NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
644086 | 6qxz | 27251 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 850 HT1 GLY 850 0.195 -7.656 -3.512 2 H2 GLY 850 HT2 GLY 850 1.624 -7.154 -2.887 3 H3 GLY 850 HT3 GLY 850 1.098 -6.554 -4.319 4 HA2 GLY 850 HA1 GLY 850 -0.204 -6.118 -1.709 5 HA3 GLY 850 HA2 GLY 850 0.797 -4.926 -2.560 6 H SER 851 HN SER 851 -1.952 -4.570 -1.762 7 HA SER 851 HA SER 851 -3.681 -5.029 -4.053 8 HB2 SER 851 HB1 SER 851 -4.182 -3.490 -1.481 9 HB3 SER 851 HB2 SER 851 -5.409 -3.944 -2.674 10 HG SER 851 HG1 SER 851 -3.785 -5.696 -1.113 11 H ARG 852 HN ARG 852 -1.461 -2.691 -3.654 12 HA ARG 852 HA ARG 852 -2.847 -0.482 -5.093 13 HB2 ARG 852 HB1 ARG 852 -0.010 -0.715 -3.978 14 HB3 ARG 852 HB2 ARG 852 -0.583 0.621 -4.968 15 HG2 ARG 852 HG1 ARG 852 -0.641 1.393 -2.786 16 HG3 ARG 852 HG2 ARG 852 -2.320 1.155 -3.262 17 HD2 ARG 852 HD1 ARG 852 -2.521 -0.802 -1.875 18 HD3 ARG 852 HD2 ARG 852 -0.773 -0.922 -1.653 19 HE ARG 852 HE ARG 852 -2.627 0.990 -0.322 20 HH11 ARG 852 HH11 ARG 852 0.738 0.012 -0.628 21 HH12 ARG 852 HH12 ARG 852 1.204 0.985 0.741 22 HH21 ARG 852 HH21 ARG 852 -1.975 2.214 1.265 23 HH22 ARG 852 HH22 ARG 852 -0.312 2.198 1.826 24 H ARG 853 HN ARG 853 -3.188 -2.449 -6.558 25 HA ARG 853 HA ARG 853 -1.130 -3.486 -8.233 26 HB2 ARG 853 HB1 ARG 853 -4.125 -3.251 -8.744 27 HB3 ARG 853 HB2 ARG 853 -3.045 -4.172 -9.766 28 HG2 ARG 853 HG1 ARG 853 -3.650 -4.702 -6.827 29 HG3 ARG 853 HG2 ARG 853 -4.232 -5.623 -8.209 30 HD2 ARG 853 HD1 ARG 853 -1.348 -5.366 -7.292 31 HD3 ARG 853 HD2 ARG 853 -2.371 -6.777 -7.080 32 HE ARG 853 HE ARG 853 -0.965 -5.935 -9.519 33 HH11 ARG 853 HH11 ARG 853 -3.380 -8.133 -8.284 34 HH12 ARG 853 HH12 ARG 853 -3.493 -8.998 -9.803 35 HH21 ARG 853 HH21 ARG 853 -1.279 -6.991 -11.468 36 HH22 ARG 853 HH22 ARG 853 -2.518 -8.213 -11.582 37 H ALA 854 HN ALA 854 -0.803 -3.317 -10.484 38 HA ALA 854 HA ALA 854 0.327 -0.764 -10.893 39 HB1 ALA 854 HB1 ALA 854 1.251 -1.761 -12.941 40 HB2 ALA 854 HB2 ALA 854 1.374 -2.886 -11.575 41 HB3 ALA 854 HB3 ALA 854 0.113 -3.119 -12.813 42 H SER 855 HN SER 855 0.284 0.578 -12.706 43 HA SER 855 HA SER 855 -0.628 2.225 -13.893 44 HB2 SER 855 HB1 SER 855 -1.979 1.786 -15.771 45 HB3 SER 855 HB2 SER 855 -0.829 0.482 -15.578 46 HG SER 855 HG1 SER 855 -2.545 -0.729 -14.570 47 H VAL 856 HN VAL 856 -2.807 3.278 -14.664 48 HA VAL 856 HA VAL 856 -4.993 3.260 -12.755 49 HB VAL 856 HB VAL 856 -3.189 4.466 -11.488 50 HG11 VAL 856 HG11 VAL 856 -3.553 6.683 -13.538 51 HG12 VAL 856 HG12 VAL 856 -2.578 6.741 -12.058 52 HG13 VAL 856 HG13 VAL 856 -2.109 5.659 -13.378 53 HG21 VAL 856 HG21 VAL 856 -4.561 6.213 -10.631 54 HG22 VAL 856 HG22 VAL 856 -5.551 6.273 -12.092 55 HG23 VAL 856 HG23 VAL 856 -5.605 4.842 -11.028 56 H GLY 857 HN GLY 857 -6.726 4.763 -13.379 57 HA2 GLY 857 HA1 GLY 857 -6.716 5.569 -16.246 58 HA3 GLY 857 HA2 GLY 857 -8.115 5.387 -15.193 59 H SER 858 HN SER 858 -8.946 7.350 -15.352 60 HA SER 858 HA SER 858 -7.714 9.644 -13.986 61 HB2 SER 858 HB1 SER 858 -8.652 9.908 -16.876 62 HB3 SER 858 HB2 SER 858 -8.114 11.226 -15.829 63 HG SER 858 HG1 SER 858 -6.032 10.263 -15.795 64 H GLU 859 HN GLU 859 -9.244 11.119 -13.232 65 HA GLU 859 HA GLU 859 -11.213 11.875 -12.434 66 HB2 GLU 859 HB1 GLU 859 -11.572 11.582 -15.312 67 HB3 GLU 859 HB2 GLU 859 -13.102 11.363 -14.507 68 HG2 GLU 859 HG1 GLU 859 -11.214 13.725 -14.136 69 HG3 GLU 859 HG2 GLU 859 -12.625 13.705 -15.189 70 H PHE 860 HN PHE 860 -13.655 11.445 -12.142 71 HA PHE 860 HA PHE 860 -14.122 8.605 -11.298 72 HB2 PHE 860 HB1 PHE 860 -15.461 11.179 -10.403 73 HB3 PHE 860 HB2 PHE 860 -15.846 9.573 -9.832 74 HD1 PHE 860 HD1 PHE 860 -12.850 8.602 -9.504 75 HD2 PHE 860 HD2 PHE 860 -14.963 12.172 -8.302 76 HE1 PHE 860 HE1 PHE 860 -11.239 8.939 -7.664 77 HE2 PHE 860 HE2 PHE 860 -13.340 12.499 -6.454 78 HZ PHE 860 HZ PHE 860 -11.469 10.890 -6.136 79 H THR 861 HN THR 861 -15.594 11.430 -12.873 80 HA THR 861 HA THR 861 -17.312 11.695 -14.373 81 HB THR 861 HB THR 861 -16.896 9.030 -15.563 82 HG1 THR 861 HG1 THR 861 -15.020 11.136 -15.770 83 HG21 THR 861 HG21 THR 861 -16.950 11.838 -16.751 84 HG22 THR 861 HG22 THR 861 -16.870 10.314 -17.659 85 HG23 THR 861 HG23 THR 861 -18.322 10.722 -16.744 86 H GLU 862 HN GLU 862 -19.008 9.592 -15.570 87 HA GLU 862 HA GLU 862 -21.059 9.252 -13.505 88 HB2 GLU 862 HB1 GLU 862 -20.855 8.367 -16.407 89 HB3 GLU 862 HB2 GLU 862 -22.276 8.119 -15.379 90 HG2 GLU 862 HG1 GLU 862 -22.432 10.563 -14.983 91 HG3 GLU 862 HG2 GLU 862 -21.094 10.829 -16.098 92 H SER 863 HN SER 863 -22.140 6.864 -13.690 93 HA SER 863 HA SER 863 -20.858 5.286 -11.915 94 HB2 SER 863 HB1 SER 863 -22.734 4.314 -14.089 95 HB3 SER 863 HB2 SER 863 -22.372 3.465 -12.572 96 HG SER 863 HG1 SER 863 -24.297 4.779 -12.472 97 H ALA 864 HN ALA 864 -19.594 3.532 -11.749 98 HA ALA 864 HA ALA 864 -17.666 3.207 -14.009 99 HB1 ALA 864 HB1 ALA 864 -15.945 3.394 -12.246 100 HB2 ALA 864 HB2 ALA 864 -17.018 4.807 -12.205 101 HB3 ALA 864 HB3 ALA 864 -17.208 3.506 -11.010 102 H TRP 865 HN TRP 865 -15.976 1.410 -13.335 103 HA TRP 865 HA TRP 865 -17.365 -0.945 -12.086 104 HB2 TRP 865 HB1 TRP 865 -14.948 -0.860 -13.916 105 HB3 TRP 865 HB2 TRP 865 -15.578 -2.287 -13.120 106 HD1 TRP 865 HD1 TRP 865 -16.688 0.279 -15.770 107 HE1 TRP 865 HE1 TRP 865 -18.525 -0.729 -17.242 108 HE3 TRP 865 HE3 TRP 865 -17.268 -4.137 -13.299 109 HZ2 TRP 865 HZ2 TRP 865 -20.110 -3.204 -17.263 110 HZ3 TRP 865 HZ3 TRP 865 -18.896 -5.844 -14.088 111 HH2 TRP 865 HH2 TRP 865 -20.308 -5.383 -16.077 112 H VAL 866 HN VAL 866 -15.909 -2.292 -10.775 113 HA VAL 866 HA VAL 866 -13.426 -1.091 -9.796 114 HB VAL 866 HB VAL 866 -15.012 -0.224 -8.195 115 HG11 VAL 866 HG11 VAL 866 -16.714 -2.057 -8.323 116 HG12 VAL 866 HG12 VAL 866 -15.615 -3.106 -7.420 117 HG13 VAL 866 HG13 VAL 866 -16.257 -1.627 -6.672 118 HG21 VAL 866 HG21 VAL 866 -12.714 -0.772 -7.469 119 HG22 VAL 866 HG22 VAL 866 -13.912 -0.856 -6.170 120 HG23 VAL 866 HG23 VAL 866 -13.299 -2.353 -6.888 121 H ARG 867 HN ARG 867 -11.913 -2.569 -9.150 122 HA ARG 867 HA ARG 867 -12.382 -5.400 -9.919 123 HB2 ARG 867 HB1 ARG 867 -10.320 -3.693 -10.475 124 HB3 ARG 867 HB2 ARG 867 -9.677 -4.447 -9.035 125 HG2 ARG 867 HG1 ARG 867 -10.114 -6.693 -10.153 126 HG3 ARG 867 HG2 ARG 867 -10.571 -5.823 -11.610 127 HD2 ARG 867 HD1 ARG 867 -8.441 -5.986 -12.207 128 HD3 ARG 867 HD2 ARG 867 -8.149 -4.630 -11.126 129 HE ARG 867 HE ARG 867 -7.940 -6.737 -9.394 130 HH11 ARG 867 HH11 ARG 867 -6.376 -6.523 -12.536 131 HH12 ARG 867 HH12 ARG 867 -5.329 -7.879 -12.157 132 HH21 ARG 867 HH21 ARG 867 -6.685 -8.487 -9.076 133 HH22 ARG 867 HH22 ARG 867 -5.561 -8.965 -10.314 134 H CYS 868 HN CYS 868 -12.194 -7.084 -8.498 135 HA CYS 868 HA CYS 868 -11.930 -6.646 -5.645 136 HB2 CYS 868 HB1 CYS 868 -13.253 -8.459 -6.607 137 HB3 CYS 868 HB2 CYS 868 -11.815 -9.129 -7.384 138 H ASP 869 HN ASP 869 -10.109 -6.248 -4.598 139 HA ASP 869 HA ASP 869 -7.437 -6.887 -5.672 140 HB2 ASP 869 HB1 ASP 869 -8.460 -5.665 -3.101 141 HB3 ASP 869 HB2 ASP 869 -6.755 -5.967 -3.392 142 H ASP 870 HN ASP 870 -9.639 -8.972 -4.381 143 HA ASP 870 HA ASP 870 -7.537 -10.560 -2.978 144 HB2 ASP 870 HB1 ASP 870 -9.795 -9.980 -1.807 145 HB3 ASP 870 HB2 ASP 870 -10.481 -11.223 -2.850 146 H CYS 871 HN CYS 871 -9.820 -10.544 -5.642 147 HA CYS 871 HA CYS 871 -8.079 -12.551 -6.903 148 HB2 CYS 871 HB1 CYS 871 -9.800 -13.630 -8.061 149 HB3 CYS 871 HB2 CYS 871 -10.193 -13.658 -6.359 150 H PHE 872 HN PHE 872 -10.478 -11.210 -8.757 151 HA PHE 872 HA PHE 872 -9.249 -8.799 -9.740 152 HB2 PHE 872 HB1 PHE 872 -8.407 -9.467 -11.830 153 HB3 PHE 872 HB2 PHE 872 -7.635 -10.462 -10.620 154 HD1 PHE 872 HD1 PHE 872 -9.399 -10.494 -13.729 155 HD2 PHE 872 HD2 PHE 872 -8.558 -12.881 -10.238 156 HE1 PHE 872 HE1 PHE 872 -10.005 -12.558 -14.984 157 HE2 PHE 872 HE2 PHE 872 -9.191 -14.930 -11.484 158 HZ PHE 872 HZ PHE 872 -9.919 -14.770 -13.858 159 H LYS 873 HN LYS 873 -11.808 -10.965 -9.789 160 HA LYS 873 HA LYS 873 -13.529 -10.349 -11.893 161 HB2 LYS 873 HB1 LYS 873 -13.785 -11.879 -9.844 162 HB3 LYS 873 HB2 LYS 873 -14.378 -10.425 -9.020 163 HG2 LYS 873 HG1 LYS 873 -15.700 -11.008 -11.605 164 HG3 LYS 873 HG2 LYS 873 -15.896 -12.257 -10.366 165 HD2 LYS 873 HD1 LYS 873 -16.389 -9.357 -9.748 166 HD3 LYS 873 HD2 LYS 873 -17.675 -10.357 -10.428 167 HE2 LYS 873 HE1 LYS 873 -16.091 -11.230 -8.022 168 HE3 LYS 873 HE2 LYS 873 -17.506 -10.178 -7.827 169 HZ1 LYS 873 HZ1 LYS 873 -17.498 -12.912 -9.001 170 HZ2 LYS 873 HZ2 LYS 873 -18.070 -12.491 -7.530 171 HZ3 LYS 873 HZ3 LYS 873 -18.812 -11.948 -8.917 172 H TRP 874 HN TRP 874 -15.125 -8.874 -12.284 173 HA TRP 874 HA TRP 874 -14.681 -6.198 -11.080 174 HB2 TRP 874 HB1 TRP 874 -15.719 -6.892 -13.866 175 HB3 TRP 874 HB2 TRP 874 -15.396 -5.282 -13.247 176 HD1 TRP 874 HD1 TRP 874 -13.675 -8.229 -14.793 177 HE1 TRP 874 HE1 TRP 874 -11.207 -7.649 -15.295 178 HE3 TRP 874 HE3 TRP 874 -13.376 -3.781 -12.295 179 HZ2 TRP 874 HZ2 TRP 874 -9.424 -5.485 -14.799 180 HZ3 TRP 874 HZ3 TRP 874 -11.210 -2.538 -12.271 181 HH2 TRP 874 HH2 TRP 874 -9.280 -3.298 -13.550 182 H ARG 875 HN ARG 875 -16.417 -4.734 -10.809 183 HA ARG 875 HA ARG 875 -19.196 -5.743 -11.052 184 HB2 ARG 875 HB1 ARG 875 -17.855 -4.839 -8.465 185 HB3 ARG 875 HB2 ARG 875 -19.590 -4.725 -8.682 186 HG2 ARG 875 HG1 ARG 875 -17.942 -7.289 -8.744 187 HG3 ARG 875 HG2 ARG 875 -19.006 -6.764 -7.462 188 HD2 ARG 875 HD1 ARG 875 -19.798 -7.673 -10.232 189 HD3 ARG 875 HD2 ARG 875 -20.147 -8.445 -8.689 190 HE ARG 875 HE ARG 875 -21.380 -6.010 -8.383 191 HH11 ARG 875 HH11 ARG 875 -21.689 -8.403 -10.888 192 HH12 ARG 875 HH12 ARG 875 -23.244 -7.816 -11.395 193 HH21 ARG 875 HH21 ARG 875 -23.450 -5.419 -8.966 194 HH22 ARG 875 HH22 ARG 875 -24.144 -6.086 -10.422 195 H ARG 876 HN ARG 876 -20.638 -4.226 -11.548 196 HA ARG 876 HA ARG 876 -19.718 -1.531 -12.242 197 HB2 ARG 876 HB1 ARG 876 -21.400 -3.029 -13.556 198 HB3 ARG 876 HB2 ARG 876 -22.571 -2.583 -12.316 199 HG2 ARG 876 HG1 ARG 876 -22.990 -1.022 -13.998 200 HG3 ARG 876 HG2 ARG 876 -21.913 -0.086 -12.947 201 HD2 ARG 876 HD1 ARG 876 -19.990 -0.655 -14.363 202 HD3 ARG 876 HD2 ARG 876 -20.985 -1.774 -15.300 203 HE ARG 876 HE ARG 876 -20.706 1.037 -15.753 204 HH11 ARG 876 HH11 ARG 876 -23.027 -1.621 -16.201 205 HH12 ARG 876 HH12 ARG 876 -23.711 -0.831 -17.591 206 HH21 ARG 876 HH21 ARG 876 -21.495 1.780 -17.614 207 HH22 ARG 876 HH22 ARG 876 -22.918 1.080 -18.344 208 H ILE 877 HN ILE 877 -19.868 0.190 -11.018 209 HA ILE 877 HA ILE 877 -21.620 0.231 -8.589 210 HB ILE 877 HB ILE 877 -19.809 1.328 -7.365 211 HG12 ILE 877 HG11 ILE 877 -18.031 0.766 -9.775 212 HG13 ILE 877 HG12 ILE 877 -18.635 2.351 -9.331 213 HG21 ILE 877 HG21 ILE 877 -18.860 -1.311 -8.533 214 HG22 ILE 877 HG22 ILE 877 -18.522 -0.664 -6.903 215 HG23 ILE 877 HG23 ILE 877 -20.156 -1.162 -7.332 216 HD11 ILE 877 HD1 ILE 877 -17.393 2.427 -7.313 217 HD12 ILE 877 HD2 ILE 877 -16.877 0.742 -7.466 218 HD13 ILE 877 HD3 ILE 877 -16.299 1.960 -8.617 219 HA PRO 878 HA PRO 878 -22.496 4.488 -9.856 220 HB2 PRO 878 HB1 PRO 878 -23.112 5.683 -7.479 221 HB3 PRO 878 HB2 PRO 878 -24.214 4.523 -8.283 222 HG2 PRO 878 HG1 PRO 878 -22.226 3.965 -6.060 223 HG3 PRO 878 HG2 PRO 878 -23.953 3.494 -6.136 224 HD2 PRO 878 HD1 PRO 878 -21.952 1.780 -6.834 225 HD3 PRO 878 HD2 PRO 878 -23.512 1.786 -7.704 226 H ALA 879 HN ALA 879 -21.288 6.387 -9.976 227 HA ALA 879 HA ALA 879 -18.551 6.387 -9.371 228 HB1 ALA 879 HB1 ALA 879 -18.657 8.769 -9.997 229 HB2 ALA 879 HB2 ALA 879 -19.641 7.775 -11.085 230 HB3 ALA 879 HB3 ALA 879 -20.425 8.747 -9.813 231 H SER 880 HN SER 880 -21.148 7.203 -7.194 232 HA SER 880 HA SER 880 -19.693 8.763 -5.252 233 HB2 SER 880 HB1 SER 880 -22.052 6.871 -4.878 234 HB3 SER 880 HB2 SER 880 -21.429 7.991 -3.658 235 HG SER 880 HG1 SER 880 -22.619 8.641 -6.169 236 H VAL 881 HN VAL 881 -19.625 5.323 -6.013 237 HA VAL 881 HA VAL 881 -18.055 4.701 -3.566 238 HB VAL 881 HB VAL 881 -19.024 2.942 -5.843 239 HG11 VAL 881 HG11 VAL 881 -17.572 2.069 -3.312 240 HG12 VAL 881 HG12 VAL 881 -18.259 1.005 -4.556 241 HG13 VAL 881 HG13 VAL 881 -16.876 2.026 -4.950 242 HG21 VAL 881 HG21 VAL 881 -20.458 1.911 -4.139 243 HG22 VAL 881 HG22 VAL 881 -19.823 3.023 -2.906 244 HG23 VAL 881 HG23 VAL 881 -20.795 3.641 -4.252 245 H VAL 882 HN VAL 882 -17.646 5.103 -7.083 246 HA VAL 882 HA VAL 882 -14.890 4.312 -6.920 247 HB VAL 882 HB VAL 882 -16.504 4.568 -9.021 248 HG11 VAL 882 HG11 VAL 882 -16.426 7.103 -9.030 249 HG12 VAL 882 HG12 VAL 882 -14.703 6.990 -9.411 250 HG13 VAL 882 HG13 VAL 882 -15.903 6.335 -10.534 251 HG21 VAL 882 HG21 VAL 882 -14.508 4.288 -10.455 252 HG22 VAL 882 HG22 VAL 882 -13.472 4.858 -9.133 253 HG23 VAL 882 HG23 VAL 882 -14.375 3.338 -8.970 254 H GLY 883 HN GLY 883 -16.443 7.265 -6.153 255 HA2 GLY 883 HA1 GLY 883 -13.998 8.896 -5.977 256 HA3 GLY 883 HA2 GLY 883 -15.617 9.324 -5.422 257 H SER 884 HN SER 884 -15.578 6.573 -3.935 258 HA SER 884 HA SER 884 -14.317 7.530 -1.425 259 HB2 SER 884 HB1 SER 884 -16.655 6.725 -1.388 260 HB3 SER 884 HB2 SER 884 -16.121 5.153 -2.003 261 HG SER 884 HG1 SER 884 -15.532 6.359 0.508 262 H ILE 885 HN ILE 885 -14.184 4.780 -3.690 263 HA ILE 885 HA ILE 885 -11.969 3.419 -2.376 264 HB ILE 885 HB ILE 885 -13.509 3.090 -4.951 265 HG12 ILE 885 HG11 ILE 885 -14.011 0.886 -4.165 266 HG13 ILE 885 HG12 ILE 885 -12.848 0.966 -2.848 267 HG21 ILE 885 HG21 ILE 885 -11.263 2.624 -5.722 268 HG22 ILE 885 HG22 ILE 885 -10.937 1.611 -4.295 269 HG23 ILE 885 HG23 ILE 885 -12.129 1.106 -5.524 270 HD11 ILE 885 HD1 ILE 885 -14.250 2.552 -1.643 271 HD12 ILE 885 HD2 ILE 885 -15.336 2.701 -3.048 272 HD13 ILE 885 HD3 ILE 885 -15.249 1.180 -2.151 273 H ASP 886 HN ASP 886 -10.012 4.169 -2.318 274 HA ASP 886 HA ASP 886 -8.769 5.730 -4.544 275 HB2 ASP 886 HB1 ASP 886 -7.716 4.946 -1.795 276 HB3 ASP 886 HB2 ASP 886 -6.846 5.899 -2.987 277 H GLU 887 HN GLU 887 -6.436 4.902 -5.091 278 HA GLU 887 HA GLU 887 -6.483 2.170 -5.933 279 HB2 GLU 887 HB1 GLU 887 -5.021 3.951 -6.897 280 HB3 GLU 887 HB2 GLU 887 -4.066 3.958 -5.415 281 HG2 GLU 887 HG1 GLU 887 -2.989 2.650 -7.217 282 HG3 GLU 887 HG2 GLU 887 -3.327 1.669 -5.802 283 H SER 888 HN SER 888 -5.307 3.679 -2.942 284 HA SER 888 HA SER 888 -4.204 1.250 -1.806 285 HB2 SER 888 HB1 SER 888 -3.431 3.521 -1.228 286 HB3 SER 888 HB2 SER 888 -4.993 3.822 -0.450 287 HG SER 888 HG1 SER 888 -4.532 2.264 1.075 288 H SER 889 HN SER 889 -7.485 2.399 -2.049 289 HA SER 889 HA SER 889 -8.491 1.094 0.360 290 HB2 SER 889 HB1 SER 889 -10.006 1.933 -2.132 291 HB3 SER 889 HB2 SER 889 -10.701 1.471 -0.571 292 HG SER 889 HG1 SER 889 -9.752 3.300 0.359 293 H ARG 890 HN ARG 890 -8.705 -1.019 0.628 294 HA ARG 890 HA ARG 890 -8.439 -2.837 -1.663 295 HB2 ARG 890 HB1 ARG 890 -7.203 -3.093 0.532 296 HB3 ARG 890 HB2 ARG 890 -8.733 -3.669 1.231 297 HG2 ARG 890 HG1 ARG 890 -8.828 -5.421 -0.572 298 HG3 ARG 890 HG2 ARG 890 -7.307 -4.787 -1.217 299 HD2 ARG 890 HD1 ARG 890 -6.220 -5.359 0.984 300 HD3 ARG 890 HD2 ARG 890 -7.721 -6.178 1.447 301 HE ARG 890 HE ARG 890 -6.008 -6.838 -0.939 302 HH11 ARG 890 HH11 ARG 890 -8.037 -8.128 1.647 303 HH12 ARG 890 HH12 ARG 890 -7.952 -9.741 0.975 304 HH21 ARG 890 HH21 ARG 890 -6.212 -8.882 -1.799 305 HH22 ARG 890 HH22 ARG 890 -6.936 -10.148 -0.826 306 H TRP 891 HN TRP 891 -10.260 -2.533 -2.780 307 HA TRP 891 HA TRP 891 -12.918 -3.177 -1.616 308 HB2 TRP 891 HB1 TRP 891 -12.637 -1.311 -3.259 309 HB3 TRP 891 HB2 TRP 891 -12.263 -2.523 -4.491 310 HD1 TRP 891 HD1 TRP 891 -14.974 -0.768 -2.752 311 HE1 TRP 891 HE1 TRP 891 -17.280 -1.431 -3.623 312 HE3 TRP 891 HE3 TRP 891 -13.651 -5.009 -5.318 313 HZ2 TRP 891 HZ2 TRP 891 -18.457 -3.723 -4.916 314 HZ3 TRP 891 HZ3 TRP 891 -15.448 -6.471 -6.279 315 HH2 TRP 891 HH2 TRP 891 -17.811 -5.853 -6.021 316 H ILE 892 HN ILE 892 -13.792 -5.222 -1.752 317 HA ILE 892 HA ILE 892 -12.680 -7.196 -3.673 318 HB ILE 892 HB ILE 892 -12.440 -8.875 -1.985 319 HG12 ILE 892 HG11 ILE 892 -13.000 -6.844 0.197 320 HG13 ILE 892 HG12 ILE 892 -14.247 -7.911 -0.445 321 HG21 ILE 892 HG21 ILE 892 -10.442 -8.070 -0.816 322 HG22 ILE 892 HG22 ILE 892 -10.478 -7.415 -2.458 323 HG23 ILE 892 HG23 ILE 892 -10.920 -6.395 -1.073 324 HD11 ILE 892 HD1 ILE 892 -11.718 -8.961 0.832 325 HD12 ILE 892 HD2 ILE 892 -13.333 -8.886 1.563 326 HD13 ILE 892 HD3 ILE 892 -13.072 -9.900 0.127 327 H CYS 893 HN CYS 893 -14.012 -9.137 -3.944 328 HA CYS 893 HA CYS 893 -16.696 -8.746 -4.340 329 HB2 CYS 893 HB1 CYS 893 -15.352 -11.383 -3.611 330 HB3 CYS 893 HB2 CYS 893 -16.909 -11.144 -4.427 331 H MET 894 HN MET 894 -15.269 -10.017 -1.226 332 HA MET 894 HA MET 894 -17.826 -10.760 -0.132 333 HB2 MET 894 HB1 MET 894 -15.912 -11.774 0.736 334 HB3 MET 894 HB2 MET 894 -15.082 -10.256 1.011 335 HG2 MET 894 HG1 MET 894 -17.541 -10.983 2.593 336 HG3 MET 894 HG2 MET 894 -15.922 -11.549 3.017 337 HE1 MET 894 HE1 MET 894 -16.656 -8.854 5.763 338 HE2 MET 894 HE2 MET 894 -17.853 -9.905 4.976 339 HE3 MET 894 HE3 MET 894 -16.266 -10.558 5.444 340 H ASN 895 HN ASN 895 -16.266 -7.661 -0.405 341 HA ASN 895 HA ASN 895 -18.002 -6.304 1.551 342 HB2 ASN 895 HB1 ASN 895 -16.215 -4.998 1.711 343 HB3 ASN 895 HB2 ASN 895 -15.393 -5.889 0.446 344 HD21 ASN 895 HD21 ASN 895 -16.102 -5.212 -1.900 345 HD22 ASN 895 HD22 ASN 895 -16.220 -3.467 -2.112 346 H ASN 896 HN ASN 896 -18.260 -7.213 -1.709 347 HA ASN 896 HA ASN 896 -19.296 -5.005 -3.030 348 HB2 ASN 896 HB1 ASN 896 -18.664 -7.163 -4.098 349 HB3 ASN 896 HB2 ASN 896 -20.079 -7.915 -3.361 350 HD21 ASN 896 HD21 ASN 896 -21.326 -8.473 -5.143 351 HD22 ASN 896 HD22 ASN 896 -21.860 -7.285 -6.298 352 H SER 897 HN SER 897 -21.138 -3.969 -3.224 353 HA SER 897 HA SER 897 -23.250 -3.930 -1.382 354 HB2 SER 897 HB1 SER 897 -23.131 -3.154 -4.326 355 HB3 SER 897 HB2 SER 897 -24.466 -2.735 -3.263 356 HG SER 897 HG1 SER 897 -23.034 -1.502 -2.003 357 H ASP 898 HN ASP 898 -23.130 -5.588 -4.497 358 HA ASP 898 HA ASP 898 -25.888 -6.583 -4.225 359 HB2 ASP 898 HB1 ASP 898 -24.005 -7.176 -6.495 360 HB3 ASP 898 HB2 ASP 898 -25.760 -7.229 -6.492 361 H LYS 899 HN LYS 899 -26.080 -8.147 -2.833 362 HA LYS 899 HA LYS 899 -24.274 -10.175 -2.123 363 HB2 LYS 899 HB1 LYS 899 -27.316 -10.164 -1.914 364 HB3 LYS 899 HB2 LYS 899 -26.237 -11.256 -1.050 365 HG2 LYS 899 HG1 LYS 899 -25.884 -8.261 -0.740 366 HG3 LYS 899 HG2 LYS 899 -27.153 -9.097 0.146 367 HD2 LYS 899 HD1 LYS 899 -24.298 -10.090 0.201 368 HD3 LYS 899 HD2 LYS 899 -24.888 -8.830 1.316 369 HE2 LYS 899 HE1 LYS 899 -26.671 -10.358 2.101 370 HE3 LYS 899 HE2 LYS 899 -26.104 -11.610 0.993 371 HZ1 LYS 899 HZ1 LYS 899 -23.988 -11.639 2.218 372 HZ2 LYS 899 HZ2 LYS 899 -24.515 -10.476 3.240 373 HZ3 LYS 899 HZ3 LYS 