -8.291 -13.304 473 2HG2 VAL 59 HG22 VAL 59 8.931 -7.412 -13.234 474 3HG2 VAL 59 HG23 VAL 59 10.239 -6.814 -14.268 475 H ASN 60 H ASN 60 12.071 -7.144 -9.651 476 HA ASN 60 HA ASN 60 13.432 -9.673 -10.149 477 1HB ASN 60 HB2 ASN 60 14.984 -7.446 -9.557 478 2HB ASN 60 HB3 ASN 60 14.693 -8.134 -7.959 479 1HD2 ASN 60 HD22 ASN 60 15.538 -9.095 -11.330 480 2HD2 ASN 60 HD21 ASN 60 16.680 -10.344 -10.873 481 H GLU 61 H GLU 61 13.719 -10.911 -8.089 482 HA GLU 61 HA GLU 61 11.201 -11.178 -6.763 483 1HB GLU 61 HB2 GLU 61 12.713 -13.044 -7.173 484 2HB GLU 61 HB3 GLU 61 13.986 -12.294 -6.219 485 1HG GLU 61 HG2 GLU 61 12.473 -12.455 -4.193 486 2HG GLU 61 HG3 GLU 61 11.271 -13.259 -5.200 487 H GLY 62 H GLY 62 10.420 -9.670 -5.407 488 1HA GLY 62 HA2 GLY 62 10.300 -8.635 -3.337 489 2HA GLY 62 HA3 GLY 62 12.059 -8.686 -3.160 490 H ASP 63 H ASP 63 11.328 -7.563 -6.341 491 HA ASP 63 HA ASP 63 12.179 -4.872 -5.619 492 1HB ASP 63 HB2 ASP 63 12.856 -6.235 -7.692 493 2HB ASP 63 HB3 ASP 63 11.249 -5.897 -8.329 494 H VAL 64 H VAL 64 10.770 -3.163 -5.285 495 HA VAL 64 HA VAL 64 8.048 -3.775 -4.791 496 HB VAL 64 HB VAL 64 9.233 -0.985 -5.046 497 1HG1 VAL 64 HG11 VAL 64 6.924 -2.114 -3.383 498 2HG1 VAL 64 HG12 VAL 64 7.532 -0.448 -3.295 499 3HG1 VAL 64 HG13 VAL 64 6.770 -1.025 -4.774 500 1HG2 VAL 64 HG21 VAL 64 9.305 -2.890 -2.661 501 2HG2 VAL 64 HG22 VAL 64 10.708 -2.224 -3.528 502 3HG2 VAL 64 HG23 VAL 64 9.679 -1.155 -2.583 503 H LEU 65 H LEU 65 6.162 -3.180 -5.837 504 HA LEU 65 HA LEU 65 6.382 -2.557 -8.752 505 1HB LEU 65 HB2 LEU 65 5.646 -4.822 -8.257 506 2HB LEU 65 HB3 LEU 65 4.412 -4.261 -7.154 507 HG LEU 65 HG LEU 65 3.693 -5.076 -9.384 508 1HD1 LEU 65 HD11 LEU 65 1.854 -3.611 -9.687 509 2HD1 LEU 65 HD12 LEU 65 2.190 -3.746 -7.957 510 3HD1 LEU 65 HD13 LEU 65 2.675 -2.285 -8.861 511 1HD2 LEU 65 HD21 LEU 65 5.438 -3.883 -10.754 512 2HD2 LEU 65 HD22 LEU 65 3.774 -3.681 -11.342 513 3HD2 LEU 65 HD23 LEU 65 4.566 -2.366 -10.461 514 H LEU 66 H LEU 66 4.302 -2.192 -5.803 515 HA LEU 66 HA LEU 66 3.988 0.636 -6.529 516 1HB LEU 66 HB2 LEU 66 1.580 0.715 -6.491 517 2HB LEU 66 HB3 LEU 66 2.149 -0.336 -7.755 518 HG LEU 66 HG LEU 66 1.645 -2.291 -6.165 519 1HD1 LEU 66 HD11 LEU 66 1.325 -1.181 -4.010 520 2HD1 LEU 66 HD12 LEU 66 0.137 -0.069 -4.724 521 3HD1 LEU 66 HD13 LEU 66 -0.226 -1.800 -4.528 522 1HD2 LEU 66 HD21 LEU 66 -0.723 -2.325 -6.773 523 2HD2 LEU 66 HD22 LEU 66 -0.645 -0.592 -7.180 524 3HD2 LEU 66 HD23 LEU 66 0.286 -1.797 -8.107 525 H GLU 67 H GLU 67 2.675 1.822 -4.865 526 HA GLU 67 HA GLU 67 3.171 0.810 -2.124 527 1HB GLU 67 HB2 GLU 67 5.031 2.251 -2.734 528 2HB GLU 67 HB3 GLU 67 3.930 3.515 -3.309 529 1HG GLU 67 HG2 GLU 67 3.153 3.957 -1.065 530 2HG GLU 67 HG3 GLU 67 3.974 2.516 -0.443 531 H LEU 68 H LEU 68 1.611 1.622 -0.626 532 HA LEU 68 HA LEU 68 -0.925 2.509 -1.917 533 1HB LEU 68 HB2 LEU 68 -0.445 0.490 0.322 534 2HB LEU 68 HB3 LEU 68 -2.028 1.028 -0.219 535 HG LEU 68 HG LEU 68 -0.061 -0.515 -1.949 536 1HD1 LEU 68 HD11 LEU 68 -0.930 -1.863 -0.079 537 2HD1 LEU 68 HD12 LEU 68 -2.593 -1.443 -0.539 538 3HD1 LEU 68 HD13 LEU 68 -1.587 -2.410 -1.634 539 1HD2 LEU 68 HD21 LEU 68 -2.955 0.349 -2.401 540 2HD2 LEU 68 HD22 LEU 68 -1.504 0.826 -3.314 541 3HD2 LEU 68 HD23 LEU 68 -2.084 -0.816 -3.408 542 H SER 69 H SER 69 -2.316 3.791 -0.670 543 HA SER 69 HA SER 69 -1.188 5.255 1.592 544 1HB SER 69 HB2 SER 69 -3.968 5.212 0.353 545 2HB SER 69 HB3 SER 69 -3.418 6.352 1.599 546 HG SER 69 HG SER 69 -3.226 7.075 -0.652 547 H ASN 70 H ASN 70 -2.767 2.226 1.229 548 HA ASN 70 HA ASN 70 -3.747 2.065 4.001 549 1HB ASN 70 HB2 ASN 70 -4.901 0.729 2.281 550 2HB ASN 70 HB3 ASN 70 -3.380 -0.079 1.865 551 1HD2 ASN 70 HD22 ASN 70 -4.456 -2.145 2.404 552 2HD2 ASN 70 HD21 ASN 70 -4.621 -2.607 4.087 553 H SER 71 H SER 71 -1.677 2.920 4.803 554 HA SER 71 HA SER 71 0.799 1.593 4.488 555 1HB SER 71 HB2 SER 71 -0.115 3.471 6.703 556 2HB SER 71 HB3 SER 71 1.556 3.137 6.207 557 HG