899 -25.225 -11.945 3.237 374 H ARG 900 HN ARG 900 -26.243 -10.095 -4.916 375 HA ARG 900 HA ARG 900 -26.290 -12.944 -5.597 376 HB2 ARG 900 HB1 ARG 900 -26.708 -10.338 -7.113 377 HB3 ARG 900 HB2 ARG 900 -26.588 -11.867 -7.967 378 HG2 ARG 900 HG1 ARG 900 -28.898 -11.349 -7.671 379 HG3 ARG 900 HG2 ARG 900 -28.501 -12.784 -6.728 380 HD2 ARG 900 HD1 ARG 900 -28.507 -11.448 -4.649 381 HD3 ARG 900 HD2 ARG 900 -28.741 -9.970 -5.584 382 HE ARG 900 HE ARG 900 -30.984 -10.466 -5.887 383 HH11 ARG 900 HH11 ARG 900 -29.510 -13.301 -4.432 384 HH12 ARG 900 HH12 ARG 900 -31.054 -14.031 -4.092 385 HH21 ARG 900 HH21 ARG 900 -32.906 -11.461 -5.422 386 HH22 ARG 900 HH22 ARG 900 -32.918 -13.014 -4.641 387 H PHE 901 HN PHE 901 -23.872 -10.446 -5.841 388 HA PHE 901 HA PHE 901 -22.094 -12.302 -7.345 389 HB2 PHE 901 HB1 PHE 901 -22.093 -9.287 -7.612 390 HB3 PHE 901 HB2 PHE 901 -21.228 -10.443 -8.610 391 HD1 PHE 901 HD1 PHE 901 -24.568 -8.993 -7.847 392 HD2 PHE 901 HD2 PHE 901 -22.270 -11.405 -10.570 393 HE1 PHE 901 HE1 PHE 901 -26.389 -8.836 -9.525 394 HE2 PHE 901 HE2 PHE 901 -24.089 -11.261 -12.244 395 HZ PHE 901 HZ PHE 901 -26.154 -9.974 -11.725 396 H ALA 902 HN ALA 902 -22.368 -11.217 -4.434 397 HA ALA 902 HA ALA 902 -19.814 -9.982 -3.894 398 HB1 ALA 902 HB1 ALA 902 -21.970 -9.227 -2.837 399 HB2 ALA 902 HB2 ALA 902 -22.080 -10.801 -2.011 400 HB3 ALA 902 HB3 ALA 902 -20.762 -9.678 -1.630 401 H ASP 903 HN ASP 903 -19.316 -12.439 -4.877 402 HA ASP 903 HA ASP 903 -17.364 -13.252 -2.885 403 HB2 ASP 903 HB1 ASP 903 -19.599 -15.094 -3.607 404 HB3 ASP 903 HB2 ASP 903 -17.984 -15.783 -3.542 405 H CYS 904 HN CYS 904 -15.548 -14.167 -3.649 406 HA CYS 904 HA CYS 904 -14.679 -13.678 -6.261 407 HB2 CYS 904 HB1 CYS 904 -13.693 -15.661 -4.147 408 HB3 CYS 904 HB2 CYS 904 -12.766 -15.077 -5.530 409 H SER 905 HN SER 905 -16.683 -16.203 -5.115 410 HA SER 905 HA SER 905 -16.121 -18.128 -7.330 411 HB2 SER 905 HB1 SER 905 -18.005 -18.341 -4.959 412 HB3 SER 905 HB2 SER 905 -17.709 -19.585 -6.187 413 HG SER 905 HG1 SER 905 -15.811 -18.505 -4.344 414 H LYS 906 HN LYS 906 -18.284 -15.513 -6.595 415 HA LYS 906 HA LYS 906 -20.502 -16.486 -8.296 416 HB2 LYS 906 HB1 LYS 906 -19.882 -13.885 -6.867 417 HB3 LYS 906 HB2 LYS 906 -21.258 -14.067 -7.950 418 HG2 LYS 906 HG1 LYS 906 -20.852 -15.513 -5.323 419 HG3 LYS 906 HG2 LYS 906 -21.951 -14.177 -5.687 420 HD2 LYS 906 HD1 LYS 906 -23.430 -15.906 -5.775 421 HD3 LYS 906 HD2 LYS 906 -22.952 -15.870 -7.474 422 HE2 LYS 906 HE1 LYS 906 -21.290 -17.715 -6.980 423 HE3 LYS 906 HE2 LYS 906 -21.816 -17.700 -5.296 424 HZ1 LYS 906 HZ1 LYS 906 -23.566 -18.354 -7.611 425 HZ2 LYS 906 HZ2 LYS 906 -22.945 -19.437 -6.561 426 HZ3 LYS 906 HZ3 LYS 906 -24.041 -18.345 -6.048 427 H SER 907 HN SER 907 -21.373 -14.860 -9.862 428 HA SER 907 HA SER 907 -19.400 -14.643 -12.039 429 HB2 SER 907 HB1 SER 907 -21.624 -15.793 -12.275 430 HB3 SER 907 HB2 SER 907 -22.398 -14.206 -12.129 431 HG SER 907 HG1 SER 907 -20.748 -15.248 -14.187 432 H GLN 908 HN GLN 908 -20.655 -12.605 -13.538 433 HA GLN 908 HA GLN 908 -20.576 -10.098 -12.018 434 HB2 GLN 908 HB1 GLN 908 -18.720 -9.118 -13.137 435 HB3 GLN 908 HB2 GLN 908 -18.190 -10.676 -12.501 436 HG2 GLN 908 HG1 GLN 908 -18.755 -11.559 -14.924 437 HG3 GLN 908 HG2 GLN 908 -18.714 -9.866 -15.342 438 HE21 GLN 908 HE21 GLN 908 -16.685 -9.049 -15.872 439 HE22 GLN 908 HE22 GLN 908 -15.169 -9.869 -15.501 440 H GLU 909 HN GLU 909 -21.013 -8.180 -13.442 441 HA GLU 909 HA GLU 909 -23.361 -8.649 -15.018 442 HB2 GLU 909 HB1 GLU 909 -23.127 -6.714 -13.653 443 HB3 GLU 909 HB2 GLU 909 -21.656 -6.200 -14.464 444 HG2 GLU 909 HG1 GLU 909 -22.889 -5.684 -16.512 445 HG3 GLU 909 HG2 GLU 909 -24.374 -6.346 -15.825 446 H MET 910 HN MET 910 -19.998 -8.304 -16.013 447 HA MET 910 HA MET 910 -20.638 -9.141 -18.743 448 HB2 MET 910 HB1 MET 910 -19.124 -6.538 -18.305 449 HB3 MET 910 HB2 MET 910 -19.306 -7.397 -19.834 450 HG2 MET 910 HG1 MET 910 -21.738 -6.919 -19.790 451 HG3 MET 910 HG2 MET 910 -21.528 -6.069 -18.251 452 HE1 MET 910 HE1 MET 910 -23.032 -4.615 -20.487 453 HE2 MET 910 HE2 MET 910 -22.579 -3.842 -18.949 454 HE3 MET 910 HE3 MET 910 -22.246 -3.021 -20.490 455 H SER 911 HN SER 911 -18.997 -10.506 -19.409 456 HA SER 911 HA SER 911 -16.821 -11.167 -17.642 457 HB2 SER 911 HB1 SER 911 -16.735 -11.871 -20.544 458 HB3 SER 911 HB2 SER 911 -16.189 -12.797 -19.155 459 HG SER 911 HG1 SER 911 -18.138 -13.657 -20.018 460 H ASN 912 HN ASN 912 -14.533 -11.079 -18.120 461 HA ASN 912 HA ASN 912 -13.843 -8.373 -18.178 462 HB2 ASN 912 HB1 ASN 912 -11.916 -10.700 -18.561 463 HB3 ASN 912 HB2 ASN 912 -11.498 -9.048 -18.094 464 HD21 ASN 912 HD21 ASN 912 -10.423 -10.222 -16.270 465 HD22 ASN 912 HD22 ASN 912 -11.451 -10.500 -14.861 466 H GLU 913 HN GLU 913 -13.706 -10.642 -20.845 467 HA GLU 913 HA GLU 913 -12.327 -8.835 -22.705 468 HB2 GLU 913 HB1 GLU 913 -13.728 -11.503 -23.127 469 HB3 GLU 913 HB2 GLU 913 -12.782 -10.638 -24.348 470 HG2 GLU 913 HG1 GLU 913 -10.793 -10.728 -22.813 471 HG3 GLU 913 HG2 GLU 913 -11.717 -11.777 -21.733 472 H GLU 914 HN GLU 914 -15.563 -9.059 -21.658 473 HA GLU 914 HA GLU 914 -16.723 -7.845 -24.122 474 HB2 GLU 914 HB1 GLU 914 -18.087 -8.651 -21.522 475 HB3 GLU 914 HB2 GLU 914 -18.868 -8.092 -22.987 476 HG2 GLU 914 HG1 GLU 914 -17.362 -10.708 -22.584 477 HG3 GLU 914 HG2 GLU 914 -19.098 -10.504 -22.736 478 H ILE 915 HN ILE 915 -16.237 -7.177 -20.592 479 HA ILE 915 HA ILE 915 -17.183 -4.480 -20.818 480 HB ILE 915 HB ILE 915 -17.309 -5.324 -18.683 481 HG12 ILE 915 HG11 ILE 915 -16.084 -3.785 -17.264 482 HG13 ILE 915 HG12 ILE 915 -14.911 -3.453 -18.545 483 HG21 ILE 915 HG21 ILE 915 -15.743 -7.116 -18.539 484 HG22 ILE 915 HG22 ILE 915 -14.349 -6.018 -18.650 485 HG23 ILE 915 HG23 ILE 915 -15.426 -6.039 -17.226 486 HD11 ILE 915 HD1 ILE 915 -16.680 -2.435 -19.907 487 HD12 ILE 915 HD2 ILE 915 -17.901 -2.877 -18.717 488 HD13 ILE 915 HD3 ILE 915 -16.604 -1.700 -18.338 489 H ASN 916 HN ASN 916 -13.790 -5.643 -20.710 490 HA ASN 916 HA ASN 916 -12.653 -3.117 -21.025 491 HB2 ASN 916 HB1 ASN 916 -10.590 -4.194 -21.578 492 HB3 ASN 916 HB2 ASN 916 -11.436 -5.227 -20.434 493 HD21 ASN 916 HD21 ASN 916 -9.408 -6.454 -21.713 494 HD22 ASN 916 HD22 ASN 916 -10.021 -7.465 -23.005 495 H GLU 917 HN GLU 917 -13.942 -5.110 -23.624 496 HA GLU 917 HA GLU 917 -13.298 -3.390 -25.828 497 HB2 GLU 917 HB1 GLU 917 -15.166 -5.651 -25.279 498 HB3 GLU 917 HB2 GLU 917 -15.521 -4.611 -26.662 499 HG2 GLU 917 HG1 GLU 917 -13.174 -4.966 -27.482 500 HG3 GLU 917 HG2 GLU 917 -12.887 -6.062 -26.132 501 H GLU 918 HN GLU 918 -16.056 -3.327 -23.565 502 HA GLU 918 HA GLU 918 -17.591 -1.338 -24.968 503 HB2 GLU 918 HB1 GLU 918 -18.317 -2.918 -22.990 504 HB3 GLU 918 HB2 GLU 918 -17.609 -1.683 -21.943 505 HG2 GLU 918 HG1 GLU 918 -19.912 -1.175 -22.043 506 HG3 GLU 918 HG2 GLU 918 -19.131 0.019 -23.039 507 H LEU 919 HN LEU 919 -15.015 -1.104 -22.520 508 HA LEU 919 HA LEU 919 -15.030 1.841 -22.470 509 HB2 LEU 919 HB1 LEU 919 -13.141 -0.304 -21.477 510 HB3 LEU 919 HB2 LEU 919 -12.825 1.408 -21.249 511 HG LEU 919 HG LEU 919 -15.533 0.632 -20.324 512 HD11 LEU 919 HD11 LEU 919 -14.479 -1.469 -19.824 513 HD12 LEU 919 HD12 LEU 919 -13.083 -0.674 -19.113 514 HD13 LEU 919 HD13 LEU 919 -14.675 -0.565 -18.307 515 HD21 LEU 919 HD21 LEU 919 -13.127 1.922 -18.969 516 HD22 LEU 919 HD22 LEU 919 -14.465 2.767 -19.762 517 HD23 LEU 919 HD23 LEU 919 -14.774 1.791 -18.297 518 H GLY 920 HN GLY 920 -13.241 -0.730 -24.116 519 HA2 GLY 920 HA1 GLY 920 -12.208 -0.644 -26.225 520 HA3 GLY 920 HA2 GLY 920 -12.254 1.122 -26.212 521 H ILE 921 HN ILE 921 -10.913 -1.283 -23.908 522 HA ILE 921 HA ILE 921 -8.244 0.070 -23.989 523 HB ILE 921 HB ILE 921 -8.207 0.126 -21.563 524 HG12 ILE 921 HG11 ILE 921 -11.065 -0.917 -21.652 525 HG13 ILE 921 HG12 ILE 921 -9.660 -1.835 -21.128 526 HG21 ILE 921 HG21 ILE 921 -9.064 2.070 -22.860 527 HG22 ILE 921 HG22 ILE 921 -10.722 1.520 -22.540 528 HG23 ILE 921 HG23 ILE 921 -9.661 1.999 -21.200 529 HD11 ILE 921 HD1 ILE 921 -10.766 -1.096 -19.179 530 HD12 ILE 921 HD2 ILE 921 -9.261 -0.161 -19.316 531 HD13 ILE 921 HD3 ILE 921 -10.829 0.584 -19.745 532 H GLY 922 HN GLY 922 -6.609 -1.022 -22.673 533 HA2 GLY 922 HA1 GLY 922 -6.443 -3.881 -23.375 534 HA3 GLY 922 HA2 GLY 922 -5.119 -2.830 -22.872 535 H GLN 923 HN GLN 923 -8.207 -3.422 -21.135 536 HA GLN 923 HA GLN 923 -6.784 -4.200 -18.691 537 HB2 GLN 923 HB1 GLN 923 -9.079 -3.001 -18.856 538 HB3 GLN 923 HB2 GLN 923 -9.740 -4.607 -19.161 539 HG2 GLN 923 HG1 GLN 923 -10.090 -4.225 -16.917 540 HG3 GLN 923 HG2 GLN 923 -8.732 -5.316 -16.930 541 HE21 GLN 923 HE21 GLN 923 -9.761 -1.938 -16.402 542 HE22 GLN 923 HE22 GLN 923 -8.282 -1.456 -15.583 543 H ASP 924 HN ASP 924 -7.113 -6.208 -17.660 544 HA ASP 924 HA ASP 924 -7.178 -8.427 -17.316 545 HB2 ASP 924 HB1 ASP 924 -9.288 -8.234 -18.814 546 HB3 ASP 924 HB2 ASP 924 -8.308 -8.991 -20.058 547 H GLU 925 HN GLU 925 -5.615 -7.146 -19.970 548 HA GLU 925 HA GLU 925 -3.956 -9.208 -21.008 549 HB2 GLU 925 HB1 GLU 925 -3.397 -6.261 -20.461 550 HB3 GLU 925 HB2 GLU 925 -2.310 -7.284 -21.368 551 HG2 GLU 925 HG1 GLU 925 -5.199 -6.646 -22.094 552 HG3 GLU 925 HG2 GLU 925 -3.776 -5.909 -22.822 553 H ALA 926 HN ALA 926 -3.723 -7.549 -17.995 554 HA ALA 926 HA ALA 926 -1.218 -8.168 -16.896 555 HB1 ALA 926 HB1 ALA 926 -3.973 -8.322 -15.624 556 HB2 ALA 926 HB2 ALA 926 -2.437 -8.069 -14.761 557 HB3 ALA 926 HB3 ALA 926 -3.042 -6.813 -15.860 558 H ASP 927 HN ASP 927 -4.000 -10.313 -17.253 559 HA ASP 927 HA ASP 927 -4.483 -12.432 -16.710 560 HB2 ASP 927 HB1 ASP 927 -1.519 -13.061 -16.805 561 HB3 ASP 927 HB2 ASP 927 -2.837 -14.215 -16.871 562 H ALA 928 HN ALA 928 -3.300 -10.454 -14.540 563 HA ALA 928 HA ALA 928 -3.783 -12.254 -12.234 564 HB1 ALA 928 HB1 ALA 928 -1.232 -10.615 -12.603 565 HB2 ALA 928 HB2 ALA 928 -1.681 -11.530 -11.148 566 HB3 ALA 928 HB3 ALA 928 -1.350 -12.388 -12.662 567 H1 ALA 1 HT1 ALA 1 -6.929 -0.274 -5.232 568 H2 ALA 1 HT2 ALA 1 -5.991 -1.247 -6.150 569 H3 ALA 1 HT3 ALA 1 -6.912 -1.889 -4.944 570 HA ALA 1 HA ALA 1 -8.040 -2.447 -6.858 571 HB1 ALA 1 HB1 ALA 1 -9.364 -0.011 -5.602 572 HB2 ALA 1 HB2 ALA 1 -10.172 -1.225 -6.620 573 HB3 ALA 1 HB3 ALA 1 -9.505 -1.692 -5.052 574 H ARG 2 HN ARG 2 -6.669 -2.116 -8.683 575 HA ARG 2 HA ARG 2 -6.747 0.342 -10.241 576 HB2 ARG 2 HB1 ARG 2 -4.905 -1.179 -10.592 577 HB3 ARG 2 HB2 ARG 2 -5.990 -2.544 -10.853 578 HG2 ARG 2 HG1 ARG 2 -5.037 -1.861 -12.960 579 HG3 ARG 2 HG2 ARG 2 -6.763 -1.599 -12.991 580 HD2 ARG 2 HD1 ARG 2 -5.492 0.835 -12.035 581 HD3 ARG 2 HD2 ARG 2 -4.585 0.269 -13.412 582 HE ARG 2 HE ARG 2 -7.500 0.997 -13.416 583 HH11 ARG 2 HH11 ARG 2 -4.587 0.532 -15.385 584 HH12 ARG 2 HH12 ARG 2 -5.341 1.323 -16.738 585 HH21 ARG 2 HH21 ARG 2 -8.273 2.044 -15.108 586 HH22 ARG 2 HH22 ARG 2 -7.374 2.130 -16.608 587 H THR 3 HN THR 3 -8.518 1.109 -11.324 588 HA THR 3 HA THR 3 -10.094 -0.779 -12.942 589 HB THR 3 HB THR 3 -11.128 -0.845 -10.635 590 HG1 THR 3 HG1 THR 3 -12.547 -1.324 -12.199 591 HG21 THR 3 HG21 THR 3 -10.762 1.530 -9.950 592 HG22 THR 3 HG22 THR 3 -11.995 2.035 -11.132 593 HG23 THR 3 HG23 THR 3 -12.437 0.992 -9.779 594 H MLZ 4 HN MLZ 4 -12.317 1.009 -13.357 595 HA MLZ 4 HA MLZ 4 -11.458 3.414 -14.730 596 HB2 MLZ 4 HB1 MLZ 4 -11.548 2.528 -16.984 597 HB3 MLZ 4 HB2 MLZ 4 -10.424 1.521 -16.110 598 HG2 MLZ 4 HG1 MLZ 4 -13.307 0.832 -16.785 599 HG3 MLZ 4 HG2 MLZ 4 -11.847 0.284 -17.604 600 HD2 MLZ 4 HD1 MLZ 4 -11.203 -0.868 -15.433 601 HD3 MLZ 4 HD2 MLZ 4 -12.847 -0.526 -14.872 602 HE2 MLZ 4 HE1 MLZ 4 -13.812 -1.742 -16.790 603 HE3 MLZ 4 HE2 MLZ 4 -12.206 -2.028 -17.463 604 HZ MLZ 4 HZ1 MLZ 4 -13.290 -3.156 -14.913 605 HCM1 MLZ 4 HC1 MLZ 4 -12.887 -5.274 -16.123 606 HCM2 MLZ 4 HC2 MLZ 4 -14.087 -4.247 -16.879 607 HCM3 MLZ 4 HC3 MLZ 4 -12.438 -4.303 -17.535 608 HZ2 MLZ 4 HZ2 MLZ 4 -11.738 -3.326 -15.327 609 H GLN 5 HN GLN 5 -13.413 3.796 -16.574 610 HA GLN 5 HA GLN 5 -15.994 3.012 -15.495 611 HB2 GLN 5 HB1 GLN 5 -16.838 5.147 -15.103 612 HB3 GLN 5 HB2 GLN 5 -15.438 4.882 -14.070 613 HG2 GLN 5 HG1 GLN 5 -15.303 6.587 -16.600 614 HG3 GLN 5 HG2 GLN 5 -15.849 7.192 -15.062 615 HE21 GLN 5 HE21 GLN 5 -14.036 8.748 -15.476 616 HE22 GLN 5 HE22 GLN 5 -12.425 8.255 -14.940 617 H THR 6 HN THR 6 -17.423 2.754 -16.884 618 HA THR 6 HA THR 6 -16.846 2.605 -19.621 619 HB THR 6 HB THR 6 -19.469 2.147 -19.696 620 HG1 THR 6 HG1 THR 6 -19.638 3.030 -17.494 621 HG21 THR 6 HG21 THR 6 -17.394 0.436 -18.371 622 HG22 THR 6 HG22 THR 6 -19.030 -0.127 -18.863 623 HG23 THR 6 HG23 THR 6 -17.884 0.445 -20.077 624 H ALA 7 HN ALA 7 -17.102 3.750 -21.332 625 HA ALA 7 HA ALA 7 -18.270 6.441 -21.281 626 HB1 ALA 7 HB1 ALA 7 -17.236 6.604 -23.495 627 HB2 ALA 7 HB2 ALA 7 -16.071 6.009 -22.294 628 HB3 ALA 7 HB3 ALA 7 -16.821 4.875 -23.448 629 H ARG 8 HN ARG 8 -20.284 4.915 -20.765 630 HA ARG 8 HA ARG 8 -22.021 4.738 -23.181 631 HB2 ARG 8 HB1 ARG 8 -21.525 2.428 -21.237 632 HB3 ARG 8 HB2 ARG 8 -22.854 2.492 -22.394 633 HG2 ARG 8 HG1 ARG 8 -19.888 2.408 -23.027 634 HG3 ARG 8 HG2 ARG 8 -21.069 1.102 -23.152 635 HD2 ARG 8 HD1 ARG 8 -22.252 2.233 -24.943 636 HD3 ARG 8 HD2 ARG 8 -21.172 3.622 -24.853 637 HE ARG 8 HE ARG 8 -20.441 0.849 -25.720 638 HH11 ARG 8 HH11 ARG 8 -19.254 4.138 -25.314 639 HH12 ARG 8 HH12 ARG 8 -17.924 3.851 -26.408 640 HH21 ARG 8 HH21 ARG 8 -18.763 0.565 -26.998 641 HH22 ARG 8 HH22 ARG 8 -17.619 1.845 -27.308 642 H TYR 9 HN TYR 9 -23.324 6.280 -22.679 643 HA TYR 9 HA TYR 9 -24.491 6.898 -20.123 644 HB2 TYR 9 HB1 TYR 9 -24.187 8.536 -21.918 645 HB3 TYR 9 HB2 TYR 9 -25.282 7.643 -22.962 646 HD1 TYR 9 HD1 TYR 9 -27.650 7.994 -22.855 647 HD2 TYR 9 HD2 TYR 9 -25.078 9.608 -19.790 648 HE1 TYR 9 HE1 TYR 9 -29.548 9.351 -21.980 649 HE2 TYR 9 HE2 TYR 9 -26.980 10.966 -18.913 650 HH TYR 9 HH TYR 9 -30.239 10.866 -20.409 Start of MODEL 2 1 H1 GLY 850 HT1 GLY 850 5.065 -4.424 -0.126 2 H2 GLY 850 HT2 GLY 850 5.638 -3.059 -0.831 3 H3 GLY 850 HT3 GLY 850 5.982 -4.525 -1.479 4 HA2 GLY 850 HA1 GLY 850 3.303 -3.296 -1.326 5 HA3 GLY 850 HA2 GLY 850 4.292 -3.428 -2.791 6 H SER 851 HN SER 851 2.468 -4.563 -3.726 7 HA SER 851 HA SER 851 2.683 -7.468 -3.434 8 HB2 SER 851 HB1 SER 851 0.390 -7.924 -2.961 9 HB3 SER 851 HB2 SER 851 0.966 -6.821 -1.714 10 HG SER 851 HG1 SER 851 -0.056 -5.111 -2.814 11 H ARG 852 HN ARG 852 0.719 -8.381 -5.006 12 HA ARG 852 HA ARG 852 1.674 -7.697 -7.643 13 HB2 ARG 852 HB1 ARG 852 -0.413 -9.600 -6.528 14 HB3 ARG 852 HB2 ARG 852 -0.355 -9.287 -8.253 15 HG2 ARG 852 HG1 ARG 852 0.889 -11.266 -7.821 16 HG3 ARG 852 HG2 ARG 852 1.984 -10.002 -8.384 17 HD2 ARG 852 HD1 ARG 852 2.783 -9.640 -6.081 18 HD3 ARG 852 HD2 ARG 852 1.619 -10.847 -5.480 19 HE ARG 852 HE ARG 852 3.248 -12.018 -7.520 20 HH11 ARG 852 HH11 ARG 852 3.580 -11.002 -4.181 21 HH12 ARG 852 HH12 ARG 852 4.872 -12.130 -3.875 22 HH21 ARG 852 HH21 ARG 852 4.893 -13.432 -7.057 23 HH22 ARG 852 HH22 ARG 852 5.590 -13.467 -5.465 24 H ARG 853 HN ARG 853 -0.961 -6.301 -5.886 25 HA ARG 853 HA ARG 853 -2.354 -5.466 -8.364 26 HB2 ARG 853 HB1 ARG 853 -3.350 -4.400 -5.763 27 HB3 ARG 853 HB2 ARG 853 -4.205 -4.920 -7.205 28 HG2 ARG 853 HG1 ARG 853 -4.893 -6.390 -5.604 29 HG3 ARG 853 HG2 ARG 853 -3.701 -7.338 -6.497 30 HD2 ARG 853 HD1 ARG 853 -2.105 -7.156 -4.708 31 HD3 ARG 853 HD2 ARG 853 -2.955 -5.772 -3.991 32 HE ARG 853 HE ARG 853 -4.711 -8.007 -3.950 33 HH11 ARG 853 HH11 ARG 853 -1.809 -6.927 -2.298 34 HH12 ARG 853 HH12 ARG 853 -2.256 -7.763 -0.826 35 HH21 ARG 853 HH21 ARG 853 -5.215 -8.970 -2.144 36 HH22 ARG 853 HH22 ARG 853 -4.155 -8.952 -0.742 37 H ALA 854 HN ALA 854 -3.203 -3.110 -8.307 38 HA ALA 854 HA ALA 854 -1.175 -1.124 -7.543 39 HB1 ALA 854 HB1 ALA 854 -0.348 -2.024 -9.700 40 HB2 ALA 854 HB2 ALA 854 -1.919 -1.672 -10.455 41 HB3 ALA 854 HB3 ALA 854 -0.889 -0.347 -9.874 42 H SER 855 HN SER 855 -1.866 1.088 -8.165 43 HA SER 855 HA SER 855 -4.804 1.530 -7.899 44 HB2 SER 855 HB1 SER 855 -4.161 3.707 -6.975 45 HB3 SER 855 HB2 SER 855 -3.529 2.360 -6.043 46 HG SER 855 HG1 SER 855 -1.930 4.017 -6.444 47 H VAL 856 HN VAL 856 -5.502 3.643 -8.722 48 HA VAL 856 HA VAL 856 -4.126 4.972 -10.865 49 HB VAL 856 HB VAL 856 -5.126 2.983 -12.072 50 HG11 VAL 856 HG11 VAL 856 -7.783 4.428 -11.720 51 HG12 VAL 856 HG12 VAL 856 -7.468 2.943 -12.629 52 HG13 VAL 856 HG13 VAL 856 -7.331 2.951 -10.854 53 HG21 VAL 856 HG21 VAL 856 -4.471 5.068 -13.241 54 HG22 VAL 856 HG22 VAL 856 -5.804 4.202 -14.015 55 HG23 VAL 856 HG23 VAL 856 -6.143 5.662 -13.078 56 H GLY 857 HN GLY 857 -5.164 7.012 -11.431 57 HA2 GLY 857 HA1 GLY 857 -6.469 8.328 -9.266 58 HA3 GLY 857 HA2 GLY 857 -6.285 8.942 -10.917 59 H SER 858 HN SER 858 -7.767 7.156 -12.359 60 HA SER 858 HA SER 858 -9.807 6.750 -13.202 61 HB2 SER 858 HB1 SER 858 -9.928 5.291 -11.169 62 HB3 SER 858 HB2 SER 858 -10.837 6.578 -10.364 63 HG SER 858 HG1 SER 858 -11.571 5.125 -12.713 64 H GLU 859 HN GLU 859 -12.258 7.413 -12.973 65 HA GLU 859 HA GLU 859 -12.652 10.303 -12.485 66 HB2 GLU 859 HB1 GLU 859 -13.280 9.036 -15.165 67 HB3 GLU 859 HB2 GLU 859 -13.670 10.679 -14.687 68 HG2 GLU 859 HG1 GLU 859 -11.329 11.308 -14.678 69 HG3 GLU 859 HG2 GLU 859 -10.819 9.636 -14.936 70 H PHE 860 HN PHE 860 -14.828 10.791 -12.026 71 HA PHE 860 HA PHE 860 -16.171 8.699 -10.731 72 HB2 PHE 860 HB1 PHE 860 -17.305 11.416 -11.479 73 HB3 PHE 860 HB2 PHE 860 -17.890 10.352 -10.214 74 HD1 PHE 860 HD1 PHE 860 -15.554 12.985 -11.053 75 HD2 PHE 860 HD2 PHE 860 -16.348 9.824 -8.221 76 HE1 PHE 860 HE1 PHE 860 -14.006 14.048 -9.431 77 HE2 PHE 860 HE2 PHE 860 -14.807 10.911 -6.594 78 HZ PHE 860 HZ PHE 860 -13.632 13.012 -7.200 79 H THR 861 HN THR 861 -17.441 10.485 -13.597 80 HA THR 861 HA THR 861 -19.205 10.056 -15.001 81 HB THR 861 HB THR 861 -18.576 7.155 -14.650 82 HG1 THR 861 HG1 THR 861 -16.769 8.410 -15.197 83 HG21 THR 861 HG21 THR 861 -20.499 7.182 -16.042 84 HG22 THR 861 HG22 THR 861 -19.998 8.703 -16.841 85 HG23 THR 861 HG23 THR 861 -19.158 7.176 -17.167 86 H GLU 862 HN GLU 862 -21.417 8.270 -14.958 87 HA GLU 862 HA GLU 862 -22.729 8.842 -12.366 88 HB2 GLU 862 HB1 GLU 862 -23.877 9.072 -14.565 89 HB3 GLU 862 HB2 GLU 862 -23.747 7.316 -14.780 90 HG2 GLU 862 HG1 GLU 862 -25.104 6.956 -12.757 91 HG3 GLU 862 HG2 GLU 862 -25.099 8.684 -12.413 92 H SER 863 HN SER 863 -21.265 6.123 -14.005 93 HA SER 863 HA SER 863 -21.063 4.577 -11.563 94 HB2 SER 863 HB1 SER 863 -22.040 2.538 -12.390 95 HB3 SER 863 HB2 SER 863 -23.255 3.812 -12.410 96 HG SER 863 HG1 SER 863 -22.886 4.019 -14.667 97 H ALA 864 HN ALA 864 -19.498 2.894 -11.719 98 HA ALA 864 HA ALA 864 -17.733 2.849 -14.108 99 HB1 ALA 864 HB1 ALA 864 -15.759 3.493 -12.724 100 HB2 ALA 864 HB2 ALA 864 -16.955 4.801 -12.788 101 HB3 ALA 864 HB3 ALA 864 -16.837 3.773 -11.343 102 H TRP 865 HN TRP 865 -15.752 1.245 -13.564 103 HA TRP 865 HA TRP 865 -16.866 -1.038 -11.993 104 HB2 TRP 865 HB1 TRP 865 -14.560 -0.924 -13.902 105 HB3 TRP 865 HB2 TRP 865 -15.141 -2.355 -13.080 106 HD1 TRP 865 HD1 TRP 865 -16.483 0.264 -15.585 107 HE1 TRP 865 HE1 TRP 865 -18.329 -0.770 -17.007 108 HE3 TRP 865 HE3 TRP 865 -16.640 -4.306 -13.362 109 HZ2 TRP 865 HZ2 TRP 865 -19.584 -3.410 -17.269 110 HZ3 TRP 865 HZ3 TRP 865 -18.048 -6.136 -14.301 111 HH2 TRP 865 HH2 TRP 865 -19.488 -5.697 -16.267 112 H VAL 866 HN VAL 866 -15.273 -2.389 -10.809 113 HA VAL 866 HA VAL 866 -12.842 -1.134 -9.748 114 HB VAL 866 HB VAL 866 -14.510 -0.399 -8.131 115 HG11 VAL 866 HG11 VAL 866 -15.093 -3.337 -7.570 116 HG12 VAL 866 HG12 VAL 866 -15.777 -1.923 -6.745 117 HG13 VAL 866 HG13 VAL 866 -16.176 -2.234 -8.434 118 HG21 VAL 866 HG21 VAL 866 -13.529 -1.176 -6.086 119 HG22 VAL 866 HG22 VAL 866 -12.826 -2.594 -6.880 120 HG23 VAL 866 HG23 VAL 866 -12.249 -0.957 -7.298 121 H ARG 867 HN ARG 867 -11.233 -2.675 -9.271 122 HA ARG 867 HA ARG 867 -11.868 -5.532 -9.830 123 HB2 ARG 867 HB1 ARG 867 -9.724 -3.974 -10.574 124 HB3 ARG 867 HB2 ARG 867 -9.077 -4.759 -9.154 125 HG2 ARG 867 HG1 ARG 867 -9.601 -6.988 -10.151 126 HG3 ARG 867 HG2 ARG 867 -10.274 -6.172 -11.576 127 HD2 ARG 867 HD1 ARG 867 -8.196 -6.716 -12.304 128 HD3 ARG 867 HD2 ARG 867 -8.024 -5.024 -11.858 129 HE ARG 867 HE ARG 867 -6.800 -7.399 -10.555 130 HH11 ARG 867 HH11 ARG 867 -7.076 -3.928 -10.382 131 HH12 ARG 867 HH12 ARG 867 -5.426 -3.779 -9.823 132 HH21 ARG 867 HH21 ARG 867 -4.804 -7.135 -10.206 133 HH22 ARG 867 HH22 ARG 867 -4.136 -5.619 -9.687 134 H CYS 868 HN CYS 868 -11.866 -7.107 -8.294 135 HA CYS 868 HA CYS 868 -11.723 -6.534 -5.494 136 HB2 CYS 868 HB1 CYS 868 -13.084 -8.334 -6.347 137 HB3 CYS 868 HB2 CYS 868 -11.680 -9.116 -7.077 138 H ASP 869 HN ASP 869 -10.018 -6.189 -4.251 139 HA ASP 869 HA ASP 869 -7.260 -6.592 -4.960 140 HB2 ASP 869 HB1 ASP 869 -8.752 -5.957 -2.395 141 HB3 ASP 869 HB2 ASP 869 -7.029 -6.290 -2.365 142 H ASP 870 HN ASP 870 -9.571 -8.948 -3.887 143 HA ASP 870 HA ASP 870 -7.402 -10.734 -2.890 144 HB2 ASP 870 HB1 ASP 870 -9.451 -10.239 -1.461 145 HB3 ASP 870 HB2 ASP 870 -10.392 -11.165 -2.623 146 H CYS 871 HN CYS 871 -9.416 -10.220 -5.621 147 HA CYS 871 HA CYS 871 -8.633 -12.851 -6.808 148 HB2 CYS 871 HB1 CYS 871 -11.157 -11.200 -7.297 149 HB3 CYS 871 HB2 CYS 871 -10.678 -12.657 -8.199 150 H PHE 872 HN PHE 872 -10.158 -10.494 -8.540 151 HA PHE 872 HA PHE 872 -8.519 -9.011 -10.158 152 HB2 PHE 872 HB1 PHE 872 -8.163 -10.363 -12.150 153 HB3 PHE 872 HB2 PHE 872 -7.268 -11.035 -10.810 154 HD1 PHE 872 HD1 PHE 872 -10.112 -11.537 -13.131 155 HD2 PHE 872 HD2 PHE 872 -7.853 -13.261 -9.883 156 HE1 PHE 872 HE1 PHE 872 -11.197 -13.731 -13.535 157 HE2 PHE 872 HE2 PHE 872 -8.951 -15.450 -10.285 158 HZ PHE 872 HZ PHE 872 -10.627 -15.688 -12.109 159 H LYS 873 HN LYS 873 -11.256 -11.137 -9.750 160 HA LYS 873 HA LYS 873 -13.230 -10.613 -11.490 161 HB2 LYS 873 HB1 LYS 873 -13.011 -11.362 -8.763 162 HB3 LYS 873 HB2 LYS 873 -14.101 -9.987 -8.733 163 HG2 LYS 873 HG1 LYS 873 -14.586 -12.288 -10.615 164 HG3 LYS 873 HG2 LYS 873 -15.041 -12.370 -8.895 165 HD2 LYS 873 HD1 LYS 873 -15.900 -10.056 -10.570 166 HD3 LYS 873 HD2 LYS 873 -16.816 -11.572 -10.616 167 HE2 LYS 873 HE1 LYS 873 -16.121 -10.181 -8.019 168 HE3 LYS 873 HE2 LYS 873 -17.523 -9.665 -8.975 169 HZ1 LYS 873 HZ1 LYS 873 -18.366 -11.939 -8.812 170 HZ2 LYS 873 HZ2 LYS 873 -17.128 -12.364 -7.803 171 HZ3 LYS 873 HZ3 LYS 873 -18.232 -11.253 -7.330 172 H TRP 874 HN TRP 874 -14.536 -9.031 -12.151 173 HA TRP 874 HA TRP 874 -14.000 -6.229 -11.237 174 HB2 TRP 874 HB1 TRP 874 -15.190 -7.173 -13.871 175 HB3 TRP 874 HB2 TRP 874 -14.883 -5.521 -13.396 176 HD1 TRP 874 HD1 TRP 874 -13.096 -8.496 -14.841 177 HE1 TRP 874 HE1 TRP 874 -10.637 -7.887 -15.336 178 HE3 TRP 874 HE3 TRP 874 -12.852 -3.933 -12.482 179 HZ2 TRP 874 HZ2 TRP 874 -8.862 -5.873 -14.738 180 HZ3 TRP 874 HZ3 TRP 874 -10.622 -2.793 -12.340 181 HH2 TRP 874 HH2 TRP 874 -8.691 -3.602 -13.540 182 H ARG 875 HN ARG 875 -15.773 -4.803 -10.907 183 HA ARG 875 HA ARG 875 -18.521 -5.865 -11.100 184 HB2 ARG 875 HB1 ARG 875 -17.186 -5.061 -8.497 185 HB3 ARG 875 HB2 ARG 875 -18.882 -4.688 -8.718 186 HG2 ARG 875 HG1 ARG 875 -17.634 -7.461 -8.770 187 HG3 ARG 875 HG2 ARG 875 -18.660 -6.796 -7.528 188 HD2 ARG 875 HD1 ARG 875 -19.489 -7.592 -10.314 189 HD3 ARG 875 HD2 ARG 875 -19.996 -8.276 -8.775 190 HE ARG 875 HE ARG 875 -20.833 -5.663 -8.538 191 HH11 ARG 875 HH11 ARG 875 -21.662 -8.118 -10.915 192 HH12 ARG 875 HH12 ARG 875 -22.888 -7.071 -11.609 193 HH21 ARG 875 HH21 ARG 875 -22.732 -4.673 -9.324 194 HH22 ARG 875 HH22 ARG 875 -23.401 -5.306 -10.828 195 H ARG 876 HN ARG 876 -19.905 -4.442 -11.787 196 HA ARG 876 HA ARG 876 -19.113 -1.628 -12.273 197 HB2 ARG 876 HB1 ARG 876 -20.215 -3.276 -13.929 198 HB3 ARG 876 HB2 ARG 876 -21.706 -2.959 -13.074 199 HG2 ARG 876 HG1 ARG 876 -19.870 -0.884 -14.397 200 HG3 ARG 876 HG2 ARG 876 -21.363 -1.518 -15.097 201 HD2 ARG 876 HD1 ARG 876 -21.082 0.147 -12.581 202 HD3 ARG 876 HD2 ARG 876 -21.705 0.699 -14.139 203 HE ARG 876 HE ARG 876 -23.025 -1.478 -12.526 204 HH11 ARG 876 HH11 ARG 876 -23.548 1.493 -14.322 205 HH12 ARG 876 HH12 ARG 876 -25.167 1.013 -14.762 206 HH21 ARG 876 HH21 ARG 876 -24.958 -2.089 -13.269 207 HH22 ARG 876 HH22 ARG 876 -26.025 -0.908 -13.983 208 H ILE 877 HN ILE 877 -19.277 -0.294 -10.760 209 HA ILE 877 HA ILE 877 -21.319 -0.476 -8.595 210 HB ILE 877 HB ILE 877 -19.651 0.661 -7.194 211 HG12 ILE 877 HG11 ILE 877 -17.729 0.434 -9.549 212 HG13 ILE 877 HG12 ILE 877 -18.459 1.933 -8.998 213 HG21 ILE 877 HG21 ILE 877 -18.414 -1.782 -8.521 214 HG22 ILE 877 HG22 ILE 877 -18.216 -1.249 -6.838 215 HG23 ILE 877 HG23 ILE 877 -19.780 -1.852 -7.385 216 HD11 ILE 877 HD1 ILE 877 -16.612 0.259 -7.269 217 HD12 ILE 877 HD2 ILE 877 -16.136 1.656 -8.243 218 HD13 ILE 877 HD3 ILE 877 -17.280 1.861 -6.915 219 HA PRO 878 HA PRO 878 -22.471 3.730 -9.794 220 HB2 PRO 878 HB1 PRO 878 -23.286 4.845 -7.425 221 HB3 PRO 878 HB2 PRO 878 -24.254 3.616 -8.296 222 HG2 PRO 878 HG1 PRO 878 -22.332 3.178 -5.989 223 HG3 PRO 878 HG2 PRO 878 -24.008 2.567 -6.158 224 HD2 PRO 878 HD1 PRO 878 -21.840 1.037 -6.779 225 HD3 PRO 878 HD2 PRO 878 -23.350 0.933 -7.731 226 H ALA 879 HN ALA 879 -21.393 5.682 -9.941 227 HA ALA 879 HA ALA 879 -18.740 5.975 -9.254 228 HB1 ALA 879 HB1 ALA 879 -19.096 8.344 -9.835 229 HB2 ALA 879 HB2 ALA 879 -20.002 7.271 -10.920 230 HB3 ALA 879 HB3 ALA 879 -20.849 8.147 -9.626 231 H SER 880 HN SER 880 -21.393 6.557 -7.043 232 HA SER 880 HA SER 880 -20.053 8.261 -5.136 233 HB2 SER 880 HB1 SER 880 -22.267 6.209 -4.722 234 HB3 SER 880 HB2 SER 880 -21.724 7.393 -3.522 235 HG SER 880 HG1 SER 880 -22.963 7.911 -6.040 236 H VAL 881 HN VAL 881 -19.744 4.831 -5.850 237 HA VAL 881 HA VAL 881 -18.116 4.359 -3.410 238 HB VAL 881 HB VAL 881 -19.010 2.466 -5.614 239 HG11 VAL 881 HG11 VAL 881 -16.852 1.688 -4.618 240 HG12 VAL 881 HG12 VAL 881 -17.587 1.798 -3.002 241 HG13 VAL 881 HG13 VAL 881 -18.203 0.636 -4.195 242 HG21 VAL 881 HG21 VAL 881 -19.897 2.693 -2.709 243 HG22 VAL 881 HG22 VAL 881 -20.859 3.154 -4.126 244 HG23 VAL 881 HG23 VAL 881 -20.433 1.460 -3.872 245 H VAL 882 HN VAL 882 -17.774 4.667 -6.946 246 HA VAL 882 HA VAL 882 -14.998 3.976 -6.836 247 HB VAL 882 HB VAL 882 -16.618 4.188 -8.922 248 HG11 VAL 882 HG11 VAL 882 -16.680 6.735 -8.871 249 HG12 VAL 882 HG12 VAL 882 -14.962 6.722 -9.290 250 HG13 VAL 882 HG13 VAL 882 -16.148 6.025 -10.400 251 HG21 VAL 882 HG21 VAL 882 -13.610 4.680 -9.061 252 HG22 VAL 882 HG22 VAL 882 -14.404 3.100 -8.908 253 HG23 VAL 882 HG23 VAL 882 -14.620 4.059 -10.376 254 H GLY 883 HN GLY 883 -16.623 6.911 -6.079 255 HA2 GLY 883 HA1 GLY 883 -14.240 8.628 -5.995 256 HA3 GLY 883 HA2 GLY 883 -15.855 8.995 -5.376 257 H SER 884 HN SER 884 -15.675 6.301 -3.833 258 HA SER 884 HA SER 884 -14.371 7.373 -1.395 259 HB2 SER 884 HB1 SER 884 -16.669 6.461 -1.278 260 HB3 SER 884 HB2 SER 884 -16.076 4.898 -1.860 261 HG SER 884 HG1 SER 884 -15.487 6.206 0.600 262 H ILE 885 HN ILE 885 -14.164 4.577 -3.595 263 HA ILE 885 HA ILE 885 -12.026 3.233 -2.215 264 HB ILE 885 HB ILE 885 -13.495 2.923 -4.804 265 HG12 ILE 885 HG11 ILE 885 -13.941 0.699 -4.010 266 HG13 ILE 885 HG12 ILE 885 -12.764 0.812 -2.707 267 HG21 ILE 885 HG21 ILE 885 -12.135 1.013 -5.497 268 HG22 ILE 885 HG22 ILE 885 -11.241 2.528 -5.614 269 HG23 ILE 885 HG23 ILE 885 -10.918 1.410 -4.258 270 HD11 ILE 885 HD1 ILE 885 -15.128 1.028 -1.929 271 HD12 ILE 885 HD2 ILE 885 -14.167 2.447 -1.529 272 HD13 ILE 885 HD3 ILE 885 -15.294 2.487 -2.909 273 H ASP 886 HN ASP 886 -9.910 3.343 -2.365 274 HA ASP 886 HA ASP 886 -8.543 5.139 -4.302 275 HB2 ASP 886 HB1 ASP 886 -9.371 6.188 -1.993 276 HB3 ASP 886 HB2 ASP 886 -8.035 5.297 -1.317 277 H GLU 887 HN GLU 887 -6.088 5.170 -3.657 278 HA GLU 887 HA GLU 887 -4.882 2.591 -3.848 279 HB2 GLU 887 HB1 GLU 887 -3.858 4.710 -4.536 280 HB3 GLU 887 HB2 GLU 887 -3.804 5.268 -2.861 281 HG2 GLU 887 HG1 GLU 887 -2.201 3.522 -2.266 282 HG3 GLU 887 HG2 GLU 887 -2.319 2.813 -3.880 283 H SER 888 HN SER 888 -6.037 4.359 -1.014 284 HA SER 888 HA SER 888 -4.585 2.672 0.921 285 HB2 SER 888 HB1 SER 888 -5.801 3.990 2.590 286 HB3 SER 888 HB2 SER 888 -4.970 5.025 1.416 287 HG SER 888 HG1 SER 888 -7.132 5.714 1.826 288 H SER 889 HN SER 889 -7.477 2.338 -0.904 289 HA SER 889 HA SER 889 -9.036 0.876 1.081 290 HB2 SER 889 HB1 SER 889 -9.450 1.196 -1.917 291 HB3 SER 889 HB2 SER 889 -10.632 0.559 -0.764 292 HG SER 889 HG1 SER 889 -10.632 2.583 0.284 293 H ARG 890 HN ARG 890 -9.911 -1.232 0.678 294 HA ARG 890 HA ARG 890 -8.390 -3.130 -1.010 295 HB2 ARG 890 HB1 ARG 890 -8.309 -4.803 0.819 296 HB3 ARG 890 HB2 ARG 890 -7.242 -3.418 1.011 297 HG2 ARG 890 HG1 ARG 890 -8.812 -2.415 2.671 298 HG3 ARG 890 HG2 ARG 890 -9.888 -3.802 2.487 299 HD2 ARG 890 HD1 ARG 890 -8.579 -4.135 4.478 300 HD3 ARG 890 HD2 ARG 890 -8.074 -5.309 3.270 301 HE ARG 890 HE ARG 890 -5.966 -4.346 3.184 302 HH11 ARG 890 HH11 ARG 890 -8.004 -2.118 4.972 303 HH12 ARG 890 HH12 ARG 890 -6.654 -1.115 5.425 304 HH21 ARG 890 HH21 ARG 890 -4.300 -3.024 3.807 305 HH22 ARG 890 HH22 ARG 890 -4.618 -1.625 4.790 306 H TRP 891 HN TRP 891 -10.265 -2.627 -2.271 307 HA TRP 891 HA TRP 891 -12.957 -3.322 -1.329 308 HB2 TRP 891 HB1 TRP 891 -12.487 -1.460 -2.914 309 HB3 TRP 891 HB2 TRP 891 -12.053 -2.666 -4.134 310 HD1 TRP 891 HD1 TRP 891 -14.851 -0.892 -2.543 311 HE1 TRP 891 HE1 TRP 891 -17.102 -1.477 -3.602 312 HE3 TRP 891 HE3 TRP 891 -13.429 -5.058 -5.150 313 HZ2 TRP 891 HZ2 TRP 891 -18.225 -3.703 -5.037 314 HZ3 TRP 891 HZ3 TRP 891 -15.180 -6.493 -6.228 315 HH2 TRP 891 HH2 TRP 891 -17.548 -5.843 -6.094 316 H ILE 892 HN ILE 892 -13.896 -5.340 -1.530 317 HA ILE 892 HA ILE 892 -12.838 -7.262 -3.526 318 HB ILE 892 HB ILE 892 -12.784 -9.068 -1.904 319 HG12 ILE 892 HG11 ILE 892 -13.151 -7.079 0.345 320 HG13 ILE 892 HG12 ILE 892 -14.503 -7.984 -0.344 321 HG21 ILE 892 HG21 ILE 892 -10.732 -8.513 -0.724 322 HG22 ILE 892 HG22 ILE 892 -10.700 -7.761 -2.322 323 HG23 ILE 892 HG23 ILE 892 -11.045 -6.783 -0.883 324 HD11 ILE 892 HD1 ILE 892 -13.648 -9.078 1.659 325 HD12 ILE 892 HD2 ILE 892 -13.581 -10.095 0.200 326 HD13 ILE 892 HD3 ILE 892 -12.092 -9.353 0.862 327 H CYS 893 HN CYS 893 -14.229 -9.152 -3.910 328 HA CYS 893 HA CYS 893 -16.860 -8.611 -4.422 329 HB2 CYS 893 HB1 CYS 893 -15.882 -11.364 -3.623 330 HB3 CYS 893 HB2 CYS 893 -17.213 -10.936 -4.694 331 H MET 894 HN MET 894 -15.652 -9.975 -1.259 332 HA MET 894 HA MET 894 -18.268 -10.609 -0.267 333 HB2 MET 894 HB1 MET 894 -16.103 -11.510 0.599 334 HB3 MET 894 HB2 MET 894 -15.760 -9.921 1.292 335 HG2 MET 894 HG1 MET 894 -16.547 -11.386 3.012 336 HG3 MET 894 HG2 MET 894 -17.726 -10.109 2.762 337 HE1 MET 894 HE1 MET 894 -19.955 -13.105 3.899 338 HE2 MET 894 HE2 MET 894 -18.330 -12.675 4.476 339 HE3 MET 894 HE3 MET 894 -19.529 -11.399 4.155 340 H ASN 895 HN ASN 895 -16.625 -7.558 -0.486 341 HA ASN 895 HA ASN 895 -18.459 -6.167 1.371 342 HB2 ASN 895 HB1 ASN 895 -16.679 -4.896 1.716 343 HB3 ASN 895 HB2 ASN 895 -15.748 -5.855 0.577 344 HD21 ASN 895 HD21 ASN 895 -16.188 -5.210 -1.853 345 HD22 ASN 895 HD22 ASN 895 -16.186 -3.468 -2.114 346 H ASN 896 HN ASN 896 -18.484 -7.050 -1.880 347 HA ASN 896 HA ASN 896 -19.291 -4.821 -3.307 348 HB2 ASN 896 HB1 ASN 896 -18.741 -7.049 -4.294 349 HB3 ASN 896 HB2 ASN 896 -20.270 -7.670 -3.670 350 HD21 ASN 896 HD21 ASN 896 -21.422 -8.148 -5.524 351 HD22 ASN 896 HD22 ASN 896 -21.744 -6.947 -6.743 352 H SER 897 HN SER 897 -21.023 -3.654 -3.633 353 HA SER 897 HA SER 897 -23.267 -3.455 -1.968 354 HB2 SER 897 HB1 SER 897 -22.866 -2.687 -4.888 355 HB3 SER 897 HB2 SER 897 -24.254 -2.192 -3.922 356 HG SER 897 HG1 SER 897 -22.620 -0.595 -3.853 357 H ASP 898 HN ASP 898 -23.034 -5.119 -5.073 358 HA ASP 898 HA ASP 898 -25.858 -5.932 -5.025 359 HB2 ASP 898 HB1 ASP 898 -23.828 -6.663 -7.119 360 HB3 ASP 898 HB2 ASP 898 -25.576 -6.591 -7.274 361 H LYS 899 HN LYS 899 -26.293 -7.458 -3.663 362 HA LYS 899 HA LYS 899 -24.673 -9.562 -2.743 363 HB2 LYS 899 HB1 LYS 899 -27.713 -9.340 -2.771 364 HB3 LYS 899 HB2 LYS 899 -26.790 -10.488 -1.807 365 HG2 LYS 899 HG1 LYS 899 -26.262 -7.511 -1.529 366 HG3 LYS 899 HG2 LYS 899 -27.617 -8.275 -0.700 367 HD2 LYS 899 HD1 LYS 899 -24.861 -9.455 -0.469 368 HD3 LYS 899 HD2 LYS 899 -25.351 -8.095 0.560 369 HE2 LYS 899 HE1 LYS 899 -27.093 -10.553 0.278 370 HE3 LYS 899 HE2 LYS 899 -25.702 -10.583 1.381 371 HZ1 LYS 899 HZ1 LYS 899 -27.727 -9.914 2.537 372 HZ2 LYS 899 HZ2 LYS 899 -26.665 -8.678 2.548 373 HZ3 LYS 899 HZ3 LYS 899 -27.952 -8.643 1.541 374 H ARG 900 HN ARG 900 -26.353 -9.446 -5.703 375 HA ARG 900 HA ARG 900 -26.546 -12.300 -6.309 376 HB2 ARG 900 HB1 ARG 900 -26.434 -9.756 -7.992 377 HB3 ARG 900 HB2 ARG 900 -26.586 -11.351 -8.703 378 HG2 ARG 900 HG1 ARG 900 -28.577 -10.099 -6.753 379 HG3 ARG 900 HG2 ARG 900 -28.743 -10.141 -8.509 380 HD2 ARG 900 HD1 ARG 900 -28.723 -12.660 -8.415 381 HD3 ARG 900 HD2 ARG 900 -28.676 -12.559 -6.656 382 HE ARG 900 HE ARG 900 -30.900 -11.902 -6.578 383 HH11 ARG 900 HH11 ARG 900 -29.954 -11.948 -9.957 384 HH12 ARG 900 HH12 ARG 900 -31.602 -11.815 -10.507 385 HH21 ARG 900 HH21 ARG 900 -32.967 -11.733 -7.354 386 HH22 ARG 900 HH22 ARG 900 -33.256 -11.696 -9.069 387 H PHE 901 HN PHE 901 -23.923 -10.040 -6.325 388 HA PHE 901 HA PHE 901 -22.111 -12.070 -7.573 389 HB2 PHE 901 HB1 PHE 901 -21.903 -9.069 -7.909 390 HB3 PHE 901 HB2 PHE 901 -21.033 -10.302 -8.806 391 HD1 PHE 901 HD1 PHE 901 -22.080 -11.407 -10.738 392 HD2 PHE 901 HD2 PHE 901 -24.209 -8.455 -8.453 393 HE1 PHE 901 HE1 PHE 901 -23.694 -11.145 -12.597 394 HE2 PHE 901 HE2 PHE 901 -25.828 -8.180 -10.314 395 HZ PHE 901 HZ PHE 901 -25.573 -9.523 -12.392 396 H ALA 902 HN ALA 902 -22.619 -10.995 -4.723 397 HA ALA 902 HA ALA 902 -20.091 -9.739 -4.019 398 HB1 ALA 902 HB1 ALA 902 -21.234 -9.212 -1.893 399 HB2 ALA 902 HB2 ALA 902 -22.293 -8.788 -3.245 400 HB3 ALA 902 HB3 ALA 902 -22.577 -10.287 -2.323 401 H ASP 903 HN ASP 903 -19.619 -12.251 -4.781 402 HA ASP 903 HA ASP 903 -18.203 -13.221 -2.384 403 HB2 ASP 903 HB1 ASP 903 -19.843 -15.023 -4.172 404 HB3 ASP 903 HB2 ASP 903 -18.649 -15.602 -3.023 405 H CYS 904 HN CYS 904 -16.211 -14.016 -2.784 406 HA CYS 904 HA CYS 904 -14.866 -13.471 -5.207 407 HB2 CYS 904 HB1 CYS 904 -14.263 -15.198 -2.768 408 HB3 CYS 904 HB2 CYS 904 -13.105 -14.884 -4.061 409 H SER 905 HN SER 905 -16.989 -16.033 -4.466 410 HA SER 905 HA SER 905 -15.979 -17.861 -6.567 411 HB2 SER 905 HB1 SER 905 -18.359 -18.155 -4.706 412 HB3 SER 905 HB2 SER 905 -17.707 -19.392 -5.793 413 HG SER 905 HG1 SER 905 -15.814 -19.441 -4.566 414 H LYS 906 HN LYS 906 -18.242 -15.246 -6.275 415 HA LYS 906 HA LYS 906 -20.188 -16.267 -8.239 416 HB2 LYS 906 HB1 LYS 906 -19.866 -13.726 -6.647 417 HB3 LYS 906 HB2 LYS 906 -20.919 -13.737 -8.054 418 HG2 LYS 906 HG1 LYS 906 -21.308 -15.512 -5.626 419 HG3 LYS 906 HG2 LYS 906 -22.116 -13.975 -5.975 420 HD2 LYS 906 HD1 LYS 906 -23.726 -15.388 -6.700 421 HD3 LYS 906 HD2 LYS 906 -22.842 -15.220 -8.217 422 HE2 LYS 906 HE1 LYS 906 -21.655 -17.385 -7.705 423 HE3 LYS 906 HE2 LYS 906 -22.525 -17.479 -6.174 424 HZ1 LYS 906 HZ1 LYS 906 -23.808 -17.516 -8.857 425 HZ2 LYS 906 HZ2 LYS 906 -23.600 -18.815 -7.891 426 HZ3 LYS 906 HZ3 LYS 906 -24.604 -17.616 -7.432 427 H SER 907 HN SER 907 -20.932 -14.692 -9.834 428 HA SER 907 HA SER 907 -18.951 -14.359 -11.963 429 HB2 SER 907 HB1 SER 907 -21.002 -14.099 -13.293 430 HB3 SER 907 HB2 SER 907 -21.129 -15.502 -12.204 431 HG SER 907 HG1 SER 907 -23.027 -14.224 -12.169 432 H GLN 908 HN GLN 908 -20.120 -12.264 -13.364 433 HA GLN 908 HA GLN 908 -20.307 -9.863 -11.713 434 HB2 GLN 908 HB1 GLN 908 -18.522 -8.657 -12.799 435 HB3 GLN 908 HB2 GLN 908 -17.899 -10.094 -11.988 436 HG2 GLN 908 HG1 GLN 908 -18.067 -11.197 -14.383 437 HG3 GLN 908 HG2 GLN 908 -18.275 -9.551 -14.918 438 HE21 GLN 908 HE21 GLN 908 -16.340 -9.231 -16.015 439 HE22 GLN 908 HE22 GLN 908 -14.749 -9.499 -15.295 440 H GLU 909 HN GLU 909 -20.606 -7.875 -13.215 441 HA GLU 909 HA GLU 909 -23.036 -8.262 -14.580 442 HB2 GLU 909 HB1 GLU 909 -21.721 -6.123 -13.515 443 HB3 GLU 909 HB2 GLU 909 -21.342 -5.860 -15.185 444 HG2 GLU 909 HG1 GLU 909 -23.257 -4.783 -15.423 445 HG3 GLU 909 HG2 GLU 909 -24.111 -6.311 -15.254 446 H MET 910 HN MET 910 -19.774 -8.346 -15.852 447 HA MET 910 HA MET 910 -20.577 -9.289 -18.497 448 HB2 MET 910 HB1 MET 910 -18.905 -6.752 -18.296 449 HB3 MET 910 HB2 MET 910 -19.308 -7.633 -19.765 450 HG2 MET 910 HG1 MET 910 -21.680 -6.967 -19.496 451 HG3 MET 910 HG2 MET 910 -21.253 -6.088 -18.018 452 HE1 MET 910 HE1 MET 910 -21.975 -3.087 -20.339 453 HE2 MET 910 HE2 MET 910 -22.858 -4.625 -20.211 454 HE3 MET 910 HE3 MET 910 -22.243 -3.825 -18.745 455 H SER 911 HN SER 911 -18.890 -10.687 -19.252 456 HA SER 911 HA SER 911 -16.607 -11.242 -17.583 457 HB2 SER 911 HB1 SER 911 -16.573 -11.884 -20.502 458 HB3 SER 911 HB2 SER 911 -15.937 -12.807 -19.149 459 HG SER 911 HG1 SER 911 -17.857 -13.760 -19.976 460 H ASN 912 HN ASN 912 -14.319 -10.979 -18.158 461 HA ASN 912 HA ASN 912 -13.787 -8.208 -18.346 462 HB2 ASN 912 HB1 ASN 912 -12.197 -9.419 -17.115 463 HB3 ASN 912 HB2 ASN 912 -11.997 -10.645 -18.380 464 HD21 ASN 912 HD21 ASN 912 -11.238 -7.301 -17.458 465 HD22 ASN 912 HD22 ASN 912 -9.842 -7.196 -18.532 466 H GLU 913 HN GLU 913 -13.662 -10.614 -20.911 467 HA GLU 913 HA GLU 913 -12.511 -8.848 -22.926 468 HB2 GLU 913 HB1 GLU 913 -12.212 -11.307 -22.811 469 HB3 GLU 913 HB2 GLU 913 -13.925 -11.532 -23.188 470 HG2 GLU 913 HG1 GLU 913 -13.621 -10.669 -25.419 471 HG3 GLU 913 HG2 GLU 913 -12.033 -10.003 -25.010 472 H GLU 914 HN GLU 914 -15.649 -9.035 -21.633 473 HA GLU 914 HA GLU 914 -16.964 -7.866 -24.045 474 HB2 GLU 914 HB1 GLU 914 -18.186 -8.857 -21.438 475 HB3 GLU 914 HB2 GLU 914 -19.063 -8.263 -22.836 476 HG2 GLU 914 HG1 GLU 914 -17.411 -10.812 -22.639 477 HG3 GLU 914 HG2 GLU 914 -19.160 -10.690 -22.723 478 H ILE 915 HN ILE 915 -16.220 -7.170 -20.577 479 HA ILE 915 HA ILE 915 -17.371 -4.508 -20.748 480 HB ILE 915 HB ILE 915 -17.325 -5.158 -18.585 481 HG12 ILE 915 HG11 ILE 915 -15.810 -3.785 -17.290 482 HG13 ILE 915 HG12 ILE 915 -14.739 -3.553 -18.674 483 HG21 ILE 915 HG21 ILE 915 -14.490 -6.169 -18.807 484 HG22 ILE 915 HG22 ILE 915 -15.396 -6.022 -17.268 485 HG23 ILE 915 HG23 ILE 915 -15.990 -7.088 -18.498 486 HD11 ILE 915 HD1 ILE 915 -16.265 -1.659 -18.143 487 HD12 ILE 915 HD2 ILE 915 -16.427 -2.204 -19.785 488 HD13 ILE 915 HD3 ILE 915 -17.656 -2.679 -18.630 489 H ASN 916 HN ASN 916 -13.918 -5.518 -20.901 490 HA ASN 916 HA ASN 916 -12.875 -2.962 -21.259 491 HB2 ASN 916 HB1 ASN 916 -10.873 -4.011 -22.066 492 HB3 ASN 916 HB2 ASN 916 -11.564 -5.010 -20.814 493 HD21 ASN 916 HD21 ASN 916 -9.698 -6.254 -22.292 494 HD22 ASN 916 HD22 ASN 916 -10.455 -7.317 -23.464 495 H GLU 917 HN GLU 917 -14.342 -4.912 -23.790 496 HA GLU 917 HA GLU 917 -13.908 -3.396 -26.105 497 HB2 GLU 917 HB1 GLU 917 -15.139 -5.658 -25.551 498 HB3 GLU 917 HB2 GLU 917 -16.535 -4.661 -25.383 499 HG2 GLU 917 HG1 GLU 917 -16.442 -5.644 -27.624 500 HG3 GLU 917 HG2 GLU 917 -16.471 -3.888 -27.646 501 H GLU 918 HN GLU 918 -16.274 -2.922 -23.554 502 HA GLU 918 HA GLU 918 -18.025 -1.105 -24.890 503 HB2 GLU 918 HB1 GLU 918 -18.429 -2.443 -22.702 504 HB3 GLU 918 HB2 GLU 918 -17.574 -1.144 -21.870 505 HG2 GLU 918 HG1 GLU 918 -19.966 -0.787 -21.731 506 HG3 GLU 918 HG2 GLU 918 -19.226 0.501 -22.665 507 H LEU 919 HN LEU 919 -15.178 -0.447 -22.845 508 HA LEU 919 HA LEU 919 -15.450 2.472 -23.238 509 HB2 LEU 919 HB1 LEU 919 -13.069 1.128 -21.954 510 HB3 LEU 919 HB2 LEU 919 -13.651 2.763 -21.792 511 HG LEU 919 HG LEU 919 -15.823 1.457 -20.797 512 HD11 LEU 919 HD11 LEU 919 -14.891 -0.354 -19.290 513 HD12 LEU 919 HD12 LEU 919 -14.959 -0.779 -20.997 514 HD13 LEU 919 HD13 LEU 919 -13.413 -0.326 -20.276 515 HD21 LEU 919 HD21 LEU 919 -14.564 3.251 -19.685 516 HD22 LEU 919 HD22 LEU 919 -14.929 1.913 -18.574 517 HD23 LEU 919 HD23 LEU 919 -13.284 2.100 -19.257 518 H GLY 920 HN GLY 920 -13.742 -0.226 -24.601 519 HA2 GLY 920 HA1 GLY 920 -12.873 -0.272 -26.813 520 HA3 GLY 920 HA2 GLY 920 -12.625 1.476 -26.783 521 H ILE 921 HN ILE 921 -11.620 -1.042 -24.459 522 HA ILE 921 HA ILE 921 -8.737 -0.361 -24.836 523 HB ILE 921 HB ILE 921 -8.455 -0.310 -22.418 524 HG12 ILE 921 HG11 ILE 921 -11.489 -0.471 -22.177 525 HG13 ILE 921 HG12 ILE 921 -10.373 -1.782 -21.806 526 HG21 ILE 921 HG21 ILE 921 -10.582 1.697 -23.237 527 HG22 ILE 921 HG22 ILE 921 -9.314 1.891 -22.009 528 HG23 ILE 921 HG23 ILE 921 -8.869 1.767 -23.714 529 HD11 ILE 921 HD1 ILE 921 -10.587 0.852 -20.325 530 HD12 ILE 921 HD2 ILE 921 -10.955 -0.781 -19.741 531 HD13 ILE 921 HD3 ILE 921 -9.274 -0.332 -20.078 532 H GLY 922 HN GLY 922 -7.312 -1.889 -23.615 533 HA2 GLY 922 HA1 GLY 922 -8.044 -4.700 -24.190 534 HA3 GLY 922 HA2 GLY 922 -6.472 -4.065 -23.697 535 H GLN 923 HN GLN 923 -7.761 -2.660 -21.410 536 HA GLN 923 HA GLN 923 -7.526 -2.873 -19.195 537 HB2 GLN 923 HB1 GLN 923 -9.213 -5.144 -19.680 538 HB3 GLN 923 HB2 GLN 923 -7.931 -5.681 -18.624 539 HG2 GLN 923 HG1 GLN 923 -10.069 -3.625 -18.145 540 HG3 GLN 923 HG2 GLN 923 -9.617 -5.049 -17.182 541 HE21 GLN 923 HE21 GLN 923 -9.588 -1.684 -17.019 542 HE22 GLN 923 HE22 GLN 923 -8.179 -1.524 -16.011 543 H ASP 924 HN ASP 924 -6.227 -4.145 -17.502 544 HA ASP 924 HA ASP 924 -3.509 -4.413 -18.748 545 HB2 ASP 924 HB1 ASP 924 -4.420 -3.444 -16.030 546 HB3 ASP 924 HB2 ASP 924 -2.742 -3.616 -16.506 547 H GLU 925 HN GLU 925 -5.682 -6.214 -16.652 548 HA GLU 925 HA GLU 925 -3.730 -7.647 -15.191 549 HB2 GLU 925 HB1 GLU 925 -6.404 -7.319 -14.976 550 HB3 GLU 925 HB2 GLU 925 -6.425 -8.838 -15.837 551 HG2 GLU 925 HG1 GLU 925 -6.534 -9.396 -13.574 552 HG3 GLU 925 HG2 GLU 925 -4.880 -9.782 -14.051 553 H ALA 926 HN ALA 926 -5.233 -8.379 -18.232 554 HA ALA 926 HA ALA 926 -4.990 -9.821 -19.919 555 HB1 ALA 926 HB1 ALA 926 -2.828 -10.824 -20.360 556 HB2 ALA 926 HB2 ALA 926 -2.585 -9.179 -19.729 557 HB3 ALA 926 HB3 ALA 926 -2.341 -10.595 -18.668 558 H ASP 927 HN ASP 927 -4.059 -11.355 -16.924 559 HA ASP 927 HA ASP 927 -4.946 -14.019 -17.701 560 HB2 ASP 927 HB1 ASP 927 -2.987 -13.379 -16.172 561 HB3 ASP 927 HB2 ASP 927 -4.184 -13.043 -14.924 562 H ALA 928 HN ALA 928 -6.844 -11.543 -17.080 563 HA ALA 928 HA ALA 928 -8.765 -12.598 -15.147 564 HB1 ALA 928 HB1 ALA 928 -10.090 -10.609 -15.797 565 HB2 ALA 928 HB2 ALA 928 -8.427 -10.189 -15.350 566 HB3 ALA 928 HB3 ALA 928 -8.903 -10.237 -17.066 567 H1 ALA 1 HT1 ALA 1 -9.608 -2.924 -6.546 568 H2 ALA 1 HT2 ALA 1 -9.528 -1.415 -5.898 569 H3 ALA 1 HT3 ALA 1 -8.764 -2.675 -5.165 570 HA ALA 1 HA ALA 1 -7.145 -1.322 -6.265 571 HB1 ALA 1 HB1 ALA 1 -6.786 -3.781 -6.150 572 HB2 ALA 1 HB2 ALA 1 -7.605 -3.971 -7.704 573 HB3 ALA 1 HB3 ALA 1 -6.064 -3.081 -7.595 574 H ARG 2 HN ARG 2 -6.149 -1.059 -8.638 575 HA ARG 2 HA ARG 2 -7.561 0.890 -9.964 576 HB2 ARG 2 HB1 ARG 2 -5.923 0.797 -11.700 577 HB3 ARG 2 HB2 ARG 2 -5.107 0.321 -10.233 578 HG2 ARG 2 HG1 ARG 2 -4.422 -1.571 -11.262 579 HG3 ARG 2 HG2 ARG 2 -6.100 -2.104 -11.324 580 HD2 ARG 2 HD1 ARG 2 -6.034 -0.448 -13.507 581 HD3 ARG 2 HD2 ARG 2 -4.395 -1.100 -13.516 582 HE ARG 2 HE ARG 2 -6.850 -2.457 -14.178 583 HH11 ARG 2 HH11 ARG 2 -3.744 -3.294 -12.639 584 HH12 ARG 2 HH12 ARG 2 -4.108 -5.009 -12.842 585 HH21 ARG 2 HH21 ARG 2 -6.822 -4.620 -14.718 586 HH22 ARG 2 HH22 ARG 2 -5.701 -5.686 -13.836 587 H THR 3 HN THR 3 -8.479 1.134 -12.076 588 HA THR 3 HA THR 3 -9.781 -1.123 -13.377 589 HB THR 3 HB THR 3 -10.918 -0.904 -11.086 590 HG1 THR 3 HG1 THR 3 -12.162 -1.751 -12.691 591 HG21 THR 3 HG21 THR 3 -12.209 1.670 -12.001 592 HG22 THR 3 HG22 THR 3 -12.133 0.941 -10.389 593 HG23 THR 3 HG23 THR 3 -10.701 1.700 -11.061 594 H MLZ 4 HN MLZ 4 -12.168 0.395 -14.040 595 HA MLZ 4 HA MLZ 4 -11.329 2.664 -15.697 596 HB2 MLZ 4 HB1 MLZ 4 -11.648 1.595 -17.754 597 HB3 MLZ 4 HB2 MLZ 4 -10.814 0.358 -16.856 598 HG2 MLZ 4 HG1 MLZ 4 -13.807 0.523 -17.330 599 HG3 MLZ 4 HG2 MLZ 4 -12.677 -0.464 -18.238 600 HD2 MLZ 4 HD1 MLZ 4 -12.908 -0.998 -15.307 601 HD3 MLZ 4 HD2 MLZ 4 -14.269 -1.385 -16.356 602 HE2 MLZ 4 HE1 MLZ 4 -12.607 -2.643 -17.844 603 HE3 MLZ 4 HE2 MLZ 4 -11.452 -2.506 -16.498 604 HZ MLZ 4 HZ1 MLZ 4 -14.180 -3.654 -16.108 605 HCM1 MLZ 4 HC1 MLZ 4 -13.194 -5.823 -16.384 606 HCM2 MLZ 4 HC2 MLZ 4 -12.907 -4.872 -17.859 607 HCM3 MLZ 4 HC3 MLZ 4 -11.621 -5.054 -16.647 608 HZ2 MLZ 4 HZ2 MLZ 4 -12.913 -3.753 -15.088 609 H GLN 5 HN GLN 5 -13.371 3.451 -17.014 610 HA GLN 5 HA GLN 5 -15.797 3.296 -15.280 611 HB2 GLN 5 HB1 GLN 5 -15.904 5.745 -15.312 612 HB3 GLN 5 HB2 GLN 5 -14.625 5.071 -14.324 613 HG2 GLN 5 HG1 GLN 5 -13.992 6.061 -17.133 614 HG3 GLN 5 HG2 GLN 5 -14.238 7.188 -15.826 615 HE21 GLN 5 HE21 GLN 5 -11.874 7.666 -16.655 616 HE22 GLN 5 HE22 GLN 5 -10.625 6.740 -15.832 617 H THR 6 HN THR 6 -17.223 2.385 -16.653 618 HA THR 6 HA THR 6 -17.441 3.006 -19.444 619 HB THR 6 HB THR 6 -19.779 1.866 -19.076 620 HG1 THR 6 HG1 THR 6 -19.779 1.963 -16.822 621 HG21 THR 6 HG21 THR 6 -18.697 -0.358 -19.082 622 HG22 THR 6 HG22 THR 6 -17.954 0.771 -20.219 623 HG23 THR 6 HG23 THR 6 -17.144 0.422 -18.673 624 H ALA 7 HN ALA 7 -18.478 4.512 -20.506 625 HA ALA 7 HA ALA 7 -20.378 6.331 -19.090 626 HB1 ALA 7 HB1 ALA 7 -18.398 6.962 -21.312 627 HB2 ALA 7 HB2 ALA 7 -19.447 8.119 -20.463 628 HB3 ALA 7 HB3 ALA 7 -18.152 7.291 -19.581 629 H ARG 8 HN ARG 8 -20.884 3.839 -20.863 630 HA ARG 8 HA ARG 8 -23.054 5.043 -22.462 631 HB2 ARG 8 HB1 ARG 8 -20.735 4.535 -23.786 632 HB3 ARG 8 HB2 ARG 8 -21.366 2.903 -23.784 633 HG2 ARG 8 HG1 ARG 8 -22.275 3.642 -25.763 634 HG3 ARG 8 HG2 ARG 8 -23.588 4.140 -24.701 635 HD2 ARG 8 HD1 ARG 8 -21.354 5.845 -25.870 636 HD3 ARG 8 HD2 ARG 8 -23.078 5.940 -26.226 637 HE ARG 8 HE ARG 8 -21.950 6.573 -23.507 638 HH11 ARG 8 HH11 ARG 8 -23.914 7.735 -26.179 639 HH12 ARG 8 HH12 ARG 8 -24.422 9.136 -25.272 640 HH21 ARG 8 HH21 ARG 8 -22.625 8.257 -22.452 641 HH22 ARG 8 HH22 ARG 8 -23.692 9.442 -23.183 642 H TYR 9 HN TYR 9 -23.416 3.994 -20.178 643 HA TYR 9 HA TYR 9 -24.398 1.219 -20.287 644 HB2 TYR 9 HB1 TYR 9 -23.367 2.090 -18.242 645 HB3 TYR 9 HB2 TYR 9 -24.589 3.350 -18.132 646 HD1 TYR 9 HD1 TYR 9 -24.274 -0.397 -18.344 647 HD2 TYR 9 HD2 TYR 9 -26.476 2.963 -16.770 648 HE1 TYR 9 HE1 TYR 9 -25.702 -1.955 -17.024 649 HE2 TYR 9 HE2 TYR 9 -27.896 1.400 -15.435 650 HH TYR 9 HH TYR 9 -27.612 -2.136 -15.694 Start of MODEL 3 1 H1 GLY 850 HT1 GLY 850 -4.545 -11.174 -4.811 2 H2 GLY 850 HT2 GLY 850 -5.665 -11.851 -5.799 3 H3 GLY 850 HT3 GLY 850 -5.744 -10.255 -5.444 4 HA2 GLY 850 HA1 GLY 850 -3.544 -11.518 -6.964 5 HA3 GLY 850 HA2 GLY 850 -4.897 -10.632 -7.690 6 H SER 851 HN SER 851 -1.968 -10.330 -5.721 7 HA SER 851 HA SER 851 -2.315 -7.645 -4.952 8 HB2 SER 851 HB1 SER 851 0.291 -9.196 -5.164 9 HB3 SER 851 HB2 SER 851 -0.026 -7.808 -4.109 10 HG SER 851 HG1 SER 851 -1.461 -9.049 -2.919 11 H ARG 852 HN ARG 852 -1.559 -8.587 -7.999 12 HA ARG 852 HA ARG 852 0.109 -6.297 -8.853 13 HB2 ARG 852 HB1 ARG 852 -1.264 -8.519 -10.431 14 HB3 ARG 852 HB2 ARG 852 -0.213 -7.272 -11.123 15 HG2 ARG 852 HG1 ARG 852 1.679 -8.061 -9.742 16 HG3 ARG 852 HG2 ARG 852 0.655 -9.328 -9.039 17 HD2 ARG 852 HD1 ARG 852 0.290 -10.312 -11.262 18 HD3 ARG 852 HD2 ARG 852 1.257 -9.047 -12.012 19 HE ARG 852 HE ARG 852 2.202 -11.371 -10.461 20 HH11 ARG 852 HH11 ARG 852 3.215 -8.312 -11.851 21 HH12 ARG 852 HH12 ARG 852 4.900 -8.756 -11.813 22 HH21 ARG 852 HH21 ARG 852 4.361 -11.864 -10.444 23 HH22 ARG 852 HH22 ARG 852 5.524 -10.713 -11.036 24 H ARG 853 HN ARG 853 -1.880 -5.277 -7.539 25 HA ARG 853 HA ARG 853 -4.357 -4.801 -8.958 26 HB2 ARG 853 HB1 ARG 853 -3.231 -3.112 -6.702 27 HB3 ARG 853 HB2 ARG 853 -4.906 -3.260 -7.260 28 HG2 ARG 853 HG1 ARG 853 -4.791 -5.722 -6.630 29 HG3 ARG 853 HG2 ARG 853 -3.273 -5.358 -5.784 30 HD2 ARG 853 HD1 ARG 853 -5.961 -4.047 -5.333 31 HD3 ARG 853 HD2 ARG 853 -5.271 -5.303 -4.290 32 HE ARG 853 HE ARG 853 -3.340 -3.489 -4.050 33 HH11 ARG 853 HH11 ARG 853 -6.823 -2.933 -3.868 34 HH12 ARG 853 HH12 ARG 853 -6.604 -1.496 -2.898 35 HH21 ARG 853 HH21 ARG 853 -3.209 -1.664 -2.735 36 HH22 ARG 853 HH22 ARG 853 -4.677 -0.855 -2.255 37 H ALA 854 HN ALA 854 -1.447 -2.914 -8.699 38 HA ALA 854 HA ALA 854 -0.601 -1.088 -9.690 39 HB1 ALA 854 HB1 ALA 854 -0.845 -2.551 -11.661 40 HB2 ALA 854 HB2 ALA 854 -2.429 -1.823 -12.006 41 HB3 ALA 854 HB3 ALA 854 -0.955 -0.837 -12.088 42 H SER 855 HN SER 855 -0.931 1.029 -10.653 43 HA SER 855 HA SER 855 -1.820 3.197 -10.269 44 HB2 SER 855 HB1 SER 855 -2.862 3.636 -12.344 45 HB3 SER 855 HB2 SER 855 -1.608 2.420 -12.550 46 HG SER 855 HG1 SER 855 -3.147 0.841 -12.722 47 H VAL 856 HN VAL 856 -4.724 3.237 -11.553 48 HA VAL 856 HA VAL 856 -5.779 4.236 -8.936 49 HB VAL 856 HB VAL 856 -6.113 6.420 -9.969 50 HG11 VAL 856 HG11 VAL 856 -3.856 7.186 -9.948 51 HG12 VAL 856 HG12 VAL 856 -4.020 5.893 -8.749 52 HG13 VAL 856 HG13 VAL 856 -3.221 5.569 -10.303 53 HG21 VAL 856 HG21 VAL 856 -6.329 5.767 -12.354 54 HG22 VAL 856 HG22 VAL 856 -5.126 7.038 -12.105 55 HG23 VAL 856 HG23 VAL 856 -4.592 5.373 -12.392 56 H GLY 857 HN GLY 857 -7.785 5.341 -9.002 57 HA2 GLY 857 HA1 GLY 857 -9.800 4.793 -10.989 58 HA3 GLY 857 HA2 GLY 857 -10.078 3.968 -9.439 59 H SER 858 HN SER 858 -10.945 6.584 -11.023 60 HA SER 858 HA SER 858 -11.640 8.178 -8.627 61 HB2 SER 858 HB1 SER 858 -10.271 9.414 -11.052 62 HB3 SER 858 HB2 SER 858 -10.902 10.288 -9.652 63 HG SER 858 HG1 SER 858 -9.330 9.201 -8.366 64 H GLU 859 HN GLU 859 -13.535 9.446 -8.927 65 HA GLU 859 HA GLU 859 -15.237 8.587 -11.140 66 HB2 GLU 859 HB1 GLU 859 -17.026 9.657 -10.009 67 HB3 GLU 859 HB2 GLU 859 -16.068 8.766 -8.862 68 HG2 GLU 859 HG1 GLU 859 -16.567 10.642 -7.689 69 HG3 GLU 859 HG2 GLU 859 -14.929 10.968 -8.227 70 H PHE 860 HN PHE 860 -15.655 9.562 -12.968 71 HA PHE 860 HA PHE 860 -15.235 12.496 -13.308 72 HB2 PHE 860 HB1 PHE 860 -14.386 10.352 -15.291 73 HB3 PHE 860 HB2 PHE 860 -14.333 12.081 -15.558 74 HD1 PHE 860 HD1 PHE 860 -12.891 13.492 -13.830 75 HD2 PHE 860 HD2 PHE 860 -12.439 9.261 -14.523 76 HE1 PHE 860 HE1 PHE 860 -10.578 13.588 -12.924 77 HE2 PHE 860 HE2 PHE 860 -10.128 9.359 -13.624 78 HZ PHE 860 HZ PHE 860 -9.195 11.521 -12.819 79 H THR 861 HN THR 861 -16.640 9.539 -14.817 80 HA THR 861 HA THR 861 -19.229 10.905 -15.118 81 HB THR 861 HB THR 861 -19.283 9.793 -17.543 82 HG1 THR 861 HG1 THR 861 -17.375 10.176 -18.641 83 HG21 THR 861 HG21 THR 861 -19.827 12.111 -16.966 84 HG22 THR 861 HG22 THR 861 -18.101 12.543 -17.071 85 HG23 THR 861 HG23 THR 861 -18.970 11.969 -18.512 86 H GLU 862 HN GLU 862 -20.920 9.681 -15.001 87 HA GLU 862 HA GLU 862 -22.243 8.082 -14.347 88 HB2 GLU 862 HB1 GLU 862 -21.731 7.818 -16.800 89 HB3 GLU 862 HB2 GLU 862 -20.993 6.283 -16.311 90 HG2 GLU 862 HG1 GLU 862 -23.393 6.340 -17.037 91 HG3 GLU 862 HG2 GLU 862 -22.999 5.423 -15.582 92 H SER 863 HN SER 863 -22.794 6.032 -13.485 93 HA SER 863 HA SER 863 -21.237 4.816 -11.458 94 HB2 SER 863 HB1 SER 863 -23.448 3.637 -13.181 95 HB3 SER 863 HB2 SER 863 -22.797 2.912 -11.700 96 HG SER 863 HG1 SER 863 -24.277 5.309 -12.012 97 H ALA 864 HN ALA 864 -19.875 3.032 -11.402 98 HA ALA 864 HA ALA 864 -18.341 2.773 -13.965 99 HB1 ALA 864 HB1 ALA 864 -16.382 3.402 -12.540 100 HB2 ALA 864 HB2 ALA 864 -17.622 4.678 -12.558 101 HB3 ALA 864 HB3 ALA 864 -17.475 3.590 -11.162 102 H TRP 865 HN TRP 865 -16.248 1.288 -13.369 103 HA TRP 865 HA TRP 865 -17.233 -1.089 -11.836 104 HB2 TRP 865 HB1 TRP 865 -14.978 -0.782 -13.817 105 HB3 TRP 865 HB2 TRP 865 -15.487 -2.283 -13.059 106 HD1 TRP 865 HD1 TRP 865 -16.835 0.345 -15.537 107 HE1 TRP 865 HE1 TRP 865 -18.751 -0.648 -16.910 108 HE3 TRP 865 HE3 TRP 865 -17.091 -4.194 -13.252 109 HZ2 TRP 865 HZ2 TRP 865 -20.037 -3.261 -17.146 110 HZ3 TRP 865 HZ3 TRP 865 -18.642 -5.958 -14.089 111 HH2 TRP 865 HH2 TRP 865 -20.104 -5.489 -16.041 112 H VAL 866 HN VAL 866 -15.612 -2.321 -10.704 113 HA VAL 866 HA VAL 866 -13.151 -0.983 -9.770 114 HB VAL 866 HB VAL 866 -14.719 -0.339 -8.080 115 HG11 VAL 866 HG11 VAL 866 -15.240 -3.295 -7.547 116 HG12 VAL 866 HG12 VAL 866 -15.904 -1.901 -6.667 117 HG13 VAL 866 HG13 VAL 866 -16.376 -2.193 -8.338 118 HG21 VAL 866 HG21 VAL 866 -12.984 -2.527 -6.912 119 HG22 VAL 866 HG22 VAL 866 -12.410 -0.905 -7.376 120 HG23 VAL 866 HG23 VAL 866 -13.633 -1.095 -6.103 121 H ARG 867 HN ARG 867 -11.474 -2.427 -9.291 122 HA ARG 867 HA ARG 867 -11.873 -5.259 -10.097 123 HB2 ARG 867 HB1 ARG 867 -9.782 -3.474 -10.516 124 HB3 ARG 867 HB2 ARG 867 -9.187 -4.394 -9.156 125 HG2 ARG 867 HG1 ARG 867 -9.573 -6.503 -10.434 126 HG3 ARG 867 HG2 ARG 867 -10.139 -5.584 -11.828 127 HD2 ARG 867 HD1 ARG 867 -7.984 -5.789 -12.462 128 HD3 ARG 867 HD2 ARG 867 -7.809 -4.298 -11.533 129 HE ARG 867 HE ARG 867 -7.461 -6.626 -9.828 130 HH11 ARG 867 HH11 ARG 867 -5.620 -4.904 -12.273 131 HH12 ARG 867 HH12 ARG 867 -4.123 -5.629 -11.726 132 HH21 ARG 867 HH21 ARG 867 -5.507 -7.559 -9.295 133 HH22 ARG 867 HH22 ARG 867 -4.096 -7.107 -10.220 134 H CYS 868 HN CYS 868 -11.817 -6.966 -8.692 135 HA CYS 868 HA CYS 868 -11.805 -6.530 -5.825 136 HB2 CYS 868 HB1 CYS 868 -13.177 -8.246 -6.864 137 HB3 CYS 868 HB2 CYS 868 -11.745 -9.026 -7.547 138 H ASP 869 HN ASP 869 -10.093 -6.275 -4.574 139 HA ASP 869 HA ASP 869 -7.367 -6.725 -5.237 140 HB2 ASP 869 HB1 ASP 869 -8.687 -6.735 -2.494 141 HB3 ASP 869 HB2 ASP 869 -6.972 -6.519 -2.812 142 H ASP 870 HN ASP 870 -9.749 -9.062 -4.096 143 HA ASP 870 HA ASP 870 -7.710 -10.802 -2.859 144 HB2 ASP 870 HB1 ASP 870 -9.926 -10.359 -1.801 145 HB3 ASP 870 HB2 ASP 870 -10.704 -11.249 -3.107 146 H CYS 871 HN CYS 871 -10.166 -11.115 -5.479 147 HA CYS 871 HA CYS 871 -8.429 -13.143 -6.764 148 HB2 CYS 871 HB1 CYS 871 -10.203 -13.837 -8.082 149 HB3 CYS 871 HB2 CYS 871 -10.722 -13.823 -6.412 150 H PHE 872 HN PHE 872 -10.374 -11.101 -8.596 151 HA PHE 872 HA PHE 872 -8.713 -9.000 -9.439 152 HB2 PHE 872 HB1 PHE 872 -7.801 -9.657 -11.528 153 HB3 PHE 872 HB2 PHE 872 -7.198 -10.768 -10.328 154 HD1 PHE 872 HD1 PHE 872 -8.212 -13.129 -10.171 155 HD2 PHE 872 HD2 PHE 872 -8.992 -10.448 -13.460 156 HE1 PHE 872 HE1 PHE 872 -9.008 -15.039 -11.540 157 HE2 PHE 872 HE2 PHE 872 -9.773 -12.368 -14.832 158 HZ PHE 872 HZ PHE 872 -9.793 -14.661 -13.871 159 H LYS 873 HN LYS 873 -11.448 -10.935 -9.893 160 HA LYS 873 HA LYS 873 -12.845 -10.266 -12.112 161 HB2 LYS 873 HB1 LYS 873 -13.493 -11.593 -10.084 162 HB3 LYS 873 HB2 LYS 873 -14.085 -10.065 -9.378 163 HG2 LYS 873 HG1 LYS 873 -15.832 -9.917 -10.948 164 HG3 LYS 873 HG2 LYS 873 -14.946 -10.884 -12.144 165 HD2 LYS 873 HD1 LYS 873 -16.737 -12.249 -11.323 166 HD3 LYS 873 HD2 LYS 873 -15.185 -12.867 -10.743 167 HE2 LYS 873 HE1 LYS 873 -15.642 -11.456 -8.595 168 HE3 LYS 873 HE2 LYS 873 -17.293 -11.268 -9.203 169 HZ1 LYS 873 HZ1 LYS 873 -17.143 -13.137 -7.695 170 HZ2 LYS 873 HZ2 LYS 873 -17.452 -13.720 -9.203 171 HZ3 LYS 873 HZ3 LYS 873 -15.950 -13.844 -8.576 172 H TRP 874 HN TRP 874 -14.260 -8.651 -12.800 173 HA TRP 874 HA TRP 874 -14.033 -5.980 -11.522 174 HB2 TRP 874 HB1 TRP 874 -15.234 -6.694 -14.212 175 HB3 TRP 874 HB2 TRP 874 -14.996 -5.076 -13.571 176 HD1 TRP 874 HD1 TRP 874 -13.177 -7.753 -15.441 177 HE1 TRP 874 HE1 TRP 874 -10.665 -7.117 -15.776 178 HE3 TRP 874 HE3 TRP 874 -12.969 -3.578 -12.512 179 HZ2 TRP 874 HZ2 TRP 874 -8.912 -5.135 -14.956 180 HZ3 TRP 874 HZ3 TRP 874 -10.798 -2.394 -12.229 181 HH2 TRP 874 HH2 TRP 874 -8.810 -3.035 -13.513 182 H ARG 875 HN ARG 875 -15.812 -4.806 -10.898 183 HA ARG 875 HA ARG 875 -18.497 -6.040 -11.043 184 HB2 ARG 875 HB1 ARG 875 -16.912 -5.486 -8.537 185 HB3 ARG 875 HB2 ARG 875 -18.590 -4.992 -8.506 186 HG2 ARG 875 HG1 ARG 875 -17.547 -7.806 -8.986 187 HG3 ARG 875 HG2 ARG 875 -18.406 -7.214 -7.574 188 HD2 ARG 875 HD1 ARG 875 -19.486 -7.739 -10.340 189 HD3 ARG 875 HD2 ARG 875 -19.980 -8.452 -8.808 190 HE ARG 875 HE ARG 875 -20.584 -5.774 -8.442 191 HH11 ARG 875 HH11 ARG 875 -21.721 -8.154 -10.714 192 HH12 ARG 875 HH12 ARG 875 -23.030 -7.151 -11.253 193 HH21 ARG 875 HH21 ARG 875 -22.226 -4.480 -9.256 194 HH22 ARG 875 HH22 ARG 875 -23.354 -5.178 -10.371 195 H ARG 876 HN ARG 876 -20.078 -4.696 -11.417 196 HA ARG 876 HA ARG 876 -19.504 -1.886 -11.913 197 HB2 ARG 876 HB1 ARG 876 -21.040 -3.366 -13.340 198 HB3 