SER 71 HG SER 71 0.734 5.072 5.292 558 H THR 72 H THR 72 -0.086 -0.663 4.854 559 HA THR 72 HA THR 72 -0.869 -1.661 7.352 560 HB THR 72 HB THR 72 0.129 -3.839 6.322 561 HG1 THR 72 HG1 THR 72 1.521 -2.436 4.877 562 1HG2 THR 72 HG21 THR 72 -1.865 -2.269 4.640 563 2HG2 THR 72 HG22 THR 72 -1.677 -4.035 4.712 564 3HG2 THR 72 HG23 THR 72 -2.270 -3.154 6.128 565 H GLN 73 H GLN 73 2.346 -0.640 6.369 566 HA GLN 73 HA GLN 73 3.592 -1.674 8.825 567 1HB GLN 73 HB2 GLN 73 4.548 -2.260 5.977 568 2HB GLN 73 HB3 GLN 73 5.526 -2.485 7.425 569 1HG GLN 73 HG2 GLN 73 3.971 -4.194 8.267 570 2HG GLN 73 HG3 GLN 73 2.907 -3.952 6.876 571 1HE2 GLN 73 HE22 GLN 73 6.213 -5.060 7.780 572 2HE2 GLN 73 HE21 GLN 73 6.426 -6.065 6.367 Start of MODEL 20 1 1H THR 2 H1 THR 2 3.187 -2.699 1.378 2 2H THR 2 H2 THR 2 3.283 -1.091 0.989 3 3H THR 2 H3 THR 2 2.096 -2.029 0.340 4 HA THR 2 HA THR 2 3.910 -1.485 -1.187 5 HB THR 2 HB THR 2 5.531 -3.384 0.554 6 HG1 THR 2 HG1 THR 2 6.529 -1.600 1.373 7 1HG2 THR 2 HG21 THR 2 6.297 -3.214 -1.806 8 2HG2 THR 2 HG22 THR 2 6.336 -1.440 -1.659 9 3HG2 THR 2 HG23 THR 2 7.447 -2.448 -0.707 10 H VAL 3 H VAL 3 3.952 -2.817 -3.040 11 HA VAL 3 HA VAL 3 3.372 -5.701 -2.694 12 HB VAL 3 HB VAL 3 2.080 -3.948 -4.820 13 1HG1 VAL 3 HG11 VAL 3 1.680 -6.898 -4.171 14 2HG1 VAL 3 HG12 VAL 3 0.793 -5.963 -5.400 15 3HG1 VAL 3 HG13 VAL 3 2.518 -6.245 -5.595 16 1HG2 VAL 3 HG21 VAL 3 -0.103 -4.497 -3.736 17 2HG2 VAL 3 HG22 VAL 3 0.787 -5.218 -2.371 18 3HG2 VAL 3 HG23 VAL 3 0.920 -3.486 -2.719 19 H SER 4 H SER 4 4.734 -6.895 -4.040 20 HA SER 4 HA SER 4 6.686 -5.445 -5.742 21 1HB SER 4 HB2 SER 4 7.346 -7.376 -3.483 22 2HB SER 4 HB3 SER 4 8.502 -6.532 -4.522 23 HG SER 4 HG SER 4 8.179 -5.543 -2.446 24 H ILE 5 H ILE 5 7.939 -6.857 -7.087 25 HA ILE 5 HA ILE 5 6.365 -9.031 -8.228 26 HB ILE 5 HB ILE 5 9.176 -8.065 -8.912 27 1HG1 ILE 5 HG12 ILE 5 7.825 -6.098 -9.089 28 2HG1 ILE 5 HG13 ILE 5 8.101 -6.701 -10.703 29 1HG2 ILE 5 HG21 ILE 5 8.650 -8.913 -11.200 30 2HG2 ILE 5 HG22 ILE 5 8.689 -10.186 -10.002 31 3HG2 ILE 5 HG23 ILE 5 7.126 -9.585 -10.592 32 1HD1 ILE 5 HD11 ILE 5 5.823 -5.921 -10.473 33 2HD1 ILE 5 HD12 ILE 5 5.824 -7.666 -10.768 34 3HD1 ILE 5 HD13 ILE 5 5.525 -7.032 -9.130 35 H GLN 6 H GLN 6 7.125 -11.272 -8.359 36 HA GLN 6 HA GLN 6 8.872 -12.012 -6.052 37 1HB GLN 6 HB2 GLN 6 6.720 -13.813 -7.149 38 2HB GLN 6 HB3 GLN 6 7.526 -13.833 -5.593 39 1HG GLN 6 HG2 GLN 6 5.503 -13.011 -4.937 40 2HG GLN 6 HG3 GLN 6 6.319 -11.486 -5.242 41 1HE2 GLN 6 HE22 GLN 6 4.906 -10.053 -6.356 42 2HE2 GLN 6 HE21 GLN 6 3.734 -10.589 -7.542 43 H MET 7 H MET 7 9.431 -11.643 -9.139 44 HA MET 7 HA MET 7 11.041 -14.088 -9.498 45 1HB MET 7 HB2 MET 7 9.088 -12.975 -11.558 46 2HB MET 7 HB3 MET 7 10.322 -14.132 -11.913 47 1HG MET 7 HG2 MET 7 8.317 -15.254 -11.914 48 2HG MET 7 HG3 MET 7 9.256 -15.825 -10.532 49 1HE MET 7 HE1 MET 7 5.321 -13.388 -10.407 50 2HE MET 7 HE2 MET 7 6.854 -12.628 -10.900 51 3HE MET 7 HE3 MET 7 6.155 -13.942 -11.875 52 H ALA 8 H ALA 8 12.583 -13.729 -11.227 53 HA ALA 8 HA ALA 8 13.405 -10.898 -11.642 54 1HB ALA 8 HB1 ALA 8 15.161 -12.440 -10.837 55 2HB ALA 8 HB2 ALA 8 14.837 -13.530 -12.208 56 3HB ALA 8 HB3 ALA 8 15.490 -11.905 -12.502 57 H GLY 9 H GLY 9 12.998 -9.926 -13.607 58 1HA GLY 9 HA2 GLY 9 12.895 -11.216 -16.107 59 2HA GLY 9 HA3 GLY 9 11.265 -11.285 -15.440 60 H ASN 10 H ASN 10 10.341 -9.863 -16.925 61 HA ASN 10 HA ASN 10 11.089 -6.981 -16.631 62 1HB ASN 10 HB2 ASN 10 10.789 -8.584 -19.187 63 2HB ASN 10 HB3 ASN 10 10.246 -6.912 -19.133 64 1HD2 ASN 10 HD22 ASN 10 13.149 -7.799 -17.201 65 2HD2 ASN 10 HD21 ASN 10 14.265 -7.030 -18.308 66 H LEU 11 H LEU 11 9.299 -5.655 -16.562 67 HA LEU 11 HA LEU 11 6.931 -7.046 -15.634 68 1HB LEU 11 HB2 LEU 11 8.144 -5.150 -14.482 69 2HB LEU 11 HB3 LEU 11 7.517 -4.067 -15.715 70 HG LEU 11 HG LEU 11 5.173 -4.730 -15.027 71 1HD1 LEU 11 HD11 LEU 11 6.661 -6.290 -12.866 72 2HD1 LEU 11 HD12 LEU 11 4.949 -5.838 -12.759 73 3HD1 LEU 11 HD13 LEU 11 5.484 -6.930 -14.029 74 1HD2 LEU 11 HD21 LEU 11 5.249 -3.437 -12.929 75 2HD2 LEU 11 HD22 LEU 11 6.995 -3.710 -12.803 76 3HD2 LEU 11 HD23 LEU 11 6.326 -2.739 -14.142 77 H TRP 12 H TRP 12 6.417 -7.872 -17.757 78 HA TRP 12 HA TRP 12 5.979 -6.976 -20.146 79 1HB TRP 12 HB2 TRP 12 5.245 -9.177 -19.011 80 2HB TRP 12 HB3 TRP 12 3.699 -8.409 -18.755 81 HD1 TRP 12 HD1 TRP 12 6.065 -9.197 -21.664 82 HE1 TRP 12 HE1 TRP 12 4.734 -9.901 -23.731 83 HE3 TRP 12 HE3 TRP 12 1.355 -8.503 -19.824 84 HZ2 TRP 12 HZ2 TRP 12 1.939 -10.178 -24.473 85 HZ3 TRP 12 HZ3 TRP 12 -0.630 -9.041 -21.209 86 HH2 TRP 12 HH2 TRP 12 -0.350 -9.871 -23.534 87 H LYS 13 H LYS 13 3.315 -6.433 -17.751 88 HA LYS 13 HA LYS 13 2.688 -3.846 -18.965 89 1HB LYS 13 HB2 LYS 13 0.703 -6.163 -18.854 90 2HB LYS 13 HB3 LYS 13 0.219 -4.470 -19.024 91 1HG LYS 13 HG2 LYS 13 1.567 -4.328 -21.133 92 2HG LYS 13 HG3 LYS 13 1.891 -6.069 -20.997 93 1HD LYS 13 HD2 LYS 13 -0.604 -6.462 -20.968 94 2HD LYS 13 HD3 LYS 13 -0.841 -4.752 -21.329 95 1HE LYS 13 HE2 LYS 13 0.735 -6.737 -23.042 96 2HE LYS 13 HE3 LYS 13 -0.939 -6.262 -23.333 97 1HZ LYS 13 HZ1 LYS 13 -0.175 -3.983 -23.680 98 2HZ LYS 13 HZ2 LYS 13 1.385 -4.427 -23.447 99 3HZ LYS 13 HZ3 LYS 13 0.551 -5.001 -24.720 100 H VAL 14 H VAL 14 1.101 -2.685 -17.543 101 HA VAL 14 HA VAL 14 0.929 -3.633 -14.754 102 HB VAL 14 HB VAL 14 2.048 -0.924 -15.633 103 1HG1 VAL 14 HG11 VAL 14 2.420 -0.556 -13.168 104 2HG1 VAL 14 HG12 VAL 14 0.718 -0.587 -13.615 105 3HG1 VAL 14 HG13 VAL 14 1.455 -2.009 -12.837 106 1HG2 VAL 14 HG21 VAL 14 4.070 -1.683 -14.348 107 2HG2 VAL 14 HG22 VAL 14 3.305 -3.288 -14.190 108 3HG2 VAL 14 HG23 VAL 14 3.768 -2.654 -15.787 109 H HIS 15 H HIS 15 -0.946 -2.822 -13.754 110 HA HIS 15 HA HIS 15 -2.926 -1.545 -15.586 111 1HB HIS 15 HB2 HIS 15 -3.606 -3.728 -13.621 112 2HB HIS 15 HB3 HIS 15 -4.493 -3.215 -15.049 113 HD1 HIS 15 HD1 HIS 15 -2.289 -3.691 -17.311 114 HD2 HIS 15 HD2 HIS 15 -2.956 -6.149 -13.967 115 HE1 HIS 15 HE1 HIS 15 -1.240 -5.964 -17.849 116 H VAL 16 H VAL 16 -1.330 -0.274 -13.370 117 HA VAL 16 HA VAL 16 -3.603 0.702 -11.729 118 HB VAL 16 HB VAL 16 -2.057 0.889 -9.800 119 1HG1 VAL 16 HG11 VAL 16 -2.232 -1.401 -9.017 120 2HG1 VAL 16 HG12 VAL 16 -3.704 -0.927 -9.879 121 3HG1 VAL 16 HG13 VAL 16 -2.519 -1.982 -10.676 122 1HG2 VAL 16 HG21 VAL 16 -0.231 -1.162 -11.070 123 2HG2 VAL 16 HG22 VAL 16 0.095 0.579 -11.192 124 3HG2 VAL 16 HG23 VAL 16 -0.005 -0.171 -9.607 125 H LYS 17 H LYS 17 -3.115 2.785 -10.697 126 HA LYS 17 HA LYS 17 -0.893 4.350 -11.659 127 1HB LYS 17 HB2 LYS 17 -2.282 6.249 -12.414 128 2HB LYS 17 HB3 LYS 17 -2.481 4.843 -13.458 129 1HG LYS 17 HG2 LYS 17 -4.645 4.311 -12.374 130 2HG LYS 17 HG3 LYS 17 -4.446 5.688 -11.272 131 1HD LYS 17 HD2 LYS 17 -4.442 7.237 -13.208 132 2HD LYS 17 HD3 LYS 17 -4.652 5.856 -14.309 133 1HE LYS 17 HE2 LYS 17 -6.787 5.281 -13.169 134 2HE LYS 17 HE3 LYS 17 -6.578 6.654 -12.074 135 1HZ LYS 17 HZ1 LYS 17 -6.916 6.856 -15.012 136 2HZ LYS 17 HZ2 LYS 17 -8.056 7.196 -13.901 137 3HZ LYS 17 HZ3 LYS 17 -6.722 8.126 -14.000 138 H ALA 18 H ALA 18 -0.724 6.309 -10.220 139 HA ALA 18 HA ALA 18 -1.499 5.856 -7.515 140 1HB ALA 18 HB1 ALA 18 0.368 7.343 -8.128 141 2HB ALA 18 HB2 ALA 18 -0.766 8.463 -8.924 142 3HB ALA 18 HB3 ALA 18 -0.843 8.215 -7.168 143 H GLY 19 H GLY 19 -3.359 6.331 -6.419 144 1HA GLY 19 HA2 GLY 19 -5.364 7.409 -5.942 145 2HA GLY 19 HA3 GLY 19 -5.426 8.095 -7.571 146 H ASP 20 H ASP 20 -4.676 4.961 -8.280 147 HA ASP 20 HA ASP 20 -7.423 4.120 -8.763 148 1HB ASP 20 HB2 ASP 20 -5.429 3.519 -10.208 149 2HB ASP 20 HB3 ASP 20 -4.866 2.475 -8.889 150 H GLN 21 H GLN 21 -8.064 1.858 -7.926 151 HA GLN 21 HA GLN 21 -7.207 1.410 -5.107 152 1HB GLN 21 HB2 GLN 21 -9.357 2.555 -5.069 153 2HB GLN 21 HB3 GLN 21 -10.042 1.431 -6.226 154 1HG GLN 21 HG2 GLN 21 -8.904 0.240 -3.698 155 2HG GLN 21 HG3 GLN 21 -10.343 1.229 -3.522 156 1HE2 GLN 21 HE22 GLN 21 -9.456 -1.946 -3.822 157 2HE2 GLN 21 HE21 GLN 21 -10.910 -2.552 -4.585 158 H ILE 22 H ILE 22 -6.824 -0.701 -4.643 159 HA ILE 22 HA ILE 22 -7.489 -2.757 -6.683 160 HB ILE 22 HB ILE 22 -5.358 -3.794 -6.430 161 1HG1 ILE 22 HG12 ILE 22 -4.653 -1.635 -4.396 162 2HG1 ILE 22 HG13 ILE 22 -4.849 -3.367 -4.100 163 1HG2 ILE 22 HG21 ILE 22 -5.599 -1.955 -8.101 164 2HG2 ILE 22 HG22 ILE 22 -4.870 -0.830 -6.935 165 3HG2 ILE 22 HG23 ILE 22 -3.932 -2.187 -7.565 166 1HD1 ILE 22 HD11 ILE 22 -2.629 -1.990 -5.634 167 2HD1 ILE 22 HD12 ILE 22 -2.520 -3.004 -4.175 168 3HD1 ILE 22 HD13 ILE 22 -2.904 -3.742 -5.727 169 H GLU 23 H GLU 23 -7.430 -4.960 -5.715 170 HA GLU 23 HA GLU 23 -8.242 -5.032 -2.873 171 1HB GLU 23 HB2 GLU 23 -10.254 -4.823 -4.255 172 2HB GLU 23 HB3 GLU 23 -9.749 -6.209 -5.238 173 1HG GLU 23 HG2 GLU 23 -9.918 -7.677 -3.245 174 2HG GLU 23 HG3 GLU 23 -10.343 -6.286 -2.245 175 H LYS 24 H LYS 24 -7.568 -6.982 -1.870 176 HA LYS 24 HA LYS 24 -5.278 -8.252 -2.737 177 1HB LYS 24 HB2 LYS 24 -6.282 -8.350 -0.449 178 2HB LYS 24 HB3 LYS 24 -7.495 -9.489 -1.043 179 1HG LYS 24 HG2 LYS 24 -5.700 -11.111 -1.621 180 2HG LYS 24 HG3 LYS 24 -4.479 -9.957 -1.081 181 1HD LYS 24 HD2 LYS 24 -5.587 -10.025 1.235 182 2HD LYS 24 HD3 LYS 24 -6.662 -11.272 0.597 183 1HE LYS 24 HE2 LYS 24 -5.038 -12.563 1.631 184 2HE LYS 24 HE3 LYS 24 -4.494 -12.558 -0.049 185 1HZ LYS 24 HZ1 LYS 24 -3.419 -10.932 2.180 186 2HZ LYS 24 HZ2 LYS 24 -2.642 -12.109 1.364 187 3HZ LYS 24 HZ3 LYS 24 -2.978 -10.679 0.630 188 H GLY 25 H GLY 25 -4.754 -9.711 -4.307 189 1HA GLY 25 HA2 GLY 25 -4.962 -11.615 -5.590 190 2HA GLY 25 HA3 GLY 25 -6.658 -11.778 -5.128 191 H GLN 26 H GLN 26 -6.587 -8.599 -6.104 192 HA GLN 26 HA GLN 26 -7.588 -9.089 -8.773 193 1HB GLN 26 HB2 GLN 26 -8.070 -7.048 -7.255 194 2HB GLN 26 HB3 GLN 26 -6.423 -6.508 -7.647 195 1HG GLN 26 HG2 GLN 26 -7.303 -6.842 -10.166 196 2HG GLN 26 HG3 GLN 26 -8.878 -6.707 -9.406 197 1HE2 GLN 26 HE22 GLN 26 -6.071 -5.021 -10.530 198 2HE2 GLN 26 HE21 GLN 26 -6.560 -3.408 -10.027 199 H GLU 27 H GLU 27 -6.397 -9.028 -10.710 200 HA GLU 27 HA GLU 27 -3.503 -9.184 -10.686 201 1HB GLU 27 HB2 GLU 27 -5.052 -10.260 -12.357 202 2HB GLU 27 HB3 GLU 27 -5.445 -8.651 -12.975 203 1HG GLU 27 HG2 GLU 27 -3.028 -8.340 -13.568 204 2HG GLU 27 HG3 GLU 27 -2.682 -9.950 -12.940 205 H VAL 28 H VAL 28 -2.060 -7.536 -10.977 206 HA VAL 28 HA VAL 28 -3.028 -4.776 -11.515 207 HB VAL 28 HB VAL 28 -1.435 -3.995 -9.721 208 1HG1 VAL 28 HG11 VAL 28 -3.021 -4.322 -7.902 209 2HG1 VAL 28 HG12 VAL 28 -3.884 -3.997 -9.412 210 3HG1 VAL 28 HG13 VAL 28 -3.812 -5.650 -8.764 211 1HG2 VAL 28 HG21 VAL 28 -0.850 -5.490 -7.893 212 2HG2 VAL 28 HG22 VAL 28 -1.637 -6.850 -8.707 213 3HG2 VAL 28 HG23 VAL 28 -0.164 -6.135 -9.398 214 H ALA 29 H ALA 29 -0.551 -7.261 -12.000 215 HA ALA 29 HA ALA 29 0.355 -5.688 -14.247 216 1HB ALA 29 HB1 ALA 29 2.765 -5.732 -13.639 217 2HB ALA 29 HB2 ALA 29 1.847 -4.726 -12.519 218 3HB ALA 29 HB3 ALA 29 2.365 -6.346 -12.027 219 H ILE 30 H ILE 30 2.263 -7.046 -15.285 220 HA ILE 30 HA ILE 30 1.913 -9.959 -14.850 221 HB ILE 30 HB ILE 30 1.637 -8.484 -17.502 222 1HG1 ILE 30 HG12 ILE 30 -0.192 -10.538 -16.166 223 2HG1 ILE 30 HG13 ILE 30 -0.442 -8.799 -16.113 224 1HG2 ILE 30 HG21 ILE 30 1.956 -11.494 -17.064 225 2HG2 ILE 30 HG22 ILE 30 1.638 -10.701 -18.622 226 3HG2 ILE 30 HG23 ILE 30 3.167 -10.440 -17.823 227 1HD1 ILE 30 HD11 ILE 30 -1.901 -9.712 -17.763 228 2HD1 ILE 30 HD12 ILE 30 -0.677 -8.723 -18.572 229 3HD1 ILE 30 HD13 ILE 30 -0.572 -10.503 -18.615 230 H LEU 31 H LEU 31 3.814 -11.014 -15.042 231 HA LEU 31 HA LEU 31 6.327 -9.480 -15.540 232 1HB LEU 31 HB2 LEU 31 6.111 -10.266 -13.301 233 2HB LEU 31 HB3 LEU 31 5.572 -11.872 -13.796 234 HG LEU 31 HG LEU 31 7.819 -11.681 -12.769 235 1HD1 LEU 31 HD11 LEU 31 8.932 -13.293 -14.141 236 2HD1 LEU 31 HD12 LEU 31 7.209 -13.655 -14.016 237 3HD1 LEU 31 HD13 LEU 31 7.853 -12.953 -15.506 238 1HD2 LEU 31 HD21 LEU 31 8.454 -9.564 -13.993 