ARG 876 HB2 ARG 876 -22.201 -3.294 -12.002 199 HG2 ARG 876 HG1 ARG 876 -22.900 -1.566 -13.448 200 HG3 ARG 876 HG2 ARG 876 -21.974 -0.682 -12.235 201 HD2 ARG 876 HD1 ARG 876 -19.949 -0.876 -13.760 202 HD3 ARG 876 HD2 ARG 876 -20.986 -1.645 -14.953 203 HE ARG 876 HE ARG 876 -20.878 1.197 -14.245 204 HH11 ARG 876 HH11 ARG 876 -22.819 -1.252 -15.952 205 HH12 ARG 876 HH12 ARG 876 -23.369 -0.023 -17.087 206 HH21 ARG 876 HH21 ARG 876 -21.722 2.601 -15.676 207 HH22 ARG 876 HH22 ARG 876 -22.843 2.004 -16.907 208 H ILE 877 HN ILE 877 -19.826 -0.269 -10.649 209 HA ILE 877 HA ILE 877 -21.445 -0.442 -8.137 210 HB ILE 877 HB ILE 877 -19.628 0.787 -7.001 211 HG12 ILE 877 HG11 ILE 877 -17.994 0.356 -9.537 212 HG13 ILE 877 HG12 ILE 877 -18.653 1.898 -9.032 213 HG21 ILE 877 HG21 ILE 877 -18.194 -1.124 -6.660 214 HG22 ILE 877 HG22 ILE 877 -19.821 -1.723 -6.979 215 HG23 ILE 877 HG23 ILE 877 -18.600 -1.782 -8.263 216 HD11 ILE 877 HD1 ILE 877 -16.687 0.382 -7.304 217 HD12 ILE 877 HD2 ILE 877 -16.241 1.603 -8.510 218 HD13 ILE 877 HD3 ILE 877 -17.254 2.048 -7.140 219 HA PRO 878 HA PRO 878 -22.693 3.762 -9.293 220 HB2 PRO 878 HB1 PRO 878 -23.157 4.951 -6.871 221 HB3 PRO 878 HB2 PRO 878 -24.255 3.721 -7.569 222 HG2 PRO 878 HG1 PRO 878 -22.041 3.300 -5.535 223 HG3 PRO 878 HG2 PRO 878 -23.737 2.726 -5.451 224 HD2 PRO 878 HD1 PRO 878 -21.721 1.120 -6.319 225 HD3 PRO 878 HD2 PRO 878 -23.344 1.043 -7.062 226 H ALA 879 HN ALA 879 -21.662 5.739 -9.573 227 HA ALA 879 HA ALA 879 -18.876 5.875 -9.326 228 HB1 ALA 879 HB1 ALA 879 -19.168 8.186 -10.083 229 HB2 ALA 879 HB2 ALA 879 -20.389 7.171 -10.880 230 HB3 ALA 879 HB3 ALA 879 -20.852 8.201 -9.513 231 H SER 880 HN SER 880 -21.177 6.677 -6.826 232 HA SER 880 HA SER 880 -19.513 8.379 -5.189 233 HB2 SER 880 HB1 SER 880 -21.747 6.463 -4.398 234 HB3 SER 880 HB2 SER 880 -20.992 7.660 -3.333 235 HG SER 880 HG1 SER 880 -22.529 8.152 -5.686 236 H VAL 881 HN VAL 881 -19.452 4.912 -5.797 237 HA VAL 881 HA VAL 881 -17.580 4.431 -3.539 238 HB VAL 881 HB VAL 881 -18.762 2.549 -5.606 239 HG11 VAL 881 HG11 VAL 881 -17.059 1.801 -3.196 240 HG12 VAL 881 HG12 VAL 881 -17.821 0.691 -4.353 241 HG13 VAL 881 HG13 VAL 881 -16.495 1.727 -4.882 242 HG21 VAL 881 HG21 VAL 881 -19.973 1.579 -3.703 243 HG22 VAL 881 HG22 VAL 881 -19.246 2.778 -2.610 244 HG23 VAL 881 HG23 VAL 881 -20.369 3.292 -3.882 245 H VAL 882 HN VAL 882 -17.594 4.741 -7.090 246 HA VAL 882 HA VAL 882 -14.816 4.015 -7.191 247 HB VAL 882 HB VAL 882 -16.613 4.053 -9.109 248 HG11 VAL 882 HG11 VAL 882 -15.052 6.571 -9.799 249 HG12 VAL 882 HG12 VAL 882 -16.268 5.768 -10.791 250 HG13 VAL 882 HG13 VAL 882 -16.749 6.558 -9.285 251 HG21 VAL 882 HG21 VAL 882 -13.644 4.562 -9.606 252 HG22 VAL 882 HG22 VAL 882 -14.375 2.996 -9.206 253 HG23 VAL 882 HG23 VAL 882 -14.773 3.787 -10.733 254 H GLY 883 HN GLY 883 -16.361 6.925 -6.378 255 HA2 GLY 883 HA1 GLY 883 -13.955 8.632 -6.537 256 HA3 GLY 883 HA2 GLY 883 -15.511 9.034 -5.794 257 H SER 884 HN SER 884 -15.254 6.336 -4.267 258 HA SER 884 HA SER 884 -13.749 7.390 -1.947 259 HB2 SER 884 HB1 SER 884 -16.028 6.524 -1.633 260 HB3 SER 884 HB2 SER 884 -15.520 4.940 -2.246 261 HG SER 884 HG1 SER 884 -15.506 5.109 0.077 262 H ILE 885 HN ILE 885 -13.763 4.539 -4.092 263 HA ILE 885 HA ILE 885 -11.363 3.350 -2.895 264 HB ILE 885 HB ILE 885 -13.189 2.616 -5.186 265 HG12 ILE 885 HG11 ILE 885 -13.570 0.554 -4.039 266 HG13 ILE 885 HG12 ILE 885 -12.335 0.849 -2.822 267 HG21 ILE 885 HG21 ILE 885 -11.840 0.560 -5.543 268 HG22 ILE 885 HG22 ILE 885 -11.021 2.023 -6.076 269 HG23 ILE 885 HG23 ILE 885 -10.548 1.252 -4.538 270 HD11 ILE 885 HD1 ILE 885 -14.773 1.187 -2.094 271 HD12 ILE 885 HD2 ILE 885 -13.743 2.608 -1.822 272 HD13 ILE 885 HD3 ILE 885 -14.850 2.543 -3.217 273 H ASP 886 HN ASP 886 -9.359 4.137 -3.328 274 HA ASP 886 HA ASP 886 -8.873 5.491 -5.948 275 HB2 ASP 886 HB1 ASP 886 -7.749 7.191 -4.937 276 HB3 ASP 886 HB2 ASP 886 -9.078 6.854 -3.836 277 H GLU 887 HN GLU 887 -6.196 6.064 -5.534 278 HA GLU 887 HA GLU 887 -4.728 3.969 -6.664 279 HB2 GLU 887 HB1 GLU 887 -4.107 6.379 -6.516 280 HB3 GLU 887 HB2 GLU 887 -3.790 6.178 -4.790 281 HG2 GLU 887 HG1 GLU 887 -1.940 4.661 -5.243 282 HG3 GLU 887 HG2 GLU 887 -2.369 4.577 -6.955 283 H SER 888 HN SER 888 -5.659 4.406 -3.256 284 HA SER 888 HA SER 888 -3.920 2.049 -2.538 285 HB2 SER 888 HB1 SER 888 -3.015 3.105 -0.621 286 HB3 SER 888 HB2 SER 888 -2.698 4.114 -2.037 287 HG SER 888 HG1 SER 888 -3.412 5.353 -0.250 288 H SER 889 HN SER 889 -7.050 3.356 -2.174 289 HA SER 889 HA SER 889 -8.012 2.125 0.150 290 HB2 SER 889 HB1 SER 889 -9.330 2.251 -2.589 291 HB3 SER 889 HB2 SER 889 -10.183 1.989 -1.059 292 HG SER 889 HG1 SER 889 -9.551 4.054 -0.390 293 H ARG 890 HN ARG 890 -9.637 0.237 0.139 294 HA ARG 890 HA ARG 890 -8.660 -2.089 -1.381 295 HB2 ARG 890 HB1 ARG 890 -9.228 -2.031 1.602 296 HB3 ARG 890 HB2 ARG 890 -9.026 -3.504 0.647 297 HG2 ARG 890 HG1 ARG 890 -6.738 -2.743 -0.024 298 HG3 ARG 890 HG2 ARG 890 -6.901 -1.343 1.045 299 HD2 ARG 890 HD1 ARG 890 -7.064 -4.256 1.924 300 HD3 ARG 890 HD2 ARG 890 -5.620 -3.236 2.043 301 HE ARG 890 HE ARG 890 -7.642 -1.820 3.367 302 HH11 ARG 890 HH11 ARG 890 -6.020 -4.883 3.869 303 HH12 ARG 890 HH12 ARG 890 -6.276 -4.842 5.593 304 HH21 ARG 890 HH21 ARG 890 -7.944 -1.833 5.570 305 HH22 ARG 890 HH22 ARG 890 -7.334 -3.153 6.523 306 H TRP 891 HN TRP 891 -10.099 -3.180 -2.330 307 HA TRP 891 HA TRP 891 -12.946 -3.287 -1.471 308 HB2 TRP 891 HB1 TRP 891 -12.451 -1.469 -3.217 309 HB3 TRP 891 HB2 TRP 891 -12.167 -2.776 -4.350 310 HD1 TRP 891 HD1 TRP 891 -14.776 -0.816 -2.616 311 HE1 TRP 891 HE1 TRP 891 -17.099 -1.335 -3.489 312 HE3 TRP 891 HE3 TRP 891 -13.658 -5.085 -5.199 313 HZ2 TRP 891 HZ2 TRP 891 -18.396 -3.547 -4.899 314 HZ3 TRP 891 HZ3 TRP 891 -15.485 -6.434 -6.222 315 HH2 TRP 891 HH2 TRP 891 -17.841 -5.673 -6.061 316 H ILE 892 HN ILE 892 -13.847 -5.308 -1.667 317 HA ILE 892 HA ILE 892 -12.775 -7.244 -3.640 318 HB ILE 892 HB ILE 892 -12.757 -9.041 -2.006 319 HG12 ILE 892 HG11 ILE 892 -13.112 -7.006 0.220 320 HG13 ILE 892 HG12 ILE 892 -14.449 -7.955 -0.433 321 HG21 ILE 892 HG21 ILE 892 -10.967 -6.761 -1.070 322 HG22 ILE 892 HG22 ILE 892 -10.685 -8.486 -0.834 323 HG23 ILE 892 HG23 ILE 892 -10.677 -7.819 -2.470 324 HD11 ILE 892 HD1 ILE 892 -13.560 -8.994 1.583 325 HD12 ILE 892 HD2 ILE 892 -13.461 -10.038 0.143 326 HD13 ILE 892 HD3 ILE 892 -11.998 -9.239 0.795 327 H CYS 893 HN CYS 893 -14.198 -9.088 -4.051 328 HA CYS 893 HA CYS 893 -16.859 -8.554 -4.452 329 HB2 CYS 893 HB1 CYS 893 -15.653 -11.287 -3.860 330 HB3 CYS 893 HB2 CYS 893 -17.194 -10.937 -4.661 331 H MET 894 HN MET 894 -15.518 -9.979 -1.359 332 HA MET 894 HA MET 894 -18.088 -10.713 -0.334 333 HB2 MET 894 HB1 MET 894 -15.879 -11.545 0.487 334 HB3 MET 894 HB2 MET 894 -15.594 -9.962 1.211 335 HG2 MET 894 HG1 MET 894 -16.313 -11.524 2.898 336 HG3 MET 894 HG2 MET 894 -17.480 -10.229 2.717 337 HE1 MET 894 HE1 MET 894 -16.649 -14.003 2.196 338 HE2 MET 894 HE2 MET 894 -18.111 -14.647 1.421 339 HE3 MET 894 HE3 MET 894 -17.023 -13.587 0.506 340 H ASN 895 HN ASN 895 -16.528 -7.607 -0.502 341 HA ASN 895 HA ASN 895 -18.326 -6.293 1.436 342 HB2 ASN 895 HB1 ASN 895 -16.546 -5.007 1.734 343 HB3 ASN 895 HB2 ASN 895 -15.657 -5.910 0.520 344 HD21 ASN 895 HD21 ASN 895 -16.184 -5.189 -1.864 345 HD22 ASN 895 HD22 ASN 895 -16.225 -3.441 -2.059 346 H ASN 896 HN ASN 896 -18.477 -7.100 -1.829 347 HA ASN 896 HA ASN 896 -19.361 -4.861 -3.183 348 HB2 ASN 896 HB1 ASN 896 -18.800 -7.040 -4.213 349 HB3 ASN 896 HB2 ASN 896 -20.283 -7.730 -3.540 350 HD21 ASN 896 HD21 ASN 896 -20.424 -8.359 -5.887 351 HD22 ASN 896 HD22 ASN 896 -21.415 -7.244 -6.818 352 H SER 897 HN SER 897 -21.090 -3.706 -3.419 353 HA SER 897 HA SER 897 -23.300 -3.480 -1.700 354 HB2 SER 897 HB1 SER 897 -22.882 -2.728 -4.622 355 HB3 SER 897 HB2 SER 897 -24.300 -2.256 -3.694 356 HG SER 897 HG1 SER 897 -22.690 -0.626 -3.603 357 H ASP 898 HN ASP 898 -23.067 -5.238 -4.764 358 HA ASP 898 HA ASP 898 -25.896 -6.128 -4.573 359 HB2 ASP 898 HB1 ASP 898 -23.852 -6.490 -6.765 360 HB3 ASP 898 HB2 ASP 898 -25.470 -7.171 -6.799 361 H LYS 899 HN LYS 899 -26.159 -7.607 -3.197 362 HA LYS 899 HA LYS 899 -24.533 -9.813 -2.467 363 HB2 LYS 899 HB1 LYS 899 -27.566 -9.514 -2.353 364 HB3 LYS 899 HB2 LYS 899 -26.630 -10.739 -1.502 365 HG2 LYS 899 HG1 LYS 899 -26.027 -7.793 -1.068 366 HG3 LYS 899 HG2 LYS 899 -27.364 -8.577 -0.230 367 HD2 LYS 899 HD1 LYS 899 -24.628 -9.823 -0.183 368 HD3 LYS 899 HD2 LYS 899 -25.047 -8.519 0.946 369 HE2 LYS 899 HE1 LYS 899 -26.854 -10.920 0.591 370 HE3 LYS 899 HE2 LYS 899 -25.420 -11.047 1.628 371 HZ1 LYS 899 HZ1 LYS 899 -26.287 -9.199 2.950 372 HZ2 LYS 899 HZ2 LYS 899 -27.615 -9.074 2.004 373 HZ3 LYS 899 HZ3 LYS 899 -27.377 -10.409 2.910 374 H ARG 900 HN ARG 900 -26.284 -9.374 -5.322 375 HA ARG 900 HA ARG 900 -26.708 -12.117 -6.220 376 HB2 ARG 900 HB1 ARG 900 -26.495 -9.396 -7.590 377 HB3 ARG 900 HB2 ARG 900 -26.657 -10.887 -8.497 378 HG2 ARG 900 HG1 ARG 900 -28.811 -9.855 -8.313 379 HG3 ARG 900 HG2 ARG 900 -28.801 -11.383 -7.445 380 HD2 ARG 900 HD1 ARG 900 -30.085 -9.726 -6.243 381 HD3 ARG 900 HD2 ARG 900 -28.678 -10.199 -5.294 382 HE ARG 900 HE ARG 900 -28.158 -7.816 -6.892 383 HH11 ARG 900 HH11 ARG 900 -29.943 -8.752 -4.031 384 HH12 ARG 900 HH12 ARG 900 -29.879 -7.151 -3.352 385 HH21 ARG 900 HH21 ARG 900 -28.048 -5.775 -5.924 386 HH22 ARG 900 HH22 ARG 900 -28.878 -5.528 -4.415 387 H PHE 901 HN PHE 901 -23.929 -10.006 -6.082 388 HA PHE 901 HA PHE 901 -22.243 -12.053 -7.421 389 HB2 PHE 901 HB1 PHE 901 -21.991 -9.083 -7.957 390 HB3 PHE 901 HB2 PHE 901 -21.197 -10.398 -8.811 391 HD1 PHE 901 HD1 PHE 901 -24.284 -8.419 -8.429 392 HD2 PHE 901 HD2 PHE 901 -22.356 -11.564 -10.635 393 HE1 PHE 901 HE1 PHE 901 -25.996 -8.212 -10.219 394 HE2 PHE 901 HE2 PHE 901 -24.055 -11.357 -12.431 395 HZ PHE 901 HZ PHE 901 -25.880 -9.679 -12.224 396 H ALA 902 HN ALA 902 -22.568 -11.136 -4.548 397 HA ALA 902 HA ALA 902 -20.055 -9.780 -3.959 398 HB1 ALA 902 HB1 ALA 902 -22.176 -8.942 -2.973 399 HB2 ALA 902 HB2 ALA 902 -22.393 -10.510 -2.142 400 HB3 ALA 902 HB3 ALA 902 -21.036 -9.445 -1.724 401 H ASP 903 HN ASP 903 -19.525 -12.222 -4.933 402 HA ASP 903 HA ASP 903 -17.831 -13.290 -2.787 403 HB2 ASP 903 HB1 ASP 903 -19.643 -15.097 -4.380 404 HB3 ASP 903 HB2 ASP 903 -18.341 -15.628 -3.329 405 H CYS 904 HN CYS 904 -15.869 -14.070 -3.558 406 HA CYS 904 HA CYS 904 -14.996 -13.527 -6.181 407 HB2 CYS 904 HB1 CYS 904 -13.973 -15.484 -4.074 408 HB3 CYS 904 HB2 CYS 904 -13.089 -14.986 -5.521 409 H SER 905 HN SER 905 -16.925 -16.157 -4.993 410 HA SER 905 HA SER 905 -16.393 -18.043 -7.205 411 HB2 SER 905 HB1 SER 905 -18.443 -18.146 -4.967 412 HB3 SER 905 HB2 SER 905 -18.009 -19.463 -6.069 413 HG SER 905 HG1 SER 905 -15.946 -19.517 -5.155 414 H LYS 906 HN LYS 906 -18.607 -15.430 -6.566 415 HA LYS 906 HA LYS 906 -20.803 -16.386 -8.247 416 HB2 LYS 906 HB1 LYS 906 -20.045 -13.826 -6.835 417 HB3 LYS 906 HB2 LYS 906 -21.303 -13.776 -8.049 418 HG2 LYS 906 HG1 LYS 906 -21.382 -15.493 -5.544 419 HG3 LYS 906 HG2 LYS 906 -22.158 -13.920 -5.784 420 HD2 LYS 906 HD1 LYS 906 -23.959 -15.194 -6.223 421 HD3 LYS 906 HD2 LYS 906 -23.297 -15.199 -7.859 422 HE2 LYS 906 HE1 LYS 906 -22.205 -17.414 -7.359 423 HE3 LYS 906 HE2 LYS 906 -22.852 -17.343 -5.719 424 HZ1 LYS 906 HZ1 LYS 906 -25.095 -17.390 -6.666 425 HZ2 LYS 906 HZ2 LYS 906 -24.506 -17.446 -8.190 426 HZ3 LYS 906 HZ3 LYS 906 -24.255 -18.693 -7.168 427 H SER 907 HN SER 907 -21.625 -14.678 -9.882 428 HA SER 907 HA SER 907 -19.708 -14.683 -12.128 429 HB2 SER 907 HB1 SER 907 -22.042 -15.543 -12.331 430 HB3 SER 907 HB2 SER 907 -22.639 -13.892 -12.084 431 HG SER 907 HG1 SER 907 -22.398 -14.561 -14.327 432 H GLN 908 HN GLN 908 -20.723 -12.459 -13.533 433 HA GLN 908 HA GLN 908 -20.514 -10.029 -11.934 434 HB2 GLN 908 HB1 GLN 908 -18.600 -9.074 -13.016 435 HB3 GLN 908 HB2 GLN 908 -18.126 -10.636 -12.359 436 HG2 GLN 908 HG1 GLN 908 -18.740 -11.481 -14.836 437 HG3 GLN 908 HG2 GLN 908 -18.549 -9.794 -15.211 438 HE21 GLN 908 HE21 GLN 908 -16.406 -9.109 -15.654 439 HE22 GLN 908 HE22 GLN 908 -14.986 -10.092 -15.292 440 H GLU 909 HN GLU 909 -20.974 -8.066 -13.270 441 HA GLU 909 HA GLU 909 -23.220 -8.456 -14.977 442 HB2 GLU 909 HB1 GLU 909 -23.050 -6.523 -13.636 443 HB3 GLU 909 HB2 GLU 909 -21.504 -6.046 -14.318 444 HG2 GLU 909 HG1 GLU 909 -22.541 -5.487 -16.459 445 HG3 GLU 909 HG2 GLU 909 -24.094 -6.120 -15.915 446 H MET 910 HN MET 910 -19.814 -8.158 -15.858 447 HA MET 910 HA MET 910 -20.375 -9.011 -18.602 448 HB2 MET 910 HB1 MET 910 -18.919 -6.390 -18.095 449 HB3 MET 910 HB2 MET 910 -18.953 -7.260 -19.626 450 HG2 MET 910 HG1 MET 910 -21.395 -6.860 -19.781 451 HG3 MET 910 HG2 MET 910 -21.328 -5.974 -18.249 452 HE1 MET 910 HE1 MET 910 -22.373 -3.784 -19.086 453 HE2 MET 910 HE2 MET 910 -21.932 -2.987 -20.612 454 HE3 MET 910 HE3 MET 910 -22.681 -4.599 -20.636 455 H SER 911 HN SER 911 -18.735 -10.364 -19.241 456 HA SER 911 HA SER 911 -16.596 -11.099 -17.471 457 HB2 SER 911 HB1 SER 911 -16.483 -11.634 -20.415 458 HB3 SER 911 HB2 SER 911 -15.924 -12.643 -19.090 459 HG SER 911 HG1 SER 911 -18.043 -13.174 -18.577 460 H ASN 912 HN ASN 912 -14.242 -10.999 -17.986 461 HA ASN 912 HA ASN 912 -13.561 -8.232 -18.194 462 HB2 ASN 912 HB1 ASN 912 -11.580 -10.546 -18.365 463 HB3 ASN 912 HB2 ASN 912 -11.251 -8.870 -17.928 464 HD21 ASN 912 HD21 ASN 912 -10.188 -9.748 -16.038 465 HD22 ASN 912 HD22 ASN 912 -11.201 -10.154 -14.650 466 H GLU 913 HN GLU 913 -13.517 -10.707 -20.662 467 HA GLU 913 HA GLU 913 -12.191 -9.095 -22.685 468 HB2 GLU 913 HB1 GLU 913 -12.775 -10.882 -24.194 469 HB3 GLU 913 HB2 GLU 913 -12.182 -11.575 -22.684 470 HG2 GLU 913 HG1 GLU 913 -14.570 -11.933 -21.961 471 HG3 GLU 913 HG2 GLU 913 -15.102 -11.370 -23.543 472 H GLU 914 HN GLU 914 -15.268 -8.808 -21.349 473 HA GLU 914 HA GLU 914 -16.352 -7.344 -23.727 474 HB2 GLU 914 HB1 GLU 914 -17.783 -8.354 -21.243 475 HB3 GLU 914 HB2 GLU 914 -18.522 -7.448 -22.551 476 HG2 GLU 914 HG1 GLU 914 -17.331 -10.250 -22.695 477 HG3 GLU 914 HG2 GLU 914 -19.035 -9.834 -22.691 478 H ILE 915 HN ILE 915 -15.832 -7.083 -20.144 479 HA ILE 915 HA ILE 915 -16.380 -4.286 -20.268 480 HB ILE 915 HB ILE 915 -17.000 -5.546 -18.412 481 HG12 ILE 915 HG11 ILE 915 -16.667 -3.949 -16.748 482 HG13 ILE 915 HG12 ILE 915 -15.075 -3.507 -17.281 483 HG21 ILE 915 HG21 ILE 915 -15.324 -6.009 -16.533 484 HG22 ILE 915 HG22 ILE 915 -15.368 -7.117 -17.880 485 HG23 ILE 915 HG23 ILE 915 -14.062 -5.915 -17.789 486 HD11 ILE 915 HD1 ILE 915 -16.557 -1.720 -17.897 487 HD12 ILE 915 HD2 ILE 915 -16.069 -2.490 -19.386 488 HD13 ILE 915 HD3 ILE 915 -17.676 -2.847 -18.725 489 H ASN 916 HN ASN 916 -13.858 -5.642 -21.376 490 HA ASN 916 HA ASN 916 -12.275 -3.106 -21.056 491 HB2 ASN 916 HB1 ASN 916 -10.351 -4.147 -22.156 492 HB3 ASN 916 HB2 ASN 916 -10.833 -5.009 -20.707 493 HD21 ASN 916 HD21 ASN 916 -9.296 -6.610 -21.885 494 HD22 ASN 916 HD22 ASN 916 -10.126 -7.772 -22.900 495 H GLU 917 HN GLU 917 -13.845 -5.083 -23.533 496 HA GLU 917 HA GLU 917 -13.486 -3.308 -25.732 497 HB2 GLU 917 HB1 GLU 917 -15.380 -5.513 -25.025 498 HB3 GLU 917 HB2 GLU 917 -15.727 -4.537 -26.427 499 HG2 GLU 917 HG1 GLU 917 -13.156 -6.103 -25.913 500 HG3 GLU 917 HG2 GLU 917 -14.470 -6.619 -26.964 501 H GLU 918 HN GLU 918 -16.030 -3.353 -23.238 502 HA GLU 918 HA GLU 918 -17.826 -1.608 -24.503 503 HB2 GLU 918 HB1 GLU 918 -18.079 -2.997 -22.292 504 HB3 GLU 918 HB2 GLU 918 -17.418 -1.572 -21.494 505 HG2 GLU 918 HG1 GLU 918 -19.883 -1.591 -21.418 506 HG3 GLU 918 HG2 GLU 918 -19.292 -0.199 -22.295 507 H LEU 919 HN LEU 919 -14.949 -0.761 -22.648 508 HA LEU 919 HA LEU 919 -15.482 2.140 -22.994 509 HB2 LEU 919 HB1 LEU 919 -13.087 0.918 -21.602 510 HB3 LEU 919 HB2 LEU 919 -13.671 2.567 -21.539 511 HG LEU 919 HG LEU 919 -15.882 1.151 -20.624 512 HD11 LEU 919 HD11 LEU 919 -13.377 -0.179 -19.532 513 HD12 LEU 919 HD12 LEU 919 -15.048 -0.418 -18.966 514 HD13 LEU 919 HD13 LEU 919 -14.581 -0.942 -20.584 515 HD21 LEU 919 HD21 LEU 919 -15.159 1.866 -18.359 516 HD22 LEU 919 HD22 LEU 919 -13.592 2.385 -19.067 517 HD23 LEU 919 HD23 LEU 919 -15.094 3.160 -19.588 518 H GLY 920 HN GLY 920 -13.450 -0.456 -24.204 519 HA2 GLY 920 HA1 GLY 920 -12.454 -0.499 -26.355 520 HA3 GLY 920 HA2 GLY 920 -12.427 1.266 -26.414 521 H ILE 921 HN ILE 921 -11.315 -0.777 -23.737 522 HA ILE 921 HA ILE 921 -8.581 0.401 -23.932 523 HB ILE 921 HB ILE 921 -8.427 0.046 -21.522 524 HG12 ILE 921 HG11 ILE 921 -11.375 -0.732 -21.599 525 HG13 ILE 921 HG12 ILE 921 -10.030 -1.861 -21.377 526 HG21 ILE 921 HG21 ILE 921 -9.818 1.927 -20.864 527 HG22 ILE 921 HG22 ILE 921 -9.192 2.206 -22.490 528 HG23 ILE 921 HG23 ILE 921 -10.877 1.697 -22.271 529 HD11 ILE 921 HD1 ILE 921 -10.977 -1.367 -19.221 530 HD12 ILE 921 HD2 ILE 921 -9.353 -0.646 -19.313 531 HD13 ILE 921 HD3 ILE 921 -10.804 0.377 -19.472 532 H GLY 922 HN GLY 922 -6.890 -0.932 -22.885 533 HA2 GLY 922 HA1 GLY 922 -6.860 -3.582 -24.228 534 HA3 GLY 922 HA2 GLY 922 -5.454 -2.595 -23.820 535 H GLN 923 HN GLN 923 -8.026 -3.307 -21.529 536 HA GLN 923 HA GLN 923 -6.140 -4.067 -19.535 537 HB2 GLN 923 HB1 GLN 923 -8.641 -3.115 -19.399 538 HB3 GLN 923 HB2 GLN 923 -9.019 -4.818 -19.190 539 HG2 GLN 923 HG1 GLN 923 -8.619 -4.516 -17.020 540 HG3 GLN 923 HG2 GLN 923 -6.905 -4.440 -17.385 541 HE21 GLN 923 HE21 GLN 923 -9.528 -2.674 -16.097 542 HE22 GLN 923 HE22 GLN 923 -8.798 -1.069 -16.192 543 H ASP 924 HN ASP 924 -6.157 -5.934 -18.247 544 HA ASP 924 HA ASP 924 -5.746 -8.077 -17.747 545 HB2 ASP 924 HB1 ASP 924 -7.971 -8.659 -19.707 546 HB3 ASP 924 HB2 ASP 924 -7.115 -9.877 -18.803 547 H GLU 925 HN GLU 925 -5.073 -6.973 -20.710 548 HA GLU 925 HA GLU 925 -3.412 -7.109 -22.184 549 HB2 GLU 925 HB1 GLU 925 -2.285 -6.750 -19.986 550 HB3 GLU 925 HB2 GLU 925 -1.869 -8.466 -19.956 551 HG2 GLU 925 HG1 GLU 925 -0.707 -8.188 -22.158 552 HG3 GLU 925 HG2 GLU 925 -1.092 -6.465 -22.114 553 H ALA 926 HN ALA 926 -3.176 -10.214 -20.575 554 HA ALA 926 HA ALA 926 -2.725 -11.812 -23.042 555 HB1 ALA 926 HB1 ALA 926 -3.372 -12.594 -20.165 556 HB2 ALA 926 HB2 ALA 926 -2.940 -13.707 -21.483 557 HB3 ALA 926 HB3 ALA 926 -1.747 -12.536 -20.888 558 H ASP 927 HN ASP 927 -5.300 -11.123 -20.707 559 HA ASP 927 HA ASP 927 -7.511 -11.432 -20.658 560 HB2 ASP 927 HB1 ASP 927 -7.082 -9.694 -22.498 561 HB3 ASP 927 HB2 ASP 927 -7.518 -10.955 -23.648 562 H ALA 928 HN ALA 928 -5.784 -13.830 -21.669 563 HA ALA 928 HA ALA 928 -7.578 -15.669 -22.945 564 HB1 ALA 928 HB1 ALA 928 -5.057 -16.156 -21.300 565 HB2 ALA 928 HB2 ALA 928 -5.841 -17.326 -22.380 566 HB3 ALA 928 HB3 ALA 928 -5.125 -15.848 -23.052 567 H1 ALA 1 HT1 ALA 1 -6.415 1.592 -6.633 568 H2 ALA 1 HT2 ALA 1 -4.938 1.491 -7.356 569 H3 ALA 1 HT3 ALA 1 -5.241 0.640 -5.988 570 HA ALA 1 HA ALA 1 -5.262 -0.814 -7.886 571 HB1 ALA 1 HB1 ALA 1 -6.768 -1.452 -6.042 572 HB2 ALA 1 HB2 ALA 1 -8.054 -0.417 -6.700 573 HB3 ALA 1 HB3 ALA 1 -7.510 -1.843 -7.596 574 H ARG 2 HN ARG 2 -5.454 -0.961 -10.017 575 HA ARG 2 HA ARG 2 -6.440 1.038 -11.771 576 HB2 ARG 2 HB1 ARG 2 -4.781 -0.676 -12.376 577 HB3 ARG 2 HB2 ARG 2 -5.937 -1.953 -12.054 578 HG2 ARG 2 HG1 ARG 2 -5.709 -1.811 -14.369 579 HG3 ARG 2 HG2 ARG 2 -7.314 -1.231 -14.002 580 HD2 ARG 2 HD1 ARG 2 -4.917 0.597 -14.488 581 HD3 ARG 2 HD2 ARG 2 -5.944 0.017 -15.780 582 HE ARG 2 HE ARG 2 -7.886 1.155 -14.607 583 HH11 ARG 2 HH11 ARG 2 -4.679 2.499 -14.109 584 HH12 ARG 2 HH12 ARG 2 -5.236 4.124 -14.451 585 HH21 ARG 2 HH21 ARG 2 -8.538 3.199 -14.744 586 HH22 ARG 2 HH22 ARG 2 -7.400 4.526 -14.652 587 H THR 3 HN THR 3 -8.513 1.566 -12.383 588 HA THR 3 HA THR 3 -10.138 -0.671 -13.214 589 HB THR 3 HB THR 3 -10.862 -0.405 -10.810 590 HG1 THR 3 HG1 THR 3 -12.314 -1.333 -12.141 591 HG21 THR 3 HG21 THR 3 -12.157 2.201 -11.717 592 HG22 THR 3 HG22 THR 3 -12.280 1.415 -10.136 593 HG23 THR 3 HG23 THR 3 -10.728 2.088 -10.661 594 H MLZ 4 HN MLZ 4 -12.603 0.689 -13.664 595 HA MLZ 4 HA MLZ 4 -12.012 2.603 -15.834 596 HB2 MLZ 4 HB1 MLZ 4 -12.777 1.091 -17.538 597 HB3 MLZ 4 HB2 MLZ 4 -11.528 0.262 -16.673 598 HG2 MLZ 4 HG1 MLZ 4 -14.487 -0.189 -16.068 599 HG3 MLZ 4 HG2 MLZ 4 -13.682 -0.997 -17.395 600 HD2 MLZ 4 HD1 MLZ 4 -12.669 -1.293 -14.589 601 HD3 MLZ 4 HD2 MLZ 4 -13.882 -2.351 -15.286 602 HE2 MLZ 4 HE1 MLZ 4 -11.293 -1.859 -16.777 603 HE3 MLZ 4 HE2 MLZ 4 -11.334 -2.978 -15.382 604 HZ MLZ 4 HZ1 MLZ 4 -13.123 -3.240 -17.756 605 HCM1 MLZ 4 HC1 MLZ 4 -11.791 -5.105 -18.410 606 HCM2 MLZ 4 HC2 MLZ 4 -10.813 -3.634 -18.362 607 HCM3 MLZ 4 HC3 MLZ 4 -10.719 -4.826 -17.037 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.028 -4.282 -16.493 609 H GLN 5 HN GLN 5 -14.105 3.379 -16.913 610 HA GLN 5 HA GLN 5 -16.558 2.910 -15.343 611 HB2 GLN 5 HB1 GLN 5 -17.032 5.200 -14.891 612 HB3 GLN 5 HB2 GLN 5 -15.507 4.696 -14.167 613 HG2 GLN 5 HG1 GLN 5 -14.431 5.846 -16.295 614 HG3 GLN 5 HG2 GLN 5 -15.980 6.695 -16.368 615 HE21 GLN 5 HE21 GLN 5 -13.080 6.086 -14.369 616 HE22 GLN 5 HE22 GLN 5 -13.372 7.409 -13.248 617 H THR 6 HN THR 6 -17.912 2.166 -16.786 618 HA THR 6 HA THR 6 -17.959 2.989 -19.570 619 HB THR 6 HB THR 6 -20.062 1.500 -19.545 620 HG1 THR 6 HG1 THR 6 -20.390 1.555 -17.306 621 HG21 THR 6 HG21 THR 6 -17.998 0.612 -20.391 622 HG22 THR 6 HG22 THR 6 -17.366 0.355 -18.743 623 HG23 THR 6 HG23 THR 6 -18.742 -0.602 -19.342 624 H ALA 7 HN ALA 7 -19.133 4.518 -20.487 625 HA ALA 7 HA ALA 7 -21.090 6.121 -19.024 626 HB1 ALA 7 HB1 ALA 7 -20.114 6.251 -21.899 627 HB2 ALA 7 HB2 ALA 7 -21.051 7.498 -21.043 628 HB3 ALA 7 HB3 ALA 7 -19.400 7.118 -20.514 629 H ARG 8 HN ARG 8 -21.994 3.591 -19.088 630 HA ARG 8 HA ARG 8 -24.450 3.583 -20.781 631 HB2 ARG 8 HB1 ARG 8 -22.677 2.365 -22.032 632 HB3 ARG 8 HB2 ARG 8 -22.446 1.266 -20.672 633 HG2 ARG 8 HG1 ARG 8 -24.799 0.480 -20.904 634 HG3 ARG 8 HG2 ARG 8 -25.057 1.639 -22.226 635 HD2 ARG 8 HD1 ARG 8 -23.271 0.533 -23.534 636 HD3 ARG 8 HD2 ARG 8 -23.030 -0.636 -22.217 637 HE ARG 8 HE ARG 8 -25.757 -0.756 -22.910 638 HH11 ARG 8 HH11 ARG 8 -22.700 -1.480 -24.496 639 HH12 ARG 8 HH12 ARG 8 -23.437 -2.669 -25.542 640 HH21 ARG 8 HH21 ARG 8 -26.614 -2.290 -24.279 641 HH22 ARG 8 HH22 ARG 8 -25.590 -3.106 -25.423 642 H TYR 9 HN TYR 9 -25.817 3.830 -19.095 643 HA TYR 9 HA TYR 9 -26.062 1.679 -17.085 644 HB2 TYR 9 HB1 TYR 9 -24.458 3.435 -16.200 645 HB3 TYR 9 HB2 TYR 9 -25.769 4.592 -16.267 646 HD1 TYR 9 HD1 TYR 9 -24.948 1.184 -14.890 647 HD2 TYR 9 HD2 TYR 9 -27.047 4.904 -14.301 648 HE1 TYR 9 HE1 TYR 9 -25.570 0.462 -12.590 649 HE2 TYR 9 HE2 TYR 9 -27.681 4.176 -11.999 650 HH TYR 9 HH TYR 9 -26.703 0.992 -10.672 Start of MODEL 4 1 H1 GLY 850 HT1 GLY 850 0.164 -8.561 -6.452 2 H2 GLY 850 HT2 GLY 850 1.452 -8.641 -5.442 3 H3 GLY 850 HT3 GLY 850 1.255 -9.775 -6.607 4 HA2 GLY 850 HA1 GLY 850 2.985 -8.223 -7.247 5 HA3 GLY 850 HA2 GLY 850 1.601 -8.168 -8.352 6 H SER 851 HN SER 851 3.740 -6.165 -7.148 7 HA SER 851 HA SER 851 2.290 -4.140 -5.743 8 HB2 SER 851 HB1 SER 851 4.747 -4.421 -5.696 9 HB3 SER 851 HB2 SER 851 4.833 -3.870 -7.383 10 HG SER 851 HG1 SER 851 5.200 -2.181 -5.832 11 H ARG 852 HN ARG 852 1.756 -2.023 -6.405 12 HA ARG 852 HA ARG 852 0.459 -0.572 -7.521 13 HB2 ARG 852 HB1 ARG 852 2.782 -0.252 -8.366 14 HB3 ARG 852 HB2 ARG 852 2.368 -1.150 -9.816 15 HG2 ARG 852 HG1 ARG 852 2.421 1.376 -9.973 16 HG3 ARG 852 HG2 ARG 852 0.975 0.618 -10.625 17 HD2 ARG 852 HD1 ARG 852 -0.348 1.259 -8.735 18 HD3 ARG 852 HD2 ARG 852 1.085 1.727 -7.796 19 HE ARG 852 HE ARG 852 1.244 3.394 -9.954 20 HH11 ARG 852 HH11 ARG 852 -1.531 2.806 -7.822 21 HH12 ARG 852 HH12 ARG 852 -1.790 4.552 -7.677 22 HH21 ARG 852 HH21 ARG 852 0.613 5.564 -9.766 23 HH22 ARG 852 HH22 ARG 852 -0.754 5.941 -8.723 24 H ARG 853 HN ARG 853 -0.534 -3.327 -7.737 25 HA ARG 853 HA ARG 853 -2.264 -3.368 -10.123 26 HB2 ARG 853 HB1 ARG 853 -2.015 -4.925 -7.550 27 HB3 ARG 853 HB2 ARG 853 -3.543 -4.982 -8.400 28 HG2 ARG 853 HG1 ARG 853 -1.887 -6.845 -8.859 29 HG3 ARG 853 HG2 ARG 853 -2.735 -6.136 -10.220 30 HD2 ARG 853 HD1 ARG 853 0.012 -5.125 -9.501 31 HD3 ARG 853 HD2 ARG 853 -0.156 -6.670 -10.330 32 HE ARG 853 HE ARG 853 -1.626 -5.293 -11.994 33 HH11 ARG 853 HH11 ARG 853 1.401 -4.082 -10.628 34 HH12 ARG 853 HH12 ARG 853 1.769 -3.215 -12.093 35 HH21 ARG 853 HH21 ARG 853 -1.090 -4.095 -13.756 36 HH22 ARG 853 HH22 ARG 853 0.390 -3.187 -13.776 37 H ALA 854 HN ALA 854 -2.400 -1.652 -7.113 38 HA ALA 854 HA ALA 854 -5.205 -0.885 -7.694 39 HB1 ALA 854 HB1 ALA 854 -4.747 -1.549 -5.391 40 HB2 ALA 854 HB2 ALA 854 -3.592 -0.195 -5.244 41 HB3 ALA 854 HB3 ALA 854 -5.315 0.131 -5.573 42 H SER 855 HN SER 855 -5.923 1.013 -8.023 43 HA SER 855 HA SER 855 -4.753 3.505 -7.773 44 HB2 SER 855 HB1 SER 855 -4.484 4.287 -10.018 45 HB3 SER 855 HB2 SER 855 -3.452 2.892 -9.756 46 HG SER 855 HG1 SER 855 -4.576 2.818 -11.775 47 H VAL 856 HN VAL 856 -6.192 5.116 -9.248 48 HA VAL 856 HA VAL 856 -8.941 4.190 -9.709 49 HB VAL 856 HB VAL 856 -9.988 6.093 -8.522 50 HG11 VAL 856 HG11 VAL 856 -8.534 4.192 -6.667 51 HG12 VAL 856 HG12 VAL 856 -10.015 5.106 -6.334 52 HG13 VAL 856 HG13 VAL 856 -10.021 3.847 -7.576 53 HG21 VAL 856 HG21 VAL 856 -7.299 6.456 -7.150 54 HG22 VAL 856 HG22 VAL 856 -8.080 7.600 -8.263 55 HG23 VAL 856 HG23 VAL 856 -8.827 7.238 -6.700 56 H GLY 857 HN GLY 857 -10.287 5.855 -10.765 57 HA2 GLY 857 HA1 GLY 857 -8.758 7.309 -12.851 58 HA3 GLY 857 HA2 GLY 857 -10.466 6.899 -12.867 59 H SER 858 HN SER 858 -11.489 8.769 -13.049 60 HA SER 858 HA SER 858 -10.689 11.173 -11.464 61 HB2 SER 858 HB1 SER 858 -10.648 11.375 -13.921 62 HB3 SER 858 HB2 SER 858 -12.379 10.977 -13.974 63 HG SER 858 HG1 SER 858 -11.692 13.302 -13.933 64 H GLU 859 HN GLU 859 -12.483 12.605 -10.884 65 HA GLU 859 HA GLU 859 -14.841 11.159 -9.805 66 HB2 GLU 859 HB1 GLU 859 -13.707 13.893 -9.139 67 HB3 GLU 859 HB2 GLU 859 -15.138 13.200 -8.354 68 HG2 GLU 859 HG1 GLU 859 -13.729 11.305 -7.515 69 HG3 GLU 859 HG2 GLU 859 -12.295 12.123 -8.141 70 H PHE 860 HN PHE 860 -14.093 12.632 -12.306 71 HA PHE 860 HA PHE 860 -16.311 14.455 -12.937 72 HB2 PHE 860 HB1 PHE 860 -14.027 14.623 -13.916 73 HB3 PHE 860 HB2 PHE 860 -14.268 13.120 -14.766 74 HD1 PHE 860 HD1 PHE 860 -15.483 16.642 -14.496 75 HD2 PHE 860 HD2 PHE 860 -15.468 13.029 -16.854 76 HE1 PHE 860 HE1 PHE 860 -16.515 17.874 -16.392 77 HE2 PHE 860 HE2 PHE 860 -16.500 14.264 -18.747 78 HZ PHE 860 HZ PHE 860 -17.024 16.687 -18.519 79 H THR 861 HN THR 861 -15.369 11.261 -14.118 80 HA THR 861 HA THR 861 -17.510 10.784 -15.863 81 HB THR 861 HB THR 861 -16.124 8.543 -14.484 82 HG1 THR 861 HG1 THR 861 -14.276 9.099 -15.243 83 HG21 THR 861 HG21 THR 861 -17.070 9.046 -17.332 84 HG22 THR 861 HG22 THR 861 -16.005 7.703 -16.900 85 HG23 THR 861 HG23 THR 861 -17.623 7.784 -16.201 86 H GLU 862 HN GLU 862 -19.294 9.324 -15.806 87 HA GLU 862 HA GLU 862 -20.746 9.210 -13.260 88 HB2 GLU 862 HB1 GLU 862 -21.634 9.645 -15.738 89 HB3 GLU 862 HB2 GLU 862 -21.727 7.893 -15.780 90 HG2 GLU 862 HG1 GLU 862 -22.876 8.700 -13.276 91 HG3 GLU 862 HG2 GLU 862 -23.423 9.889 -14.440 92 H SER 863 HN SER 863 -22.092 6.635 -13.776 93 HA SER 863 HA SER 863 -20.742 5.038 -11.988 94 HB2 SER 863 HB1 SER 863 -22.154 3.175 -12.723 95 HB3 SER 863 HB2 SER 863 -23.069 4.672 -12.521 96 HG SER 863 HG1 SER 863 -23.220 4.919 -14.661 97 H ALA 864 HN ALA 864 -19.395 3.399 -11.915 98 HA ALA 864 HA ALA 864 -17.635 2.921 -14.294 99 HB1 ALA 864 HB1 ALA 864 -15.720 3.435 -12.788 100 HB2 ALA 864 HB2 ALA 864 -16.800 4.834 -12.965 101 HB3 ALA 864 HB3 ALA 864 -16.855 3.841 -11.489 102 H TRP 865 HN TRP 865 -15.805 1.275 -13.492 103 HA TRP 865 HA TRP 865 -17.142 -0.953 -11.983 104 HB2 TRP 865 HB1 TRP 865 -14.836 -0.906 -13.915 105 HB3 TRP 865 HB2 TRP 865 -15.455 -2.342 -13.100 106 HD1 TRP 865 HD1 TRP 865 -16.661 0.361 -15.578 107 HE1 TRP 865 HE1 TRP 865 -18.601 -0.509 -16.945 108 HE3 TRP 865 HE3 TRP 865 -17.174 -4.188 -13.327 109 HZ2 TRP 865 HZ2 TRP 865 -19.974 -3.088 -17.293 110 HZ3 TRP 865 HZ3 TRP 865 -18.788 -5.862 -14.209 111 HH2 TRP 865 HH2 TRP 865 -20.159 -5.332 -16.199 112 H VAL 866 HN VAL 866 -15.641 -2.360 -10.786 113 HA VAL 866 HA VAL 866 -13.131 -1.177 -9.803 114 HB VAL 866 HB VAL 866 -14.684 -0.371 -8.144 115 HG11 VAL 866 HG11 VAL 866 -15.402 -3.264 -7.518 116 HG12 VAL 866 HG12 VAL 866 -15.991 -1.797 -6.706 117 HG13 VAL 866 HG13 VAL 866 -16.454 -2.127 -8.374 118 HG21 VAL 866 HG21 VAL 866 -12.419 -1.035 -7.413 119 HG22 VAL 866 HG22 VAL 866 -13.651 -1.142 -6.144 120 HG23 VAL 866 HG23 VAL 866 -13.068 -2.625 -6.923 121 H ARG 867 HN ARG 867 -11.545 -2.688 -9.391 122 HA ARG 867 HA ARG 867 -12.138 -5.551 -9.981 123 HB2 ARG 867 HB1 ARG 867 -10.096 -3.972 -10.849 124 HB3 ARG 867 HB2 ARG 867 -9.375 -4.529 -9.405 125 HG2 ARG 867 HG1 ARG 867 -9.729 -6.898 -10.200 126 HG3 ARG 867 HG2 ARG 867 -10.303 -6.229 -11.768 127 HD2 ARG 867 HD1 ARG 867 -8.200 -5.117 -12.141 128 HD3 ARG 867 HD2 ARG 867 -7.643 -5.495 -10.510 129 HE ARG 867 HE ARG 867 -6.709 -7.355 -11.275 130 HH11 ARG 867 HH11 ARG 867 -9.545 -7.208 -13.297 131 HH12 ARG 867 HH12 ARG 867 -8.734 -8.000 -14.643 132 HH21 ARG 867 HH21 ARG 867 -5.771 -8.429 -13.060 133 HH22 ARG 867 HH22 ARG 867 -6.784 -8.681 -14.476 134 H CYS 868 HN CYS 868 -11.954 -7.125 -8.439 135 HA CYS 868 HA CYS 868 -11.758 -6.519 -5.657 136 HB2 CYS 868 HB1 CYS 868 -13.062 -8.336 -6.615 137 HB3 CYS 868 HB2 CYS 868 -11.602 -9.090 -7.257 138 H ASP 869 HN ASP 869 -10.038 -6.218 -4.382 139 HA ASP 869 HA ASP 869 -7.280 -6.725 -5.138 140 HB2 ASP 869 HB1 ASP 869 -8.719 -5.834 -2.628 141 HB3 ASP 869 HB2 ASP 869 -7.035 -6.328 -2.530 142 H ASP 870 HN ASP 870 -9.660 -8.969 -4.058 143 HA ASP 870 HA ASP 870 -7.608 -10.700 -2.757 144 HB2 ASP 870 HB1 ASP 870 -9.774 -10.126 -1.563 145 HB3 ASP 870 HB2 ASP 870 -10.608 -11.118 -2.756 146 H CYS 871 HN CYS 871 -9.748 -10.506 -5.549 147 HA CYS 871 HA CYS 871 -8.185 -12.716 -6.721 148 HB2 CYS 871 HB1 CYS 871 -9.977 -13.687 -7.850 149 HB3 CYS 871 HB2 CYS 871 -10.376 -13.611 -6.149 150 H PHE 872 HN PHE 872 -10.498 -11.038 -8.514 151 HA PHE 872 HA PHE 872 -9.010 -8.939 -9.743 152 HB2 PHE 872 HB1 PHE 872 -8.355 -9.805 -11.810 153 HB3 PHE 872 HB2 PHE 872 -7.618 -10.825 -10.608 154 HD1 PHE 872 HD1 PHE 872 -8.697 -13.146 -10.140 155 HD2 PHE 872 HD2 PHE 872 -9.727 -10.700 -13.539 156 HE1 PHE 872 HE1 PHE 872 -9.682 -15.126 -11.267 157 HE2 PHE 872 HE2 PHE 872 -10.703 -12.689 -14.670 158 HZ PHE 872 HZ PHE 872 -10.688 -14.898 -13.532 159 H LYS 873 HN LYS 873 -11.742 -11.014 -9.694 160 HA LYS 873 HA LYS 873 -13.394 -10.432 -11.825 161 HB2 LYS 873 HB1 LYS 873 -13.720 -11.857 -9.717 162 HB3 LYS 873 HB2 LYS 873 -14.318 -10.353 -8.985 163 HG2 LYS 873 HG1 LYS 873 -15.585 -11.034 -11.562 164 HG3 LYS 873 HG2 LYS 873 -15.812 -12.247 -10.290 165 HD2 LYS 873 HD1 LYS 873 -16.289 -9.330 -9.771 166 HD3 LYS 873 HD2 LYS 873 -17.574 -10.341 -10.444 167 HE2 LYS 873 HE1 LYS 873 -16.044 -11.157 -7.980 168 HE3 LYS 873 HE2 LYS 873 -17.436 -10.067 -7.840 169 HZ1 LYS 873 HZ1 LYS 873 -17.483 -12.830 -8.941 170 HZ2 LYS 873 HZ2 LYS 873 -18.057 -12.363 -7.484 171 HZ3 LYS 873 HZ3 LYS 873 -18.773 -11.832 -8.889 172 H TRP 874 HN TRP 874 -14.881 -8.952 -12.390 173 HA TRP 874 HA TRP 874 -14.488 -6.233 -11.296 174 HB2 TRP 874 HB1 TRP 874 -15.698 -7.068 -13.976 175 HB3 TRP 874 HB2 TRP 874 -15.407 -5.430 -13.445 176 HD1 TRP 874 HD1 TRP 874 -13.640 -8.218 -15.195 177 HE1 TRP 874 HE1 TRP 874 -11.153 -7.521 -15.676 178 HE3 TRP 874 HE3 TRP 874 -13.392 -3.916 -12.437 179 HZ2 TRP 874 HZ2 TRP 874 -9.399 -5.507 -14.943 180 HZ3 TRP 874 HZ3 TRP 874 -11.203 -2.724 -12.256 181 HH2 TRP 874 HH2 TRP 874 -9.233 -3.476 -13.503 182 H ARG 875 HN ARG 875 -16.225 -4.813 -10.919 183 HA ARG 875 HA ARG 875 -19.005 -5.836 -11.046 184 HB2 ARG 875 HB1 ARG 875 -17.595 -4.904 -8.507 185 HB3 ARG 875 HB2 ARG 875 -19.336 -4.809 -8.679 186 HG2 ARG 875 HG1 ARG 875 -17.660 -7.355 -8.747 187 HG3 ARG 875 HG2 ARG 875 -18.706 -6.825 -7.453 188 HD2 ARG 875 HD1 ARG 875 -19.553 -7.795 -10.175 189 HD3 ARG 875 HD2 ARG 875 -19.860 -8.539 -8.606 190 HE ARG 875 HE ARG 875 -21.100 -6.100 -8.329 191 HH11 ARG 875 HH11 ARG 875 -21.450 -8.590 -10.771 192 HH12 ARG 875 HH12 ARG 875 -23.028 -7.958 -11.247 193 HH21 ARG 875 HH21 ARG 875 -23.271 -5.578 -8.935 194 HH22 ARG 875 HH22 ARG 875 -23.896 -6.385 -10.377 195 H ARG 876 HN ARG 876 -20.418 -4.342 -11.625 196 HA ARG 876 HA ARG 876 -19.553 -1.626 -12.295 197 HB2 ARG 876 HB1 ARG 876 -21.143 -3.015 -13.702 198 HB3 ARG 876 HB2 ARG 876 -22.322 -2.908 -12.400 199 HG2 ARG 876 HG1 ARG 876 -22.957 -1.277 -13.991 200 HG3 ARG 876 HG2 ARG 876 -22.240 -0.359 -12.664 201 HD2 ARG 876 HD1 ARG 876 -20.100 -0.225 -13.966 202 HD3 ARG 876 HD2 ARG 876 -20.853 -1.165 -15.250 203 HE ARG 876 HE ARG 876 -21.743 1.576 -14.399 204 HH11 ARG 876 HH11 ARG 876 -21.348 -0.711 -17.050 205 HH12 ARG 876 HH12 ARG 876 -21.723 0.500 -18.240 206 HH21 ARG 876 HH21 ARG 876 -22.311 2.991 -15.942 207 HH22 ARG 876 HH22 ARG 876 -22.303 2.495 -17.636 208 H ILE 877 HN ILE 877 -19.673 0.062 -11.032 209 HA ILE 877 HA ILE 877 -21.485 0.125 -8.656 210 HB ILE 877 HB ILE 877 -19.710 1.173 -7.374 211 HG12 ILE 877 HG11 ILE 877 -17.889 0.726 -9.774 212 HG13 ILE 877 HG12 ILE 877 -18.483 2.289 -9.236 213 HG21 ILE 877 HG21 ILE 877 -18.669 -1.407 -8.593 214 HG22 ILE 877 HG22 ILE 877 -18.404 -0.805 -6.942 215 HG23 ILE 877 HG23 ILE 877 -20.013 -1.329 -7.437 216 HD11 ILE 877 HD1 ILE 877 -16.168 1.871 -8.538 217 HD12 ILE 877 HD2 ILE 877 -17.253 2.164 -7.175 218 HD13 ILE 877 HD3 ILE 877 -16.701 0.518 -7.535 219 HA PRO 878 HA PRO 878 -22.325 4.343 -10.029 220 HB2 PRO 878 HB1 PRO 878 -23.056 5.583 -7.707 221 HB3 PRO 878 HB2 PRO 878 -24.109 4.391 -8.530 222 HG2 PRO 878 HG1 PRO 878 -22.211 3.913 -6.216 223 HG3 PRO 878 HG2 PRO 878 -23.925 3.410 -6.354 224 HD2 PRO 878 HD1 PRO 878 -21.862 1.718 -6.926 225 HD3 PRO 878 HD2 PRO 878 -23.390 1.669 -7.853 226 H ALA 879 HN ALA 879 -21.148 6.255 -10.129 227 HA ALA 879 HA ALA 879 -18.454 6.374 -9.436 228 HB1 ALA 879 HB1 ALA 879 -18.646 8.745 -10.057 229 HB2 ALA 879 HB2 ALA 879 -19.654 7.758 -11.133 230 HB3 ALA 879 HB3 ALA 879 -20.408 8.688 -9.823 231 H SER 880 HN SER 880 -21.168 7.138 -7.343 232 HA SER 880 HA SER 880 -19.887 8.654 -5.305 233 HB2 SER 880 HB1 SER 880 -22.074 6.561 -4.977 234 HB3 SER 880 HB2 SER 880 -21.703 7.903 -3.876 235 HG SER 880 HG1 SER 880 -23.455 8.421 -5.250 236 H VAL 881 HN VAL 881 -19.693 5.212 -6.082 237 HA VAL 881 HA VAL 881 -18.211 4.606 -3.578 238 HB VAL 881 HB VAL 881 -19.059 2.820 -5.880 239 HG11 VAL 881 HG11 VAL 881 -18.354 0.906 -4.521 240 HG12 VAL 881 HG12 VAL 881 -16.957 1.931 -4.849 241 HG13 VAL 881 HG13 VAL 881 -17.746 1.993 -3.257 242 HG21 VAL 881 HG21 VAL 881 -20.010 2.920 -2.986 243 HG22 VAL 881 HG22 VAL 881 -20.917 3.530 -4.379 244 HG23 VAL 881 HG23 VAL 881 -20.580 1.801 -4.245 245 H VAL 882 HN VAL 882 -17.681 5.003 -7.078 246 HA VAL 882 HA VAL 882 -14.947 4.169 -6.820 247 HB VAL 882 HB VAL 882 -16.481 4.434 -8.976 248 HG11 VAL 882 HG11 VAL 882 -16.378 6.979 -8.956 249 HG12 VAL 882 HG12 VAL 882 -14.660 6.851 -9.333 250 HG13 VAL 882 HG13 VAL 882 -15.870 6.208 -10.463 251 HG21 VAL 882 HG21 VAL 882 -14.484 4.107 -10.360 252 HG22 VAL 882 HG22 VAL 882 -13.448 4.753 -9.064 253 HG23 VAL 882 HG23 VAL 882 -14.315 3.225 -8.841 254 H GLY 883 HN GLY 883 -16.450 7.137 -6.088 255 HA2 GLY 883 HA1 GLY 883 -13.933 8.671 -5.760 256 HA3 GLY 883 HA2 GLY 883 -15.569 9.199 -5.369 257 H SER 884 HN SER 884 -15.987 6.596 -3.794 258 HA SER 884 HA SER 884 -14.943 7.514 -1.200 259 HB2 SER 884 HB1 SER 884 -17.263 6.691 -1.446 260 HB3 SER 884 HB2 SER 884 -16.644 5.112 -1.960 261 HG SER 884 HG1 SER 884 -16.389 6.364 0.584 262 H ILE 885 HN ILE 885 -14.453 4.792 -3.433 263 HA ILE 885 HA ILE 885 -12.344 3.461 -1.909 264 HB ILE 885 HB ILE 885 -13.588 3.259 -4.649 265 HG12 ILE 885 HG11 ILE 885 -14.028 0.983 -4.097 266 HG13 ILE 885 HG12 ILE 885 -12.947 0.981 -2.709 267 HG21 ILE 885 HG21 ILE 885 -11.255 3.040 -5.246 268 HG22 ILE 885 HG22 ILE 885 -11.006 1.835 -3.958 269 HG23 ILE 885 HG23 ILE 885 -12.075 1.477 -5.332 270 HD11 ILE 885 HD1 ILE 885 -15.509 2.619 -2.922 271 HD12 ILE 885 HD2 ILE 885 -15.387 1.065 -2.097 272 HD13 ILE 885 HD3 ILE 885 -14.491 2.442 -1.468 273 H ASP 886 HN ASP 886 -10.347 4.197 -1.660 274 HA ASP 886 HA ASP 886 -9.346 6.514 -3.205 275 HB2 ASP 886 HB1 ASP 886 -8.139 5.027 -0.843 276 HB3 ASP 886 HB2 ASP 886 -7.491 6.479 -1.577 277 H GLU 887 HN GLU 887 -6.970 6.435 -3.772 278 HA GLU 887 HA GLU 887 -6.471 4.632 -5.852 279 HB2 GLU 887 HB1 GLU 887 -5.499 6.946 -5.334 280 HB3 GLU 887 HB2 GLU 887 -4.355 6.122 -4.260 281 HG2 GLU 887 HG1 GLU 887 -3.581 4.762 -6.222 282 HG3 GLU 887 HG2 GLU 887 -4.721 5.642 -7.247 283 H SER 888 HN SER 888 -5.839 4.137 -2.458 284 HA SER 888 HA SER 888 -4.429 1.560 -3.001 285 HB2 SER 888 HB1 SER 888 -3.360 1.863 -0.819 286 HB3 SER 888 HB2 SER 888 -3.018 3.220 -1.903 287 HG SER 888 HG1 SER 888 -3.608 3.919 0.213 288 H SER 889 HN SER 889 -7.519 2.503 -2.261 289 HA SER 889 HA SER 889 -8.082 1.004 0.136 290 HB2 SER 889 HB1 SER 889 -9.859 1.985 -2.110 291 HB3 SER 889 HB2 SER 889 -10.485 1.109 -0.702 292 HG SER 889 HG1 SER 889 -9.712 2.740 0.638 293 H ARG 890 HN ARG 890 -8.428 -1.061 0.496 294 HA ARG 890 HA ARG 890 -8.282 -3.052 -1.652 295 HB2 ARG 890 HB1 ARG 890 -8.434 -3.334 1.370 296 HB3 ARG 890 HB2 ARG 890 -8.296 -4.683 0.231 297 HG2 ARG 890 HG1 ARG 890 -6.158 -3.755 -0.630 298 