239 2HD2 LEU 31 HD22 LEU 31 9.695 -10.819 -13.864 240 3HD2 LEU 31 HD23 LEU 31 8.822 -10.584 -15.397 241 H GLU 32 H GLU 32 7.602 -10.231 -17.215 242 HA GLU 32 HA GLU 32 6.822 -12.749 -18.581 243 1HB GLU 32 HB2 GLU 32 6.595 -10.684 -19.937 244 2HB GLU 32 HB3 GLU 32 8.317 -10.364 -19.759 245 1HG GLU 32 HG2 GLU 32 7.180 -12.932 -20.957 246 2HG GLU 32 HG3 GLU 32 7.449 -11.488 -21.911 247 H SER 33 H SER 33 8.244 -14.344 -18.223 248 HA SER 33 HA SER 33 11.030 -13.965 -18.339 249 1HB SER 33 HB2 SER 33 10.477 -13.266 -15.884 250 2HB SER 33 HB3 SER 33 10.171 -14.986 -15.609 251 HG SER 33 HG SER 33 12.358 -14.035 -15.263 252 H MET 34 H MET 34 12.088 -16.227 -17.959 253 HA MET 34 HA MET 34 12.246 -18.269 -18.933 254 1HB MET 34 HB2 MET 34 9.529 -18.800 -17.645 255 2HB MET 34 HB3 MET 34 10.658 -19.997 -18.242 256 1HG MET 34 HG2 MET 34 10.883 -20.014 -15.925 257 2HG MET 34 HG3 MET 34 12.337 -19.281 -16.576 258 1HE MET 34 HE1 MET 34 9.061 -16.886 -14.246 259 2HE MET 34 HE2 MET 34 8.792 -17.467 -15.896 260 3HE MET 34 HE3 MET 34 8.944 -18.633 -14.563 261 H LYS 35 H LYS 35 10.924 -16.069 -20.460 262 HA LYS 35 HA LYS 35 9.641 -15.562 -22.198 263 1HB LYS 35 HB2 LYS 35 10.506 -18.243 -23.317 264 2HB LYS 35 HB3 LYS 35 9.876 -16.877 -24.231 265 1HG LYS 35 HG2 LYS 35 12.533 -17.072 -22.774 266 2HG LYS 35 HG3 LYS 35 12.256 -16.903 -24.500 267 1HD LYS 35 HD2 LYS 35 11.805 -14.770 -22.365 268 2HD LYS 35 HD3 LYS 35 13.097 -14.825 -23.559 269 1HE LYS 35 HE2 LYS 35 11.487 -14.547 -25.393 270 2HE LYS 35 HE3 LYS 35 10.134 -14.580 -24.253 271 1HZ LYS 35 HZ1 LYS 35 10.781 -12.325 -24.898 272 2HZ LYS 35 HZ2 LYS 35 10.913 -12.525 -23.284 273 3HZ LYS 35 HZ3 LYS 35 12.257 -12.515 -24.239 274 H MET 36 H MET 36 8.196 -16.309 -20.098 275 HA MET 36 HA MET 36 5.672 -17.185 -21.340 276 1HB MET 36 HB2 MET 36 6.853 -18.149 -18.684 277 2HB MET 36 HB3 MET 36 5.147 -18.303 -19.101 278 1HG MET 36 HG2 MET 36 7.421 -19.560 -20.676 279 2HG MET 36 HG3 MET 36 6.442 -20.381 -19.467 280 1HE MET 36 HE1 MET 36 6.030 -22.307 -21.247 281 2HE MET 36 HE2 MET 36 5.348 -22.026 -22.864 282 3HE MET 36 HE3 MET 36 6.963 -21.402 -22.461 283 H GLU 37 H GLU 37 3.850 -16.342 -19.895 284 HA GLU 37 HA GLU 37 4.651 -13.802 -18.548 285 1HB GLU 37 HB2 GLU 37 2.080 -14.441 -20.048 286 2HB GLU 37 HB3 GLU 37 2.379 -13.010 -19.077 287 1HG GLU 37 HG2 GLU 37 2.771 -12.245 -21.227 288 2HG GLU 37 HG3 GLU 37 4.388 -12.513 -20.592 289 H ILE 38 H ILE 38 3.856 -13.465 -16.516 290 HA ILE 38 HA ILE 38 2.252 -15.598 -15.210 291 HB ILE 38 HB ILE 38 4.851 -14.343 -14.215 292 1HG1 ILE 38 HG12 ILE 38 5.331 -17.017 -14.128 293 2HG1 ILE 38 HG13 ILE 38 4.210 -17.012 -15.474 294 1HG2 ILE 38 HG21 ILE 38 3.298 -14.709 -12.355 295 2HG2 ILE 38 HG22 ILE 38 3.004 -16.379 -12.895 296 3HG2 ILE 38 HG23 ILE 38 4.599 -15.886 -12.288 297 1HD1 ILE 38 HD11 ILE 38 6.897 -15.595 -15.236 298 2HD1 ILE 38 HD12 ILE 38 6.451 -16.902 -16.341 299 3HD1 ILE 38 HD13 ILE 38 5.789 -15.278 -16.579 300 HA PRO 39 HA PRO 39 0.045 -11.778 -14.090 301 1HB PRO 39 HB2 PRO 39 -1.069 -13.619 -11.969 302 2HB PRO 39 HB3 PRO 39 -1.937 -12.463 -13.020 303 1HG PRO 39 HG2 PRO 39 -1.979 -15.124 -13.549 304 2HG PRO 39 HG3 PRO 39 -1.790 -13.941 -14.887 305 1HD PRO 39 HD2 PRO 39 0.347 -15.588 -13.517 306 2HD PRO 39 HD3 PRO 39 0.123 -15.232 -15.258 307 H ILE 40 H ILE 40 0.196 -10.235 -12.440 308 HA ILE 40 HA ILE 40 1.563 -10.952 -9.894 309 HB ILE 40 HB ILE 40 1.808 -8.402 -11.520 310 1HG1 ILE 40 HG12 ILE 40 3.216 -10.200 -12.466 311 2HG1 ILE 40 HG13 ILE 40 4.132 -8.843 -11.853 312 1HG2 ILE 40 HG21 ILE 40 3.410 -7.660 -9.777 313 2HG2 ILE 40 HG22 ILE 40 1.762 -7.820 -9.181 314 3HG2 ILE 40 HG23 ILE 40 2.959 -9.062 -8.785 315 1HD1 ILE 40 HD11 ILE 40 3.751 -11.477 -10.354 316 2HD1 ILE 40 HD12 ILE 40 5.171 -11.015 -11.300 317 3HD1 ILE 40 HD13 ILE 40 4.768 -10.110 -9.839 318 H VAL 41 H VAL 41 0.229 -10.596 -8.260 319 HA VAL 41 HA VAL 41 -2.284 -9.107 -8.729 320 HB VAL 41 HB VAL 41 -3.201 -10.739 -6.990 321 1HG1 VAL 41 HG11 VAL 41 -3.619 -12.521 -8.639 322 2HG1 VAL 41 HG12 VAL 41 -3.857 -10.911 -9.302 323 3HG1 VAL 41 HG13 VAL 41 -2.381 -11.822 -9.713 324 1HG2 VAL 41 HG21 VAL 41 -0.993 -11.656 -6.209 325 2HG2 VAL 41 HG22 VAL 41 -2.150 -12.896 -6.716 326 3HG2 VAL 41 HG23 VAL 41 -0.813 -12.459 -7.791 327 H ALA 42 H ALA 42 -3.259 -8.114 -6.894 328 HA ALA 42 HA ALA 42 -1.467 -6.582 -5.281 329 1HB ALA 42 HB1 ALA 42 -3.548 -5.756 -4.258 330 2HB ALA 42 HB2 ALA 42 -3.752 -5.859 -6.024 331 3HB ALA 42 HB3 ALA 42 -4.448 -7.103 -4.975 332 H ASP 43 H ASP 43 -0.444 -7.256 -3.451 333 HA ASP 43 HA ASP 43 -1.001 -9.721 -2.099 334 1HB ASP 43 HB2 ASP 43 1.214 -8.711 -1.973 335 2HB ASP 43 HB3 ASP 43 0.551 -7.221 -1.301 336 H ARG 44 H ARG 44 -2.301 -6.457 -1.734 337 HA ARG 44 HA ARG 44 -4.293 -7.387 0.155 338 1HB ARG 44 HB2 ARG 44 -3.732 -5.841 1.939 339 2HB ARG 44 HB3 ARG 44 -2.385 -6.927 1.636 340 1HG ARG 44 HG2 ARG 44 -1.632 -4.822 0.044 341 2HG ARG 44 HG3 ARG 44 -2.591 -3.963 1.248 342 1HD ARG 44 HD2 ARG 44 -0.117 -5.681 1.663 343 2HD ARG 44 HD3 ARG 44 -0.276 -3.954 1.918 344 HE ARG 44 HE ARG 44 -1.601 -4.325 3.868 345 1HH1 ARG 44 HH21 ARG 44 -0.130 -7.371 2.614 346 2HH1 ARG 44 HH22 ARG 44 -0.225 -8.149 4.152 347 1HH2 ARG 44 HH11 ARG 44 -1.735 -5.440 5.856 348 2HH2 ARG 44 HH12 ARG 44 -1.165 -7.057 6.003 349 H SER 45 H SER 45 -6.003 -5.757 0.393 350 HA SER 45 HA SER 45 -6.423 -4.184 -1.960 351 1HB SER 45 HB2 SER 45 -7.910 -4.079 0.697 352 2HB SER 45 HB3 SER 45 -8.546 -3.691 -0.909 353 HG SER 45 HG SER 45 -9.086 -5.830 -0.048 354 H GLY 46 H GLY 46 -6.684 -1.831 -2.065 355 1HA GLY 46 HA2 GLY 46 -6.554 -0.021 -0.024 356 2HA GLY 46 HA3 GLY 46 -4.846 -0.304 -0.386 357 H ILE 47 H ILE 47 -5.490 2.170 -0.729 358 HA ILE 47 HA ILE 47 -6.137 2.716 -3.569 359 HB ILE 47 HB ILE 47 -5.319 4.558 -1.279 360 1HG1 ILE 47 HG12 ILE 47 -7.520 3.707 -0.787 361 2HG1 ILE 47 HG13 ILE 47 -7.640 5.383 -1.289 362 1HG2 ILE 47 HG21 ILE 47 -4.650 5.575 -3.363 363 2HG2 ILE 47 HG22 ILE 47 -6.221 5.229 -4.110 364 3HG2 ILE 47 HG23 ILE 47 -6.092 6.406 -2.785 365 1HD1 ILE 47 HD11 ILE 47 -8.323 2.941 -2.975 366 2HD1 ILE 47 HD12 ILE 47 -9.459 4.099 -2.267 367 3HD1 ILE 47 HD13 ILE 47 -8.378 4.617 -3.574 368 H VAL 48 H VAL 48 -4.521 3.015 -5.034 369 HA VAL 48 HA VAL 48 -1.757 2.325 -4.433 370 HB VAL 48 HB VAL 48 -2.988 3.521 -6.920 371 1HG1 VAL 48 HG11 VAL 48 -0.416 1.904 -6.490 372 2HG1 VAL 48 HG12 VAL 48 -1.042 2.501 -8.043 373 3HG1 VAL 48 HG13 VAL 48 -0.491 3.651 -6.820 374 1HG2 VAL 48 HG21 VAL 48 -2.568 0.588 -6.187 375 2HG2 VAL 48 HG22 VAL 48 -4.131 1.403 -6.426 376 3HG2 VAL 48 HG23 VAL 48 -3.041 1.204 -7.788 377 H LYS 49 H LYS 49 -0.521 3.750 -3.278 378 HA LYS 49 HA LYS 49 -1.109 6.636 -3.375 379 1HB LYS 49 HB2 LYS 49 -0.249 5.174 -1.337 380 2HB LYS 49 HB3 LYS 49 1.337 5.443 -2.037 381 1HG LYS 49 HG2 LYS 49 -0.678 7.584 -1.188 382 2HG LYS 49 HG3 LYS 49 0.695 7.039 -0.238 383 1HD LYS 49 HD2 LYS 49 2.217 7.858 -2.112 384 2HD LYS 49 HD3 LYS 49 0.771 8.605 -2.837 385 1HE LYS 49 HE2 LYS 49 0.365 9.870 -0.748 386 2HE LYS 49 HE3 LYS 49 1.815 9.157 -0.030 387 1HZ LYS 49 HZ1 LYS 49 2.256 11.352 -0.928 388 2HZ LYS 49 HZ2 LYS 49 3.127 10.255 -1.757 389 3HZ LYS 49 HZ3 LYS 49 1.783 10.911 -2.421 390 H GLU 50 H GLU 50 1.400 4.235 -4.476 391 HA GLU 50 HA GLU 50 2.053 6.091 -6.650 392 1HB GLU 50 HB2 GLU 50 3.501 6.803 -4.693 393 2HB GLU 50 HB3 GLU 50 4.209 5.186 -4.674 394 1HG GLU 50 HG2 GLU 50 5.650 6.845 -5.771 395 2HG GLU 50 HG3 GLU 50 5.219 5.532 -6.847 396 H VAL 51 H VAL 51 3.390 5.068 -8.296 397 HA VAL 51 HA VAL 51 3.492 2.087 -8.143 398 HB VAL 51 HB VAL 51 2.987 3.739 -10.656 399 1HG1 VAL 51 HG11 VAL 51 2.825 0.728 -10.128 400 2HG1 VAL 51 HG12 VAL 51 2.451 1.544 -11.662 401 3HG1 VAL 51 HG13 VAL 51 4.102 1.553 -11.045 402 1HG2 VAL 51 HG21 VAL 51 1.008 2.110 -9.012 403 2HG2 VAL 51 HG22 VAL 51 0.970 3.875 -9.244 404 3HG2 VAL 51 HG23 VAL 51 0.688 