HG3 ARG 890 HG2 ARG 890 -6.261 -2.431 0.550 299 HD2 ARG 890 HD1 ARG 890 -6.255 -4.082 2.399 300 HD3 ARG 890 HD2 ARG 890 -6.132 -5.401 1.215 301 HE ARG 890 HE ARG 890 -4.009 -3.571 0.731 302 HH11 ARG 890 HH11 ARG 890 -4.899 -5.882 3.209 303 HH12 ARG 890 HH12 ARG 890 -3.244 -6.151 3.684 304 HH21 ARG 890 HH21 ARG 890 -1.920 -3.958 1.387 305 HH22 ARG 890 HH22 ARG 890 -1.607 -5.086 2.674 306 H TRP 891 HN TRP 891 -10.221 -2.469 -2.748 307 HA TRP 891 HA TRP 891 -12.836 -3.114 -1.511 308 HB2 TRP 891 HB1 TRP 891 -12.623 -1.274 -3.147 309 HB3 TRP 891 HB2 TRP 891 -12.165 -2.448 -4.386 310 HD1 TRP 891 HD1 TRP 891 -14.967 -0.774 -2.801 311 HE1 TRP 891 HE1 TRP 891 -17.240 -1.541 -3.685 312 HE3 TRP 891 HE3 TRP 891 -13.463 -5.006 -5.247 313 HZ2 TRP 891 HZ2 TRP 891 -18.312 -3.899 -4.938 314 HZ3 TRP 891 HZ3 TRP 891 -15.188 -6.568 -6.188 315 HH2 TRP 891 HH2 TRP 891 -17.573 -6.052 -5.937 316 H ILE 892 HN ILE 892 -13.774 -5.128 -1.604 317 HA ILE 892 HA ILE 892 -12.747 -7.138 -3.540 318 HB ILE 892 HB ILE 892 -12.587 -8.836 -1.836 319 HG12 ILE 892 HG11 ILE 892 -12.984 -6.756 0.334 320 HG13 ILE 892 HG12 ILE 892 -14.308 -7.750 -0.275 321 HG21 ILE 892 HG21 ILE 892 -10.905 -6.438 -0.991 322 HG22 ILE 892 HG22 ILE 892 -10.524 -8.141 -0.732 323 HG23 ILE 892 HG23 ILE 892 -10.568 -7.498 -2.376 324 HD11 ILE 892 HD1 ILE 892 -11.807 -8.971 0.910 325 HD12 ILE 892 HD2 ILE 892 -13.343 -8.721 1.750 326 HD13 ILE 892 HD3 ILE 892 -13.290 -9.795 0.335 327 H CYS 893 HN CYS 893 -14.094 -9.027 -3.821 328 HA CYS 893 HA CYS 893 -16.760 -8.601 -4.244 329 HB2 CYS 893 HB1 CYS 893 -15.435 -11.252 -3.532 330 HB3 CYS 893 HB2 CYS 893 -16.978 -11.006 -4.372 331 H MET 894 HN MET 894 -15.390 -9.815 -1.098 332 HA MET 894 HA MET 894 -17.896 -10.644 0.001 333 HB2 MET 894 HB1 MET 894 -15.645 -11.240 0.835 334 HB3 MET 894 HB2 MET 894 -15.414 -9.589 1.400 335 HG2 MET 894 HG1 MET 894 -17.660 -11.349 2.397 336 HG3 MET 894 HG2 MET 894 -16.042 -11.398 3.081 337 HE1 MET 894 HE1 MET 894 -15.625 -8.005 4.923 338 HE2 MET 894 HE2 MET 894 -14.875 -9.546 4.451 339 HE3 MET 894 HE3 MET 894 -15.121 -8.260 3.243 340 H ASN 895 HN ASN 895 -16.454 -7.472 -0.299 341 HA ASN 895 HA ASN 895 -18.329 -6.124 1.525 342 HB2 ASN 895 HB1 ASN 895 -16.576 -4.772 1.764 343 HB3 ASN 895 HB2 ASN 895 -15.663 -5.703 0.591 344 HD21 ASN 895 HD21 ASN 895 -16.179 -5.120 -1.807 345 HD22 ASN 895 HD22 ASN 895 -16.307 -3.390 -2.105 346 H ASN 896 HN ASN 896 -18.417 -7.106 -1.698 347 HA ASN 896 HA ASN 896 -19.358 -4.964 -3.169 348 HB2 ASN 896 HB1 ASN 896 -18.732 -7.190 -4.087 349 HB3 ASN 896 HB2 ASN 896 -20.204 -7.868 -3.390 350 HD21 ASN 896 HD21 ASN 896 -21.582 -8.379 -5.084 351 HD22 ASN 896 HD22 ASN 896 -21.889 -7.279 -6.399 352 H SER 897 HN SER 897 -21.151 -3.893 -3.498 353 HA SER 897 HA SER 897 -23.312 -3.641 -1.773 354 HB2 SER 897 HB1 SER 897 -23.098 -3.157 -4.772 355 HB3 SER 897 HB2 SER 897 -24.461 -2.626 -3.791 356 HG SER 897 HG1 SER 897 -22.871 -0.974 -3.984 357 H ASP 898 HN ASP 898 -23.183 -5.634 -4.680 358 HA ASP 898 HA ASP 898 -25.972 -6.561 -4.323 359 HB2 ASP 898 HB1 ASP 898 -24.142 -7.293 -6.597 360 HB3 ASP 898 HB2 ASP 898 -25.897 -7.308 -6.555 361 H LYS 899 HN LYS 899 -26.146 -8.065 -2.858 362 HA LYS 899 HA LYS 899 -24.289 -10.012 -2.053 363 HB2 LYS 899 HB1 LYS 899 -27.329 -10.062 -1.826 364 HB3 LYS 899 HB2 LYS 899 -26.217 -11.082 -0.916 365 HG2 LYS 899 HG1 LYS 899 -25.939 -8.067 -0.761 366 HG3 LYS 899 HG2 LYS 899 -27.178 -8.889 0.178 367 HD2 LYS 899 HD1 LYS 899 -24.297 -9.805 0.256 368 HD3 LYS 899 HD2 LYS 899 -24.911 -8.504 1.311 369 HE2 LYS 899 HE1 LYS 899 -26.647 -10.035 2.190 370 HE3 LYS 899 HE2 LYS 899 -26.057 -11.327 1.142 371 HZ1 LYS 899 HZ1 LYS 899 -23.929 -11.238 2.347 372 HZ2 LYS 899 HZ2 LYS 899 -24.480 -10.039 3.313 373 HZ3 LYS 899 HZ3 LYS 899 -25.150 -11.524 3.391 374 H ARG 900 HN ARG 900 -26.334 -10.118 -4.804 375 HA ARG 900 HA ARG 900 -26.258 -12.985 -5.388 376 HB2 ARG 900 HB1 ARG 900 -26.696 -10.482 -7.075 377 HB3 ARG 900 HB2 ARG 900 -26.795 -12.106 -7.724 378 HG2 ARG 900 HG1 ARG 900 -28.608 -10.935 -5.555 379 HG3 ARG 900 HG2 ARG 900 -28.992 -11.122 -7.260 380 HD2 ARG 900 HD1 ARG 900 -30.073 -12.931 -6.322 381 HD3 ARG 900 HD2 ARG 900 -28.576 -13.645 -6.940 382 HE ARG 900 HE ARG 900 -28.378 -12.795 -4.152 383 HH11 ARG 900 HH11 ARG 900 -29.595 -15.440 -6.099 384 HH12 ARG 900 HH12 ARG 900 -29.472 -16.582 -4.790 385 HH21 ARG 900 HH21 ARG 900 -28.223 -14.314 -2.529 386 HH22 ARG 900 HH22 ARG 900 -28.722 -15.952 -2.826 387 H PHE 901 HN PHE 901 -23.955 -10.421 -5.821 388 HA PHE 901 HA PHE 901 -22.151 -12.287 -7.294 389 HB2 PHE 901 HB1 PHE 901 -22.217 -9.271 -7.613 390 HB3 PHE 901 HB2 PHE 901 -21.308 -10.416 -8.582 391 HD1 PHE 901 HD1 PHE 901 -24.747 -9.171 -7.817 392 HD2 PHE 901 HD2 PHE 901 -22.260 -11.313 -10.601 393 HE1 PHE 901 HE1 PHE 901 -26.588 -9.156 -9.479 394 HE2 PHE 901 HE2 PHE 901 -24.097 -11.317 -12.250 395 HZ PHE 901 HZ PHE 901 -26.272 -10.240 -11.696 396 H ALA 902 HN ALA 902 -22.433 -11.233 -4.395 397 HA ALA 902 HA ALA 902 -19.904 -9.936 -3.862 398 HB1 ALA 902 HB1 ALA 902 -20.851 -9.635 -1.599 399 HB2 ALA 902 HB2 ALA 902 -22.057 -9.193 -2.812 400 HB3 ALA 902 HB3 ALA 902 -22.162 -10.766 -1.980 401 H ASP 903 HN ASP 903 -19.372 -12.403 -4.837 402 HA ASP 903 HA ASP 903 -17.388 -13.063 -2.854 403 HB2 ASP 903 HB1 ASP 903 -19.583 -14.992 -3.312 404 HB3 ASP 903 HB2 ASP 903 -17.990 -15.677 -3.550 405 H CYS 904 HN CYS 904 -15.560 -13.995 -3.582 406 HA CYS 904 HA CYS 904 -14.673 -13.554 -6.197 407 HB2 CYS 904 HB1 CYS 904 -13.698 -15.501 -4.043 408 HB3 CYS 904 HB2 CYS 904 -12.754 -14.903 -5.408 409 H SER 905 HN SER 905 -16.734 -16.015 -5.054 410 HA SER 905 HA SER 905 -16.078 -18.065 -7.119 411 HB2 SER 905 HB1 SER 905 -18.163 -18.099 -4.910 412 HB3 SER 905 HB2 SER 905 -17.706 -19.449 -5.962 413 HG SER 905 HG1 SER 905 -15.659 -19.466 -5.009 414 H LYS 906 HN LYS 906 -18.250 -15.399 -6.553 415 HA LYS 906 HA LYS 906 -20.395 -16.423 -8.310 416 HB2 LYS 906 HB1 LYS 906 -19.930 -13.735 -6.999 417 HB3 LYS 906 HB2 LYS 906 -21.376 -14.199 -7.937 418 HG2 LYS 906 HG1 LYS 906 -20.544 -15.161 -5.231 419 HG3 LYS 906 HG2 LYS 906 -21.968 -14.215 -5.684 420 HD2 LYS 906 HD1 LYS 906 -21.360 -17.101 -6.424 421 HD3 LYS 906 HD2 LYS 906 -22.509 -16.571 -5.188 422 HE2 LYS 906 HE1 LYS 906 -23.858 -15.458 -6.969 423 HE3 LYS 906 HE2 LYS 906 -22.744 -16.065 -8.191 424 HZ1 LYS 906 HZ1 LYS 906 -23.343 -18.336 -7.509 425 HZ2 LYS 906 HZ2 LYS 906 -24.379 -17.764 -6.381 426 HZ3 LYS 906 HZ3 LYS 906 -24.676 -17.513 -7.965 427 H SER 907 HN SER 907 -21.288 -14.748 -9.811 428 HA SER 907 HA SER 907 -19.452 -14.538 -12.064 429 HB2 SER 907 HB1 SER 907 -21.564 -14.275 -13.297 430 HB3 SER 907 HB2 SER 907 -21.667 -15.625 -12.147 431 HG SER 907 HG1 SER 907 -23.523 -14.287 -12.057 432 H GLN 908 HN GLN 908 -20.614 -12.527 -13.519 433 HA GLN 908 HA GLN 908 -20.618 -9.980 -12.096 434 HB2 GLN 908 HB1 GLN 908 -18.782 -8.992 -13.274 435 HB3 GLN 908 HB2 GLN 908 -18.204 -10.475 -12.521 436 HG2 GLN 908 HG1 GLN 908 -18.785 -11.532 -14.909 437 HG3 GLN 908 HG2 GLN 908 -18.692 -9.865 -15.410 438 HE21 GLN 908 HE21 GLN 908 -16.634 -9.284 -16.120 439 HE22 GLN 908 HE22 GLN 908 -15.167 -10.166 -15.680 440 H GLU 909 HN GLU 909 -21.182 -8.155 -13.652 441 HA GLU 909 HA GLU 909 -23.465 -8.881 -15.212 442 HB2 GLU 909 HB1 GLU 909 -21.863 -6.317 -15.430 443 HB3 GLU 909 HB2 GLU 909 -23.524 -6.548 -15.928 444 HG2 GLU 909 HG1 GLU 909 -22.410 -6.471 -13.109 445 HG3 GLU 909 HG2 GLU 909 -23.407 -5.258 -13.888 446 H MET 910 HN MET 910 -20.105 -8.420 -16.217 447 HA MET 910 HA MET 910 -20.654 -9.409 -18.942 448 HB2 MET 910 HB1 MET 910 -19.367 -6.685 -18.445 449 HB3 MET 910 HB2 MET 910 -19.275 -7.575 -19.949 450 HG2 MET 910 HG1 MET 910 -21.892 -6.638 -18.731 451 HG3 MET 910 HG2 MET 910 -20.965 -5.749 -19.933 452 HE1 MET 910 HE1 MET 910 -24.048 -6.546 -20.225 453 HE2 MET 910 HE2 MET 910 -23.144 -5.579 -21.414 454 HE3 MET 910 HE3 MET 910 -24.091 -6.985 -21.946 455 H SER 911 HN SER 911 -19.005 -10.684 -19.612 456 HA SER 911 HA SER 911 -16.789 -11.343 -17.919 457 HB2 SER 911 HB1 SER 911 -16.788 -11.873 -20.880 458 HB3 SER 911 HB2 SER 911 -16.112 -12.848 -19.576 459 HG SER 911 HG1 SER 911 -18.062 -13.757 -20.368 460 H ASN 912 HN ASN 912 -14.439 -11.227 -18.613 461 HA ASN 912 HA ASN 912 -13.890 -8.392 -18.716 462 HB2 ASN 912 HB1 ASN 912 -11.784 -10.580 -18.812 463 HB3 ASN 912 HB2 ASN 912 -11.617 -8.929 -18.251 464 HD21 ASN 912 HD21 ASN 912 -10.732 -9.627 -16.244 465 HD22 ASN 912 HD22 ASN 912 -11.756 -10.418 -15.045 466 H GLU 913 HN GLU 913 -13.874 -10.793 -21.214 467 HA GLU 913 HA GLU 913 -12.509 -9.206 -23.237 468 HB2 GLU 913 HB1 GLU 913 -12.779 -11.666 -23.292 469 HB3 GLU 913 HB2 GLU 913 -14.530 -11.475 -23.457 470 HG2 GLU 913 HG1 GLU 913 -14.252 -10.455 -25.657 471 HG3 GLU 913 HG2 GLU 913 -12.500 -10.368 -25.437 472 H GLU 914 HN GLU 914 -15.675 -8.991 -21.809 473 HA GLU 914 HA GLU 914 -16.711 -7.237 -23.996 474 HB2 GLU 914 HB1 GLU 914 -18.094 -8.440 -21.579 475 HB3 GLU 914 HB2 GLU 914 -18.852 -7.374 -22.753 476 HG2 GLU 914 HG1 GLU 914 -17.744 -10.172 -23.228 477 HG3 GLU 914 HG2 GLU 914 -19.437 -9.710 -23.155 478 H ILE 915 HN ILE 915 -16.158 -7.196 -20.398 479 HA ILE 915 HA ILE 915 -16.486 -4.346 -20.412 480 HB ILE 915 HB ILE 915 -17.260 -5.598 -18.612 481 HG12 ILE 915 HG11 ILE 915 -16.742 -4.124 -16.840 482 HG13 ILE 915 HG12 ILE 915 -15.126 -3.805 -17.392 483 HG21 ILE 915 HG21 ILE 915 -15.710 -6.356 -16.747 484 HG22 ILE 915 HG22 ILE 915 -15.722 -7.345 -18.191 485 HG23 ILE 915 HG23 ILE 915 -14.370 -6.224 -17.911 486 HD11 ILE 915 HD1 ILE 915 -16.069 -2.606 -19.421 487 HD12 ILE 915 HD2 ILE 915 -17.687 -2.844 -18.740 488 HD13 ILE 915 HD3 ILE 915 -16.459 -1.864 -17.888 489 H ASN 916 HN ASN 916 -14.241 -5.669 -21.756 490 HA ASN 916 HA ASN 916 -12.485 -3.280 -21.280 491 HB2 ASN 916 HB1 ASN 916 -10.558 -4.275 -22.230 492 HB3 ASN 916 HB2 ASN 916 -11.171 -5.319 -20.972 493 HD21 ASN 916 HD21 ASN 916 -9.694 -6.841 -22.027 494 HD22 ASN 916 HD22 ASN 916 -10.254 -7.733 -23.447 495 H GLU 917 HN GLU 917 -14.177 -5.106 -23.774 496 HA GLU 917 HA GLU 917 -13.819 -3.247 -25.913 497 HB2 GLU 917 HB1 GLU 917 -15.687 -5.477 -25.254 498 HB3 GLU 917 HB2 GLU 917 -16.160 -4.397 -26.541 499 HG2 GLU 917 HG1 GLU 917 -13.516 -5.923 -26.386 500 HG3 GLU 917 HG2 GLU 917 -14.918 -6.427 -27.324 501 H GLU 918 HN GLU 918 -16.254 -3.304 -23.319 502 HA GLU 918 HA GLU 918 -18.082 -1.442 -24.373 503 HB2 GLU 918 HB1 GLU 918 -18.266 -2.882 -22.276 504 HB3 GLU 918 HB2 GLU 918 -17.331 -1.619 -21.436 505 HG2 GLU 918 HG1 GLU 918 -19.050 0.040 -21.883 506 HG3 GLU 918 HG2 GLU 918 -19.927 -1.072 -22.932 507 H LEU 919 HN LEU 919 -14.975 -0.821 -22.855 508 HA LEU 919 HA LEU 919 -15.410 2.116 -23.016 509 HB2 LEU 919 HB1 LEU 919 -13.067 0.676 -21.746 510 HB3 LEU 919 HB2 LEU 919 -13.480 2.376 -21.646 511 HG LEU 919 HG LEU 919 -15.804 1.182 -20.687 512 HD11 LEU 919 HD11 LEU 919 -14.779 -1.044 -20.692 513 HD12 LEU 919 HD12 LEU 919 -13.435 -0.448 -19.708 514 HD13 LEU 919 HD13 LEU 919 -15.089 -0.473 -19.050 515 HD21 LEU 919 HD21 LEU 919 -14.907 1.818 -18.422 516 HD22 LEU 919 HD22 LEU 919 -13.325 2.129 -19.196 517 HD23 LEU 919 HD23 LEU 919 -14.724 3.091 -19.659 518 H GLY 920 HN GLY 920 -13.419 -0.515 -24.275 519 HA2 GLY 920 HA1 GLY 920 -12.373 -0.555 -26.417 520 HA3 GLY 920 HA2 GLY 920 -12.309 1.210 -26.450 521 H ILE 921 HN ILE 921 -11.305 -1.105 -23.914 522 HA ILE 921 HA ILE 921 -8.541 0.041 -23.920 523 HB ILE 921 HB ILE 921 -8.495 -0.279 -21.511 524 HG12 ILE 921 HG11 ILE 921 -11.453 -0.993 -21.666 525 HG13 ILE 921 HG12 ILE 921 -10.148 -2.152 -21.398 526 HG21 ILE 921 HG21 ILE 921 -9.161 1.884 -22.517 527 HG22 ILE 921 HG22 ILE 921 -10.867 1.434 -22.347 528 HG23 ILE 921 HG23 ILE 921 -9.846 1.639 -20.910 529 HD11 ILE 921 HD1 ILE 921 -9.505 -0.976 -19.316 530 HD12 ILE 921 HD2 ILE 921 -10.886 0.126 -19.536 531 HD13 ILE 921 HD3 ILE 921 -11.167 -1.605 -19.289 532 H GLY 922 HN GLY 922 -6.952 -1.360 -22.787 533 HA2 GLY 922 HA1 GLY 922 -6.902 -3.947 -24.185 534 HA3 GLY 922 HA2 GLY 922 -5.562 -3.103 -23.399 535 H GLN 923 HN GLN 923 -7.667 -3.103 -21.022 536 HA GLN 923 HA GLN 923 -6.128 -4.812 -19.457 537 HB2 GLN 923 HB1 GLN 923 -7.448 -3.029 -18.557 538 HB3 GLN 923 HB2 GLN 923 -8.954 -3.917 -18.878 539 HG2 GLN 923 HG1 GLN 923 -8.660 -5.356 -17.071 540 HG3 GLN 923 HG2 GLN 923 -6.896 -5.216 -17.126 541 HE21 GLN 923 HE21 GLN 923 -9.523 -2.655 -16.722 542 HE22 GLN 923 HE22 GLN 923 -8.696 -1.993 -15.336 543 H ASP 924 HN ASP 924 -6.270 -6.675 -18.573 544 HA ASP 924 HA ASP 924 -6.310 -8.933 -18.469 545 HB2 ASP 924 HB1 ASP 924 -9.266 -8.507 -18.963 546 HB3 ASP 924 HB2 ASP 924 -8.535 -10.043 -18.564 547 H GLU 925 HN GLU 925 -6.802 -7.552 -21.285 548 HA GLU 925 HA GLU 925 -6.183 -7.898 -23.424 549 HB2 GLU 925 HB1 GLU 925 -4.687 -10.267 -22.262 550 HB3 GLU 925 HB2 GLU 925 -4.440 -9.565 -23.861 551 HG2 GLU 925 HG1 GLU 925 -3.830 -7.393 -22.808 552 HG3 GLU 925 HG2 GLU 925 -4.072 -8.102 -21.209 553 H ALA 926 HN ALA 926 -7.282 -11.006 -22.172 554 HA ALA 926 HA ALA 926 -8.540 -11.713 -24.811 555 HB1 ALA 926 HB1 ALA 926 -6.677 -13.425 -23.121 556 HB2 ALA 926 HB2 ALA 926 -7.473 -13.918 -24.635 557 HB3 ALA 926 HB3 ALA 926 -6.243 -12.638 -24.660 558 H ASP 927 HN ASP 927 -8.272 -12.560 -21.366 559 HA ASP 927 HA ASP 927 -9.544 -13.695 -19.927 560 HB2 ASP 927 HB1 ASP 927 -11.185 -11.843 -20.632 561 HB3 ASP 927 HB2 ASP 927 -12.014 -13.084 -21.563 562 H ALA 928 HN ALA 928 -8.746 -14.930 -22.682 563 HA ALA 928 HA ALA 928 -10.373 -17.264 -23.062 564 HB1 ALA 928 HB1 ALA 928 -8.946 -16.296 -24.818 565 HB2 ALA 928 HB2 ALA 928 -7.490 -16.684 -23.870 566 HB3 ALA 928 HB3 ALA 928 -8.511 -17.987 -24.509 567 H1 ALA 1 HT1 ALA 1 -9.742 -2.974 -6.735 568 H2 ALA 1 HT2 ALA 1 -9.343 -1.471 -6.193 569 H3 ALA 1 HT3 ALA 1 -8.755 -2.810 -5.439 570 HA ALA 1 HA ALA 1 -7.013 -1.874 -6.713 571 HB1 ALA 1 HB1 ALA 1 -6.637 -3.874 -8.334 572 HB2 ALA 1 HB2 ALA 1 -6.801 -4.210 -6.609 573 HB3 ALA 1 HB3 ALA 1 -8.164 -4.505 -7.682 574 H ARG 2 HN ARG 2 -6.254 -1.914 -9.290 575 HA ARG 2 HA ARG 2 -7.418 0.500 -10.212 576 HB2 ARG 2 HB1 ARG 2 -5.985 0.417 -12.024 577 HB3 ARG 2 HB2 ARG 2 -5.083 -0.348 -10.741 578 HG2 ARG 2 HG1 ARG 2 -4.894 -2.308 -11.896 579 HG3 ARG 2 HG2 ARG 2 -6.564 -2.328 -12.430 580 HD2 ARG 2 HD1 ARG 2 -4.352 -0.636 -13.652 581 HD3 ARG 2 HD2 ARG 2 -4.983 -2.156 -14.304 582 HE ARG 2 HE ARG 2 -7.158 -0.311 -13.967 583 HH11 ARG 2 HH11 ARG 2 -4.441 -0.844 -16.103 584 HH12 ARG 2 HH12 ARG 2 -5.159 0.068 -17.401 585 HH21 ARG 2 HH21 ARG 2 -7.997 0.923 -15.645 586 HH22 ARG 2 HH22 ARG 2 -7.126 1.002 -17.148 587 H THR 3 HN THR 3 -8.576 1.014 -12.210 588 HA THR 3 HA THR 3 -10.189 -1.168 -13.361 589 HB THR 3 HB THR 3 -11.096 -0.714 -11.011 590 HG1 THR 3 HG1 THR 3 -12.582 -1.536 -12.354 591 HG21 THR 3 HG21 THR 3 -12.291 1.280 -10.486 592 HG22 THR 3 HG22 THR 3 -10.677 1.780 -10.993 593 HG23 THR 3 HG23 THR 3 -12.059 1.960 -12.105 594 H MLZ 4 HN MLZ 4 -12.437 0.374 -14.002 595 HA MLZ 4 HA MLZ 4 -11.497 2.094 -16.205 596 HB2 MLZ 4 HB1 MLZ 4 -12.580 0.656 -17.822 597 HB3 MLZ 4 HB2 MLZ 4 -11.381 -0.256 -16.967 598 HG2 MLZ 4 HG1 MLZ 4 -14.334 -0.411 -16.220 599 HG3 MLZ 4 HG2 MLZ 4 -13.683 -1.314 -17.570 600 HD2 MLZ 4 HD1 MLZ 4 -12.592 -1.650 -14.794 601 HD3 MLZ 4 HD2 MLZ 4 -13.883 -2.634 -15.454 602 HE2 MLZ 4 HE1 MLZ 4 -11.380 -2.344 -17.097 603 HE3 MLZ 4 HE2 MLZ 4 -11.278 -3.310 -15.599 604 HZ MLZ 4 HZ1 MLZ 4 -13.231 -3.807 -17.796 605 HCM1 MLZ 4 HC1 MLZ 4 -11.942 -5.796 -18.249 606 HCM2 MLZ 4 HC2 MLZ 4 -10.995 -4.333 -18.509 607 HCM3 MLZ 4 HC3 MLZ 4 -10.778 -5.293 -17.019 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.084 -4.704 -16.426 609 H GLN 5 HN GLN 5 -12.959 3.664 -16.812 610 HA GLN 5 HA GLN 5 -15.424 3.926 -15.129 611 HB2 GLN 5 HB1 GLN 5 -13.622 6.128 -16.197 612 HB3 GLN 5 HB2 GLN 5 -15.114 6.315 -15.259 613 HG2 GLN 5 HG1 GLN 5 -13.989 4.900 -13.438 614 HG3 GLN 5 HG2 GLN 5 -12.474 5.155 -14.303 615 HE21 GLN 5 HE21 GLN 5 -13.554 6.151 -11.576 616 HE22 GLN 5 HE22 GLN 5 -13.377 7.902 -11.688 617 H THR 6 HN THR 6 -16.915 3.052 -16.428 618 HA THR 6 HA THR 6 -16.953 3.121 -19.215 619 HB THR 6 HB THR 6 -19.575 2.598 -18.608 620 HG1 THR 6 HG1 THR 6 -19.219 2.830 -16.374 621 HG21 THR 6 HG21 THR 6 -18.894 0.242 -18.621 622 HG22 THR 6 HG22 THR 6 -18.045 1.152 -19.870 623 HG23 THR 6 HG23 THR 6 -17.197 0.713 -18.366 624 H ALA 7 HN ALA 7 -17.740 4.263 -20.764 625 HA ALA 7 HA ALA 7 -19.087 6.843 -20.229 626 HB1 ALA 7 HB1 ALA 7 -18.327 7.410 -22.489 627 HB2 ALA 7 HB2 ALA 7 -16.978 6.806 -21.513 628 HB3 ALA 7 HB3 ALA 7 -17.733 5.752 -22.730 629 H ARG 8 HN ARG 8 -20.481 4.127 -20.219 630 HA ARG 8 HA ARG 8 -22.752 4.712 -21.982 631 HB2 ARG 8 HB1 ARG 8 -21.268 2.033 -22.025 632 HB3 ARG 8 HB2 ARG 8 -22.895 2.310 -22.640 633 HG2 ARG 8 HG1 ARG 8 -21.775 2.566 -24.605 634 HG3 ARG 8 HG2 ARG 8 -21.750 4.234 -24.053 635 HD2 ARG 8 HD1 ARG 8 -19.410 3.435 -22.959 636 HD3 ARG 8 HD2 ARG 8 -19.548 2.185 -24.201 637 HE ARG 8 HE ARG 8 -19.992 4.888 -25.214 638 HH11 ARG 8 HH11 ARG 8 -17.428 2.563 -24.587 639 HH12 ARG 8 HH12 ARG 8 -16.283 3.461 -25.556 640 HH21 ARG 8 HH21 ARG 8 -18.504 5.906 -26.491 641 HH22 ARG 8 HH22 ARG 8 -16.892 5.271 -26.629 642 H TYR 9 HN TYR 9 -24.356 4.746 -20.781 643 HA TYR 9 HA TYR 9 -24.942 2.969 -18.500 644 HB2 TYR 9 HB1 TYR 9 -25.364 5.239 -17.182 645 HB3 TYR 9 HB2 TYR 9 -23.829 4.417 -17.164 646 HD1 TYR 9 HD1 TYR 9 -21.835 5.528 -17.748 647 HD2 TYR 9 HD2 TYR 9 -25.638 7.203 -18.913 648 HE1 TYR 9 HE1 TYR 9 -20.684 7.583 -18.535 649 HE2 TYR 9 HE2 TYR 9 -24.477 9.267 -19.708 650 HH TYR 9 HH TYR 9 -20.923 9.661 -19.485 Start of MODEL 5 1 H1 GLY 850 HT1 GLY 850 5.943 -7.535 -10.463 2 H2 GLY 850 HT2 GLY 850 7.123 -6.751 -11.287 3 H3 GLY 850 HT3 GLY 850 5.639 -6.940 -11.958 4 HA2 GLY 850 HA1 GLY 850 6.227 -5.326 -9.560 5 HA3 GLY 850 HA2 GLY 850 5.935 -4.670 -11.181 6 H SER 851 HN SER 851 4.469 -4.527 -8.481 7 HA SER 851 HA SER 851 2.023 -5.984 -8.714 8 HB2 SER 851 HB1 SER 851 2.716 -3.675 -6.869 9 HB3 SER 851 HB2 SER 851 1.420 -4.868 -6.643 10 HG SER 851 HG1 SER 851 3.310 -5.409 -5.453 11 H ARG 852 HN ARG 852 1.971 -4.684 -11.088 12 HA ARG 852 HA ARG 852 0.683 -2.111 -11.183 13 HB2 ARG 852 HB1 ARG 852 1.066 -4.381 -13.166 14 HB3 ARG 852 HB2 ARG 852 0.021 -3.028 -13.565 15 HG2 ARG 852 HG1 ARG 852 2.162 -2.603 -14.503 16 HG3 ARG 852 HG2 ARG 852 1.848 -1.424 -13.231 17 HD2 ARG 852 HD1 ARG 852 3.358 -2.658 -11.700 18 HD3 ARG 852 HD2 ARG 852 3.580 -3.911 -12.927 19 HE ARG 852 HE ARG 852 5.010 -2.535 -14.135 20 HH11 ARG 852 HH11 ARG 852 3.628 -0.566 -11.576 21 HH12 ARG 852 HH12 ARG 852 4.764 0.726 -11.847 22 HH21 ARG 852 HH21 