2.809 -10.617 405 H LYS 52 H LYS 52 5.522 1.305 -8.483 406 HA LYS 52 HA LYS 52 7.664 3.363 -8.692 407 1HB LYS 52 HB2 LYS 52 7.687 0.525 -7.585 408 2HB LYS 52 HB3 LYS 52 9.031 1.658 -7.523 409 1HG LYS 52 HG2 LYS 52 6.369 1.944 -6.060 410 2HG LYS 52 HG3 LYS 52 7.935 1.510 -5.375 411 1HD LYS 52 HD2 LYS 52 8.820 3.759 -6.099 412 2HD LYS 52 HD3 LYS 52 7.154 4.210 -6.538 413 1HE LYS 52 HE2 LYS 52 6.391 3.869 -4.250 414 2HE LYS 52 HE3 LYS 52 7.957 3.198 -3.779 415 1HZ LYS 52 HZ1 LYS 52 8.960 5.357 -4.158 416 2HZ LYS 52 HZ2 LYS 52 7.539 6.009 -4.632 417 3HZ LYS 52 HZ3 LYS 52 7.740 5.504 -3.094 418 H LYS 53 H LYS 53 6.178 1.319 -10.845 419 HA LYS 53 HA LYS 53 8.641 0.894 -12.433 420 1HB LYS 53 HB2 LYS 53 6.574 -1.230 -11.678 421 2HB LYS 53 HB3 LYS 53 7.783 -1.430 -12.948 422 1HG LYS 53 HG2 LYS 53 8.509 -0.950 -10.043 423 2HG LYS 53 HG3 LYS 53 8.349 -2.547 -10.786 424 1HD LYS 53 HD2 LYS 53 10.081 -1.969 -12.447 425 2HD LYS 53 HD3 LYS 53 10.283 -0.369 -11.700 426 1HE LYS 53 HE2 LYS 53 11.067 -1.358 -9.623 427 2HE LYS 53 HE3 LYS 53 10.701 -2.981 -10.188 428 1HZ LYS 53 HZ1 LYS 53 12.342 -2.582 -12.010 429 2HZ LYS 53 HZ2 LYS 53 12.793 -1.189 -11.259 430 3HZ LYS 53 HZ3 LYS 53 12.960 -2.656 -10.497 431 H LYS 54 H LYS 54 7.812 -0.138 -14.652 432 HA LYS 54 HA LYS 54 5.283 1.002 -15.552 433 1HB LYS 54 HB2 LYS 54 6.290 2.256 -17.387 434 2HB LYS 54 HB3 LYS 54 6.800 2.917 -15.836 435 1HG LYS 54 HG2 LYS 54 8.986 1.759 -16.033 436 2HG LYS 54 HG3 LYS 54 8.499 1.064 -17.583 437 1HD LYS 54 HD2 LYS 54 8.755 4.047 -17.010 438 2HD LYS 54 HD3 LYS 54 9.993 3.042 -17.780 439 1HE LYS 54 HE2 LYS 54 8.392 2.478 -19.609 440 2HE LYS 54 HE3 LYS 54 7.186 3.539 -18.871 441 1HZ LYS 54 HZ1 LYS 54 8.704 5.400 -19.219 442 2HZ LYS 54 HZ2 LYS 54 9.817 4.419 -19.907 443 3HZ LYS 54 HZ3 LYS 54 8.382 4.661 -20.634 444 H GLU 55 H GLU 55 4.859 0.289 -17.794 445 HA GLU 55 HA GLU 55 5.191 -2.461 -18.116 446 1HB GLU 55 HB2 GLU 55 4.689 -0.451 -20.359 447 2HB GLU 55 HB3 GLU 55 4.316 -2.170 -20.349 448 1HG GLU 55 HG2 GLU 55 2.243 -1.417 -19.838 449 2HG GLU 55 HG3 GLU 55 2.864 -1.503 -18.196 450 H GLY 56 H GLY 56 6.802 -3.701 -18.805 451 1HA GLY 56 HA2 GLY 56 8.505 -4.478 -20.118 452 2HA GLY 56 HA3 GLY 56 8.651 -2.899 -20.901 453 H ASP 57 H ASP 57 8.809 -2.246 -17.564 454 HA ASP 57 HA ASP 57 11.667 -1.801 -17.736 455 1HB ASP 57 HB2 ASP 57 10.116 -0.358 -16.422 456 2HB ASP 57 HB3 ASP 57 9.888 -1.684 -15.276 457 H PHE 58 H PHE 58 13.251 -2.709 -16.236 458 HA PHE 58 HA PHE 58 13.121 -5.622 -16.023 459 1HB PHE 58 HB2 PHE 58 15.235 -4.446 -16.489 460 2HB PHE 58 HB3 PHE 58 15.084 -3.545 -14.986 461 HD1 PHE 58 HD1 PHE 58 15.716 -4.523 -12.849 462 HD2 PHE 58 HD2 PHE 58 15.745 -6.906 -16.447 463 HE1 PHE 58 HE1 PHE 58 17.019 -6.281 -11.680 464 HE2 PHE 58 HE2 PHE 58 17.040 -8.663 -15.271 465 HZ PHE 58 HZ PHE 58 17.706 -8.342 -12.898 466 H VAL 59 H VAL 59 12.840 -6.827 -14.121 467 HA VAL 59 HA VAL 59 12.357 -5.442 -11.581 468 HB VAL 59 HB VAL 59 10.270 -6.908 -11.295 469 1HG1 VAL 59 HG11 VAL 59 10.198 -4.486 -11.383 470 2HG1 VAL 59 HG12 VAL 59 10.102 -4.514 -13.164 471 3HG1 VAL 59 HG13 VAL 59 8.787 -5.172 -12.181 472 1HG2 VAL 59 HG21 VAL 59 10.208 -6.794 -14.337 473 2HG2 VAL 59 HG22 VAL 59 10.477 -8.260 -13.366 474 3HG2 VAL 59 HG23 VAL 59 8.928 -7.394 -13.272 475 H ASN 60 H ASN 60 12.196 -7.013 -9.777 476 HA ASN 60 HA ASN 60 13.520 -9.554 -10.297 477 1HB ASN 60 HB2 ASN 60 15.106 -7.322 -9.735 478 2HB ASN 60 HB3 ASN 60 14.891 -8.073 -8.154 479 1HD2 ASN 60 HD22 ASN 60 15.584 -8.913 -11.609 480 2HD2 ASN 60 HD21 ASN 60 16.740 -10.175 -11.236 481 H GLU 61 H GLU 61 13.841 -10.791 -8.226 482 HA GLU 61 HA GLU 61 11.315 -11.041 -6.935 483 1HB GLU 61 HB2 GLU 61 12.926 -12.879 -7.333 484 2HB GLU 61 HB3 GLU 61 14.065 -12.146 -6.204 485 1HG GLU 61 HG2 GLU 61 12.277 -12.375 -4.403 486 2HG GLU 61 HG3 GLU 61 11.277 -13.220 -5.585 487 H GLY 62 H GLY 62 10.506 -9.587 -5.539 488 1HA GLY 62 HA2 GLY 62 10.359 -8.527 -3.481 489 2HA GLY 62 HA3 GLY 62 12.117 -8.558 -3.293 490 H ASP 63 H ASP 63 11.404 -7.458 -6.482 491 HA ASP 63 HA ASP 63 12.171 -4.738 -5.766 492 1HB ASP 63 HB2 ASP 63 12.950 -6.092 -7.797 493 2HB ASP 63 HB3 ASP 63 11.342 -5.836 -8.479 494 H VAL 64 H VAL 64 10.729 -3.040 -5.568 495 HA VAL 64 HA VAL 64 8.028 -3.732 -5.008 496 HB VAL 64 HB VAL 64 9.346 -0.995 -5.241 497 1HG1 VAL 64 HG11 VAL 64 7.495 -0.301 -3.670 498 2HG1 VAL 64 HG12 VAL 64 6.931 -0.726 -5.284 499 3HG1 VAL 64 HG13 VAL 64 6.725 -1.878 -3.956 500 1HG2 VAL 64 HG21 VAL 64 10.493 -2.378 -3.557 501 2HG2 VAL 64 HG22 VAL 64 9.510 -1.156 -2.753 502 3HG2 VAL 64 HG23 VAL 64 8.935 -2.835 -2.840 503 H LEU 65 H LEU 65 6.197 -3.539 -6.139 504 HA LEU 65 HA LEU 65 6.223 -2.630 -8.967 505 1HB LEU 65 HB2 LEU 65 5.042 -4.736 -8.551 506 2HB LEU 65 HB3 LEU 65 4.156 -4.036 -7.206 507 HG LEU 65 HG LEU 65 2.959 -2.496 -8.752 508 1HD1 LEU 65 HD11 LEU 65 3.036 -2.906 -11.181 509 2HD1 LEU 65 HD12 LEU 65 4.601 -2.350 -10.590 510 3HD1 LEU 65 HD13 LEU 65 4.352 -4.078 -10.945 511 1HD2 LEU 65 HD21 LEU 65 2.739 -5.426 -9.507 512 2HD2 LEU 65 HD22 LEU 65 1.970 -4.652 -8.105 513 3HD2 LEU 65 HD23 LEU 65 1.500 -4.176 -9.743 514 H LEU 66 H LEU 66 4.572 -2.091 -5.765 515 HA LEU 66 HA LEU 66 4.154 0.726 -6.411 516 1HB LEU 66 HB2 LEU 66 1.723 0.674 -6.425 517 2HB LEU 66 HB3 LEU 66 2.377 -0.277 -7.728 518 HG LEU 66 HG LEU 66 1.910 -2.345 -6.289 519 1HD1 LEU 66 HD11 LEU 66 0.339 -0.275 -4.704 520 2HD1 LEU 66 HD12 LEU 66 -0.018 -2.018 -4.660 521 3HD1 LEU 66 HD13 LEU 66 1.526 -1.436 -4.069 522 1HD2 LEU 66 HD21 LEU 66 0.568 -1.799 -8.203 523 2HD2 LEU 66 HD22 LEU 66 -0.461 -2.403 -6.914 524 3HD2 LEU 66 HD23 LEU 66 -0.411 -0.655 -7.242 525 H GLU 67 H GLU 67 2.810 1.797 -4.672 526 HA GLU 67 HA GLU 67 3.021 0.434 -2.074 527 1HB GLU 67 HB2 GLU 67 4.710 2.632 -2.876 528 2HB GLU 67 HB3 GLU 67 3.582 3.244 -1.681 529 1HG GLU 67 HG2 GLU 67 5.319 0.762 -1.334 530 2HG GLU 67 HG3 GLU 67 5.739 2.369 -0.755 531 H LEU 68 H LEU 68 1.538 1.227 -0.534 532 HA LEU 68 HA LEU 68 -0.953 2.261 -1.830 533 1HB LEU 68 HB2 LEU 68 -0.618 0.110 0.313 534 2HB LEU 68 HB3 LEU 68 -2.159 0.705 -0.296 535 HG LEU 68 HG LEU 68 -0.093 -0.817 -1.937 536 1HD1 LEU 68 HD11 LEU 68 -2.798 -1.725 -0.870 537 2HD1 LEU 68 HD12 LEU 68 -1.683 -2.671 -1.880 538 3HD1 LEU 68 HD13 LEU 68 -1.213 -2.216 -0.237 539 1HD2 LEU 68 HD21 LEU 68 -1.909 -0.935 -3.639 540 2HD2 LEU 68 HD22 LEU 68 -2.895 0.165 -2.659 541 3HD2 LEU 68 HD23 LEU 68 -1.337 0.684 -3.352 542 H SER 69 H SER 69 -2.273 3.608 -0.610 543 HA SER 69 HA SER 69 -1.061 5.274 1.284 544 1HB SER 69 HB2 SER 69 -4.020 4.746 0.847 545 2HB SER 69 HB3 SER 69 -3.295 6.216 1.542 546 HG SER 69 HG SER 69 -3.711 6.535 -0.651 547 H ASN 70 H ASN 70 -2.638 2.189 1.791 548 HA ASN 70 HA ASN 70 -3.239 2.249 4.545 549 1HB ASN 70 HB2 ASN 70 -3.814 0.376 3.047 550 2HB ASN 70 HB3 ASN 70 -2.103 -0.002 2.816 551 1HD2 ASN 70 HD22 ASN 70 -0.906 -1.040 4.582 552 2HD2 ASN 70 HD21 ASN 70 -1.777 -1.758 5.915 553 H SER 71 H SER 71 -0.083 1.909 2.898 554 HA SER 71 HA SER 71 1.251 1.564 5.548 555 1HB SER 71 HB2 SER 71 2.132 0.476 2.863 556 2HB SER 71 HB3 SER 71 2.750 0.054 4.470 557 HG SER 71 HG SER 71 1.330 -1.539 3.785 558 H THR 72 H THR 72 1.207 3.448 2.576 559 HA THR 72 HA THR 72 3.870 4.502 2.815 560 HB THR 72 HB THR 72 1.447 5.776 1.485 561 HG1 THR 72 HG1 THR 72 1.727 3.662 0.729 562 1HG2 THR 72 HG21 THR 72 3.368 7.290 1.531 563 2HG2 THR 72 HG22 THR 72 4.447 5.999 0.955 564 3HG2 THR 72 HG23 THR 72 3.187 6.653 -0.110 565 H GLN 73 H GLN 73 0.702 5.414 4.203 566 HA GLN 73 HA GLN 73 1.534 7.960 5.285 567 1HB GLN 73 HB2 GLN 73 -0.748 6.062 5.993 568 2HB GLN 73 HB3 GLN 73 -0.502 7.642 6.741 569 1HG GLN 73 HG2 GLN 73 -0.722 8.760 4.551 570 2HG GLN 73 HG3 GLN 73 -0.958 7.200 3.757 571 1HE2 GLN 73 HE22 GLN 73 -2.844 5.864 4.518 572 2HE2 GLN 73 HE21 GLN 73 -4.308 6.698 5.028
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