ARG 852 6.415 -0.849 -14.416 23 HH22 ARG 852 HH22 ARG 852 6.291 0.567 -13.413 24 H ARG 853 HN ARG 853 -0.720 -5.128 -10.406 25 HA ARG 853 HA ARG 853 -3.487 -4.655 -11.042 26 HB2 ARG 853 HB1 ARG 853 -2.130 -6.226 -8.800 27 HB3 ARG 853 HB2 ARG 853 -3.867 -6.260 -9.119 28 HG2 ARG 853 HG1 ARG 853 -3.485 -7.170 -11.364 29 HG3 ARG 853 HG2 ARG 853 -1.732 -7.094 -11.137 30 HD2 ARG 853 HD1 ARG 853 -1.792 -8.714 -9.362 31 HD3 ARG 853 HD2 ARG 853 -3.563 -8.705 -9.324 32 HE ARG 853 HE ARG 853 -3.276 -9.494 -11.836 33 HH11 ARG 853 HH11 ARG 853 -1.385 -10.693 -9.125 34 HH12 ARG 853 HH12 ARG 853 -1.191 -12.259 -9.863 35 HH21 ARG 853 HH21 ARG 853 -3.058 -11.485 -12.663 36 HH22 ARG 853 HH22 ARG 853 -2.095 -12.689 -11.835 37 H ALA 854 HN ALA 854 -1.478 -3.499 -8.349 38 HA ALA 854 HA ALA 854 -3.815 -2.179 -7.089 39 HB1 ALA 854 HB1 ALA 854 -2.288 -3.376 -5.603 40 HB2 ALA 854 HB2 ALA 854 -0.932 -2.358 -6.158 41 HB3 ALA 854 HB3 ALA 854 -2.302 -1.624 -5.285 42 H SER 855 HN SER 855 -3.859 -0.009 -6.625 43 HA SER 855 HA SER 855 -2.096 2.021 -7.384 44 HB2 SER 855 HB1 SER 855 -3.182 3.053 -9.263 45 HB3 SER 855 HB2 SER 855 -2.684 1.429 -9.685 46 HG SER 855 HG1 SER 855 -4.945 2.319 -10.194 47 H VAL 856 HN VAL 856 -3.306 4.167 -7.501 48 HA VAL 856 HA VAL 856 -5.164 4.618 -5.317 49 HB VAL 856 HB VAL 856 -5.303 6.923 -6.231 50 HG11 VAL 856 HG11 VAL 856 -2.474 5.863 -5.912 51 HG12 VAL 856 HG12 VAL 856 -3.015 7.543 -5.712 52 HG13 VAL 856 HG13 VAL 856 -3.598 6.293 -4.602 53 HG21 VAL 856 HG21 VAL 856 -3.893 7.657 -8.051 54 HG22 VAL 856 HG22 VAL 856 -3.294 6.013 -8.334 55 HG23 VAL 856 HG23 VAL 856 -4.998 6.413 -8.652 56 H GLY 857 HN GLY 857 -7.204 5.914 -5.678 57 HA2 GLY 857 HA1 GLY 857 -9.087 4.507 -7.450 58 HA3 GLY 857 HA2 GLY 857 -9.430 5.783 -6.284 59 H SER 858 HN SER 858 -10.488 7.208 -7.471 60 HA SER 858 HA SER 858 -9.207 8.727 -9.630 61 HB2 SER 858 HB1 SER 858 -10.938 8.207 -11.294 62 HB3 SER 858 HB2 SER 858 -10.025 6.764 -10.829 63 HG SER 858 HG1 SER 858 -11.739 6.124 -9.518 64 H GLU 859 HN GLU 859 -10.642 10.477 -10.477 65 HA GLU 859 HA GLU 859 -12.342 11.735 -8.463 66 HB2 GLU 859 HB1 GLU 859 -12.714 13.451 -10.087 67 HB3 GLU 859 HB2 GLU 859 -10.990 13.080 -10.020 68 HG2 GLU 859 HG1 GLU 859 -11.284 11.645 -12.080 69 HG3 GLU 859 HG2 GLU 859 -12.948 12.230 -12.190 70 H PHE 860 HN PHE 860 -14.590 12.125 -8.756 71 HA PHE 860 HA PHE 860 -15.907 9.741 -8.646 72 HB2 PHE 860 HB1 PHE 860 -17.147 12.462 -9.209 73 HB3 PHE 860 HB2 PHE 860 -18.003 11.063 -8.594 74 HD1 PHE 860 HD1 PHE 860 -15.836 13.878 -7.732 75 HD2 PHE 860 HD2 PHE 860 -17.464 10.150 -6.302 76 HE1 PHE 860 HE1 PHE 860 -15.233 14.502 -5.406 77 HE2 PHE 860 HE2 PHE 860 -16.869 10.780 -3.976 78 HZ PHE 860 HZ PHE 860 -15.745 12.955 -3.525 79 H THR 861 HN THR 861 -16.143 11.953 -11.451 80 HA THR 861 HA THR 861 -16.903 11.640 -13.619 81 HB THR 861 HB THR 861 -16.116 8.780 -13.226 82 HG1 THR 861 HG1 THR 861 -14.443 10.074 -12.610 83 HG21 THR 861 HG21 THR 861 -15.265 9.124 -15.648 84 HG22 THR 861 HG22 THR 861 -16.974 8.825 -15.425 85 HG23 THR 861 HG23 THR 861 -16.391 10.493 -15.710 86 H GLU 862 HN GLU 862 -18.430 9.702 -14.951 87 HA GLU 862 HA GLU 862 -20.943 9.409 -13.407 88 HB2 GLU 862 HB1 GLU 862 -20.785 9.961 -15.910 89 HB3 GLU 862 HB2 GLU 862 -20.376 8.247 -16.136 90 HG2 GLU 862 HG1 GLU 862 -22.505 7.553 -15.271 91 HG3 GLU 862 HG2 GLU 862 -22.822 9.135 -14.570 92 H SER 863 HN SER 863 -21.901 7.102 -13.464 93 HA SER 863 HA SER 863 -20.537 5.510 -11.656 94 HB2 SER 863 HB1 SER 863 -22.672 4.641 -13.627 95 HB3 SER 863 HB2 SER 863 -22.223 3.794 -12.131 96 HG SER 863 HG1 SER 863 -24.057 5.261 -11.926 97 H ALA 864 HN ALA 864 -19.328 3.651 -11.642 98 HA ALA 864 HA ALA 864 -17.913 2.965 -14.185 99 HB1 ALA 864 HB1 ALA 864 -16.745 4.355 -11.740 100 HB2 ALA 864 HB2 ALA 864 -15.765 3.668 -13.048 101 HB3 ALA 864 HB3 ALA 864 -16.867 5.017 -13.384 102 H TRP 865 HN TRP 865 -15.917 1.423 -13.584 103 HA TRP 865 HA TRP 865 -17.108 -0.738 -11.920 104 HB2 TRP 865 HB1 TRP 865 -14.664 -0.739 -13.704 105 HB3 TRP 865 HB2 TRP 865 -15.303 -2.134 -12.845 106 HD1 TRP 865 HD1 TRP 865 -16.220 0.258 -15.675 107 HE1 TRP 865 HE1 TRP 865 -17.905 -0.808 -17.226 108 HE3 TRP 865 HE3 TRP 865 -17.001 -4.071 -13.111 109 HZ2 TRP 865 HZ2 TRP 865 -19.717 -3.129 -17.157 110 HZ3 TRP 865 HZ3 TRP 865 -18.638 -5.784 -13.950 111 HH2 TRP 865 HH2 TRP 865 -20.013 -5.293 -15.937 112 H VAL 866 HN VAL 866 -15.723 -2.050 -10.595 113 HA VAL 866 HA VAL 866 -13.259 -0.859 -9.522 114 HB VAL 866 HB VAL 866 -14.828 -0.215 -7.799 115 HG11 VAL 866 HG11 VAL 866 -16.184 -1.789 -6.552 116 HG12 VAL 866 HG12 VAL 866 -16.618 -1.927 -8.255 117 HG13 VAL 866 HG13 VAL 866 -15.591 -3.162 -7.509 118 HG21 VAL 866 HG21 VAL 866 -13.845 -1.222 -5.890 119 HG22 VAL 866 HG22 VAL 866 -13.308 -2.631 -6.794 120 HG23 VAL 866 HG23 VAL 866 -12.584 -1.031 -7.114 121 H ARG 867 HN ARG 867 -11.695 -2.363 -9.115 122 HA ARG 867 HA ARG 867 -12.154 -5.185 -9.922 123 HB2 ARG 867 HB1 ARG 867 -10.103 -3.533 -10.536 124 HB3 ARG 867 HB2 ARG 867 -9.529 -4.000 -8.955 125 HG2 ARG 867 HG1 ARG 867 -9.724 -6.404 -9.643 126 HG3 ARG 867 HG2 ARG 867 -10.144 -5.888 -11.290 127 HD2 ARG 867 HD1 ARG 867 -8.050 -5.250 -11.801 128 HD3 ARG 867 HD2 ARG 867 -7.698 -4.605 -10.203 129 HE ARG 867 HE ARG 867 -7.559 -7.053 -9.434 130 HH11 ARG 867 HH11 ARG 867 -6.515 -6.187 -12.687 131 HH12 ARG 867 HH12 ARG 867 -5.567 -7.673 -12.795 132 HH21 ARG 867 HH21 ARG 867 -6.363 -8.916 -9.771 133 HH22 ARG 867 HH22 ARG 867 -5.511 -9.062 -11.304 134 H CYS 868 HN CYS 868 -12.094 -6.895 -8.457 135 HA CYS 868 HA CYS 868 -11.938 -6.512 -5.619 136 HB2 CYS 868 HB1 CYS 868 -13.137 -8.356 -6.673 137 HB3 CYS 868 HB2 CYS 868 -11.635 -8.972 -7.367 138 H ASP 869 HN ASP 869 -10.234 -6.057 -4.432 139 HA ASP 869 HA ASP 869 -7.471 -6.314 -5.277 140 HB2 ASP 869 HB1 ASP 869 -8.820 -5.681 -2.624 141 HB3 ASP 869 HB2 ASP 869 -7.071 -5.704 -2.825 142 H ASP 870 HN ASP 870 -9.572 -8.757 -4.108 143 HA ASP 870 HA ASP 870 -7.320 -10.304 -2.905 144 HB2 ASP 870 HB1 ASP 870 -9.480 -10.041 -1.644 145 HB3 ASP 870 HB2 ASP 870 -10.270 -10.998 -2.896 146 H CYS 871 HN CYS 871 -9.508 -10.268 -5.680 147 HA CYS 871 HA CYS 871 -7.763 -12.300 -6.913 148 HB2 CYS 871 HB1 CYS 871 -9.444 -13.569 -7.832 149 HB3 CYS 871 HB2 CYS 871 -9.820 -13.411 -6.137 150 H PHE 872 HN PHE 872 -10.410 -10.878 -8.506 151 HA PHE 872 HA PHE 872 -9.121 -8.615 -9.724 152 HB2 PHE 872 HB1 PHE 872 -8.872 -9.321 -11.984 153 HB3 PHE 872 HB2 PHE 872 -7.963 -10.442 -10.995 154 HD1 PHE 872 HD1 PHE 872 -11.016 -10.049 -13.084 155 HD2 PHE 872 HD2 PHE 872 -8.602 -12.800 -10.803 156 HE1 PHE 872 HE1 PHE 872 -12.306 -11.961 -14.020 157 HE2 PHE 872 HE2 PHE 872 -9.865 -14.706 -11.772 158 HZ PHE 872 HZ PHE 872 -11.719 -14.287 -13.376 159 H LYS 873 HN LYS 873 -11.824 -10.741 -9.475 160 HA LYS 873 HA LYS 873 -13.683 -10.224 -11.268 161 HB2 LYS 873 HB1 LYS 873 -13.646 -11.024 -8.546 162 HB3 LYS 873 HB2 LYS 873 -14.856 -9.767 -8.625 163 HG2 LYS 873 HG1 LYS 873 -14.924 -12.011 -10.634 164 HG3 LYS 873 HG2 LYS 873 -15.477 -12.269 -8.964 165 HD2 LYS 873 HD1 LYS 873 -16.486 -9.929 -10.556 166 HD3 LYS 873 HD2 LYS 873 -17.236 -11.530 -10.705 167 HE2 LYS 873 HE1 LYS 873 -16.742 -10.211 -8.016 168 HE3 LYS 873 HE2 LYS 873 -18.195 -9.833 -8.966 169 HZ1 LYS 873 HZ1 LYS 873 -18.645 -11.580 -7.408 170 HZ2 LYS 873 HZ2 LYS 873 -18.722 -12.190 -8.939 171 HZ3 LYS 873 HZ3 LYS 873 -17.426 -12.520 -7.957 172 H TRP 874 HN TRP 874 -14.998 -8.733 -12.045 173 HA TRP 874 HA TRP 874 -14.613 -5.939 -11.089 174 HB2 TRP 874 HB1 TRP 874 -15.603 -6.891 -13.806 175 HB3 TRP 874 HB2 TRP 874 -15.191 -5.263 -13.342 176 HD1 TRP 874 HD1 TRP 874 -13.547 -8.509 -14.362 177 HE1 TRP 874 HE1 TRP 874 -11.030 -8.113 -14.775 178 HE3 TRP 874 HE3 TRP 874 -13.110 -3.797 -12.420 179 HZ2 TRP 874 HZ2 TRP 874 -9.147 -5.994 -14.486 180 HZ3 TRP 874 HZ3 TRP 874 -10.844 -2.697 -12.446 181 HH2 TRP 874 HH2 TRP 874 -8.969 -3.692 -13.530 182 H ARG 875 HN ARG 875 -16.344 -4.557 -10.781 183 HA ARG 875 HA ARG 875 -19.136 -5.459 -11.199 184 HB2 ARG 875 HB1 ARG 875 -18.017 -4.625 -8.484 185 HB3 ARG 875 HB2 ARG 875 -19.727 -4.551 -8.864 186 HG2 ARG 875 HG1 ARG 875 -18.018 -7.072 -8.802 187 HG3 ARG 875 HG2 ARG 875 -19.171 -6.568 -7.594 188 HD2 ARG 875 HD1 ARG 875 -19.773 -7.475 -10.416 189 HD3 ARG 875 HD2 ARG 875 -20.166 -8.306 -8.913 190 HE ARG 875 HE ARG 875 -21.524 -5.908 -8.654 191 HH11 ARG 875 HH11 ARG 875 -21.695 -8.450 -11.021 192 HH12 ARG 875 HH12 ARG 875 -23.154 -7.800 -11.740 193 HH21 ARG 875 HH21 ARG 875 -23.509 -5.324 -9.462 194 HH22 ARG 875 HH22 ARG 875 -24.007 -5.962 -11.035 195 H ARG 876 HN ARG 876 -20.447 -3.820 -11.815 196 HA ARG 876 HA ARG 876 -19.303 -1.100 -12.087 197 HB2 ARG 876 HB1 ARG 876 -20.818 -2.597 -13.799 198 HB3 ARG 876 HB2 ARG 876 -22.065 -1.592 -13.072 199 HG2 ARG 876 HG1 ARG 876 -19.446 -0.535 -14.237 200 HG3 ARG 876 HG2 ARG 876 -20.909 -0.706 -15.195 201 HD2 ARG 876 HD1 ARG 876 -20.847 0.963 -12.664 202 HD3 ARG 876 HD2 ARG 876 -20.287 1.598 -14.204 203 HE ARG 876 HE ARG 876 -23.082 0.640 -13.666 204 HH11 ARG 876 HH11 ARG 876 -21.039 2.913 -15.436 205 HH12 ARG 876 HH12 ARG 876 -22.321 3.318 -16.537 206 HH21 ARG 876 HH21 ARG 876 -24.692 1.368 -15.022 207 HH22 ARG 876 HH22 ARG 876 -24.325 2.557 -16.236 208 H ILE 877 HN ILE 877 -19.546 0.354 -10.697 209 HA ILE 877 HA ILE 877 -21.678 0.272 -8.605 210 HB ILE 877 HB ILE 877 -20.031 1.108 -7.031 211 HG12 ILE 877 HG11 ILE 877 -18.006 1.027 -9.300 212 HG13 ILE 877 HG12 ILE 877 -18.648 2.482 -8.545 213 HG21 ILE 877 HG21 ILE 877 -18.744 -0.895 -6.732 214 HG22 ILE 877 HG22 ILE 877 -20.276 -1.371 -7.467 215 HG23 ILE 877 HG23 ILE 877 -18.809 -1.267 -8.468 216 HD11 ILE 877 HD1 ILE 877 -16.433 2.015 -7.702 217 HD12 ILE 877 HD2 ILE 877 -17.618 1.845 -6.399 218 HD13 ILE 877 HD3 ILE 877 -16.929 0.409 -7.158 219 HA PRO 878 HA PRO 878 -22.320 4.553 -9.719 220 HB2 PRO 878 HB1 PRO 878 -23.124 5.742 -7.368 221 HB3 PRO 878 HB2 PRO 878 -24.167 4.619 -8.298 222 HG2 PRO 878 HG1 PRO 878 -22.398 3.979 -5.917 223 HG3 PRO 878 HG2 PRO 878 -24.115 3.528 -6.167 224 HD2 PRO 878 HD1 PRO 878 -22.083 1.804 -6.712 225 HD3 PRO 878 HD2 PRO 878 -23.540 1.863 -7.744 226 H ALA 879 HN ALA 879 -21.212 6.381 -9.823 227 HA ALA 879 HA ALA 879 -18.550 6.699 -9.251 228 HB1 ALA 879 HB1 ALA 879 -20.822 8.743 -9.467 229 HB2 ALA 879 HB2 ALA 879 -19.113 9.170 -9.554 230 HB3 ALA 879 HB3 ALA 879 -19.813 8.104 -10.789 231 H SER 880 HN SER 880 -21.188 7.444 -7.005 232 HA SER 880 HA SER 880 -19.847 8.995 -5.066 233 HB2 SER 880 HB1 SER 880 -21.988 6.886 -4.581 234 HB3 SER 880 HB2 SER 880 -21.626 8.284 -3.556 235 HG SER 880 HG1 SER 880 -22.375 9.644 -5.186 236 H VAL 881 HN VAL 881 -19.647 5.516 -5.685 237 HA VAL 881 HA VAL 881 -17.944 5.169 -3.262 238 HB VAL 881 HB VAL 881 -18.916 2.959 -5.085 239 HG11 VAL 881 HG11 VAL 881 -18.416 1.502 -3.161 240 HG12 VAL 881 HG12 VAL 881 -16.964 2.403 -3.585 241 HG13 VAL 881 HG13 VAL 881 -17.923 2.908 -2.192 242 HG21 VAL 881 HG21 VAL 881 -20.904 3.999 -4.106 243 HG22 VAL 881 HG22 VAL 881 -20.595 2.446 -3.335 244 HG23 VAL 881 HG23 VAL 881 -20.163 3.950 -2.493 245 H VAL 882 HN VAL 882 -17.767 5.210 -6.810 246 HA VAL 882 HA VAL 882 -15.144 4.054 -6.844 247 HB VAL 882 HB VAL 882 -16.792 4.518 -8.847 248 HG11 VAL 882 HG11 VAL 882 -14.765 6.752 -9.297 249 HG12 VAL 882 HG12 VAL 882 -16.112 6.271 -10.338 250 HG13 VAL 882 HG13 VAL 882 -16.429 7.045 -8.780 251 HG21 VAL 882 HG21 VAL 882 -14.891 4.075 -10.377 252 HG22 VAL 882 HG22 VAL 882 -13.750 4.526 -9.100 253 HG23 VAL 882 HG23 VAL 882 -14.777 3.094 -8.914 254 H GLY 883 HN GLY 883 -16.185 7.274 -6.108 255 HA2 GLY 883 HA1 GLY 883 -13.471 8.425 -5.993 256 HA3 GLY 883 HA2 GLY 883 -14.977 9.181 -5.478 257 H SER 884 HN SER 884 -15.387 6.497 -3.863 258 HA SER 884 HA SER 884 -14.037 7.395 -1.371 259 HB2 SER 884 HB1 SER 884 -16.473 6.963 -1.358 260 HB3 SER 884 HB2 SER 884 -16.167 5.278 -1.825 261 HG SER 884 HG1 SER 884 -16.432 5.584 0.464 262 H ILE 885 HN ILE 885 -14.254 4.578 -3.532 263 HA ILE 885 HA ILE 885 -12.282 2.892 -2.292 264 HB ILE 885 HB ILE 885 -13.423 3.227 -5.058 265 HG12 ILE 885 HG11 ILE 885 -13.454 0.586 -3.543 266 HG13 ILE 885 HG12 ILE 885 -14.507 1.895 -2.960 267 HG21 ILE 885 HG21 ILE 885 -11.152 2.498 -5.539 268 HG22 ILE 885 HG22 ILE 885 -11.296 1.180 -4.327 269 HG23 ILE 885 HG23 ILE 885 -12.274 1.170 -5.801 270 HD11 ILE 885 HD1 ILE 885 -15.676 0.531 -4.649 271 HD12 ILE 885 HD2 ILE 885 -15.430 2.193 -5.219 272 HD13 ILE 885 HD3 ILE 885 -14.395 0.915 -5.822 273 H ASP 886 HN ASP 886 -10.175 2.624 -2.809 274 HA ASP 886 HA ASP 886 -8.496 4.434 -4.236 275 HB2 ASP 886 HB1 ASP 886 -9.442 5.815 -2.111 276 HB3 ASP 886 HB2 ASP 886 -8.211 4.927 -1.262 277 H GLU 887 HN GLU 887 -6.130 4.339 -3.343 278 HA GLU 887 HA GLU 887 -5.262 1.608 -2.932 279 HB2 GLU 887 HB1 GLU 887 -3.928 3.364 -4.054 280 HB3 GLU 887 HB2 GLU 887 -3.781 4.247 -2.537 281 HG2 GLU 887 HG1 GLU 887 -2.443 2.474 -1.564 282 HG3 GLU 887 HG2 GLU 887 -2.794 1.392 -2.916 283 H SER 888 HN SER 888 -6.174 4.211 -0.718 284 HA SER 888 HA SER 888 -5.071 2.913 1.683 285 HB2 SER 888 HB1 SER 888 -6.182 4.742 2.868 286 HB3 SER 888 HB2 SER 888 -5.190 5.351 1.531 287 HG SER 888 HG1 SER 888 -7.267 6.340 1.592 288 H SER 889 HN SER 889 -7.948 2.675 -0.195 289 HA SER 889 HA SER 889 -9.557 1.326 1.901 290 HB2 SER 889 HB1 SER 889 -10.566 2.937 0.214 291 HB3 SER 889 HB2 SER 889 -10.181 1.743 -1.038 292 HG SER 889 HG1 SER 889 -12.030 1.581 1.097 293 H ARG 890 HN ARG 890 -10.683 -0.724 0.828 294 HA ARG 890 HA ARG 890 -9.026 -2.313 -0.953 295 HB2 ARG 890 HB1 ARG 890 -8.007 -2.813 1.270 296 HB3 ARG 890 HB2 ARG 890 -9.561 -3.466 1.807 297 HG2 ARG 890 HG1 ARG 890 -9.458 -5.144 -0.048 298 HG3 ARG 890 HG2 ARG 890 -7.892 -4.491 -0.543 299 HD2 ARG 890 HD1 ARG 890 -8.504 -5.712 2.180 300 HD3 ARG 890 HD2 ARG 890 -7.753 -6.576 0.826 301 HE ARG 890 HE ARG 890 -6.187 -4.279 1.248 302 HH11 ARG 890 HH11 ARG 890 -6.937 -7.170 3.078 303 HH12 ARG 890 HH12 ARG 890 -5.429 -7.120 3.949 304 HH21 ARG 890 HH21 ARG 890 -4.286 -4.270 2.399 305 HH22 ARG 890 HH22 ARG 890 -3.971 -5.519 3.567 306 H TRP 891 HN TRP 891 -10.610 -2.510 -2.392 307 HA TRP 891 HA TRP 891 -13.363 -3.226 -1.568 308 HB2 TRP 891 HB1 TRP 891 -12.789 -1.469 -3.309 309 HB3 TRP 891 HB2 TRP 891 -12.460 -2.816 -4.392 310 HD1 TRP 891 HD1 TRP 891 -15.172 -0.859 -2.755 311 HE1 TRP 891 HE1 TRP 891 -17.500 -1.615 -3.529 312 HE3 TRP 891 HE3 TRP 891 -13.853 -5.153 -5.247 313 HZ2 TRP 891 HZ2 TRP 891 -18.665 -3.887 -4.848 314 HZ3 TRP 891 HZ3 TRP 891 -15.645 -6.622 -6.211 315 HH2 TRP 891 HH2 TRP 891 -18.009 -6.024 -5.948 316 H ILE 892 HN ILE 892 -14.039 -5.373 -1.629 317 HA ILE 892 HA ILE 892 -12.838 -7.235 -3.600 318 HB ILE 892 HB ILE 892 -12.623 -9.012 -1.969 319 HG12 ILE 892 HG11 ILE 892 -13.150 -7.022 0.262 320 HG13 ILE 892 HG12 ILE 892 -14.402 -8.078 -0.390 321 HG21 ILE 892 HG21 ILE 892 -10.607 -8.274 -0.805 322 HG22 ILE 892 HG22 ILE 892 -10.655 -7.565 -2.423 323 HG23 ILE 892 HG23 ILE 892 -11.064 -6.580 -1.002 324 HD11 ILE 892 HD1 ILE 892 -11.853 -9.163 0.822 325 HD12 ILE 892 HD2 ILE 892 -13.430 -9.049 1.616 326 HD13 ILE 892 HD3 ILE 892 -13.250 -10.072 0.170 327 H CYS 893 HN CYS 893 -14.123 -9.204 -3.962 328 HA CYS 893 HA CYS 893 -16.816 -8.845 -4.351 329 HB2 CYS 893 HB1 CYS 893 -15.467 -11.496 -3.699 330 HB3 CYS 893 HB2 CYS 893 -17.003 -11.222 -4.541 331 H MET 894 HN MET 894 -15.350 -10.175 -1.279 332 HA MET 894 HA MET 894 -17.895 -10.984 -0.201 333 HB2 MET 894 HB1 MET 894 -15.339 -10.267 1.268 334 HB3 MET 894 HB2 MET 894 -16.704 -11.098 1.976 335 HG2 MET 894 HG1 MET 894 -15.725 -12.439 -0.475 336 HG3 MET 894 HG2 MET 894 -14.493 -12.272 0.768 337 HE1 MET 894 HE1 MET 894 -18.431 -12.782 1.357 338 HE2 MET 894 HE2 MET 894 -18.026 -13.676 -0.126 339 HE3 MET 894 HE3 MET 894 -18.489 -14.556 1.347 340 H ASN 895 HN ASN 895 -16.444 -7.860 -0.461 341 HA ASN 895 HA ASN 895 -18.142 -6.581 1.596 342 HB2 ASN 895 HB1 ASN 895 -16.370 -5.260 1.782 343 HB3 ASN 895 HB2 ASN 895 -15.547 -6.108 0.488 344 HD21 ASN 895 HD21 ASN 895 -16.255 -5.372 -1.833 345 HD22 ASN 895 HD22 ASN 895 -16.380 -3.622 -1.996 346 H ASN 896 HN ASN 896 -18.425 -7.418 -1.676 347 HA ASN 896 HA ASN 896 -19.499 -5.197 -2.936 348 HB2 ASN 896 HB1 ASN 896 -18.867 -7.344 -4.038 349 HB3 ASN 896 HB2 ASN 896 -20.303 -8.098 -3.343 350 HD21 ASN 896 HD21 ASN 896 -20.579 -8.635 -5.689 351 HD22 ASN 896 HD22 ASN 896 -21.603 -7.494 -6.547 352 H SER 897 HN SER 897 -21.304 -4.133 -2.998 353 HA SER 897 HA SER 897 -23.483 -4.302 -1.137 354 HB2 SER 897 HB1 SER 897 -23.056 -2.964 -3.835 355 HB3 SER 897 HB2 SER 897 -24.612 -2.907 -3.023 356 HG SER 897 HG1 SER 897 -22.098 -1.972 -2.013 357 H ASP 898 HN ASP 898 -23.064 -5.602 -4.389 358 HA ASP 898 HA ASP 898 -25.862 -6.530 -4.533 359 HB2 ASP 898 HB1 ASP 898 -23.726 -7.078 -6.577 360 HB3 ASP 898 HB2 ASP 898 -25.469 -7.107 -6.775 361 H LYS 899 HN LYS 899 -26.119 -8.068 -3.116 362 HA LYS 899 HA LYS 899 -24.403 -10.156 -2.336 363 HB2 LYS 899 HB1 LYS 899 -27.449 -10.038 -2.223 364 HB3 LYS 899 HB2 LYS 899 -26.434 -11.157 -1.318 365 HG2 LYS 899 HG1 LYS 899 -25.992 -8.173 -1.022 366 HG3 LYS 899 HG2 LYS 899 -27.313 -8.960 -0.165 367 HD2 LYS 899 HD1 LYS 899 -24.493 -10.042 -0.021 368 HD3 LYS 899 HD2 LYS 899 -25.075 -8.754 1.067 369 HE2 LYS 899 HE1 LYS 899 -26.927 -10.218 1.812 370 HE3 LYS 899 HE2 LYS 899 -26.370 -11.496 0.731 371 HZ1 LYS 899 HZ1 LYS 899 -25.565 -11.840 3.001 372 HZ2 LYS 899 HZ2 LYS 899 -24.290 -11.583 2.015 373 HZ3 LYS 899 HZ3 LYS 899 -24.809 -10.396 3.013 374 H ARG 900 HN ARG 900 -26.179 -9.977 -5.203 375 HA ARG 900 HA ARG 900 -26.409 -12.808 -5.925 376 HB2 ARG 900 HB1 ARG 900 -26.477 -10.160 -7.428 377 HB3 ARG 900 HB2 ARG 900 -26.568 -11.714 -8.259 378 HG2 ARG 900 HG1 ARG 900 -28.607 -12.301 -6.967 379 HG3 ARG 900 HG2 ARG 900 -28.507 -10.764 -6.099 380 HD2 ARG 900 HD1 ARG 900 -30.155 -10.537 -7.858 381 HD3 ARG 900 HD2 ARG 900 -28.766 -9.528 -8.232 382 HE ARG 900 HE ARG 900 -28.265 -10.841 -10.088 383 HH11 ARG 900 HH11 ARG 900 -30.786 -12.502 -8.304 384 HH12 ARG 900 HH12 ARG 900 -31.078 -13.632 -9.598 385 HH21 ARG 900 HH21 ARG 900 -28.688 -12.314 -11.688 386 HH22 ARG 900 HH22 ARG 900 -29.919 -13.520 -11.460 387 H PHE 901 HN PHE 901 -23.824 -10.480 -5.982 388 HA PHE 901 HA PHE 901 -22.060 -12.402 -7.443 389 HB2 PHE 901 HB1 PHE 901 -21.943 -9.383 -7.742 390 HB3 PHE 901 HB2 PHE 901 -21.128 -10.581 -8.724 391 HD1 PHE 901 HD1 PHE 901 -22.264 -11.548 -10.682 392 HD2 PHE 901 HD2 PHE 901 -24.331 -8.878 -8.014 393 HE1 PHE 901 HE1 PHE 901 -24.110 -11.363 -12.309 394 HE2 PHE 901 HE2 PHE 901 -26.169 -8.655 -9.666 395 HZ PHE 901 HZ PHE 901 -26.071 -9.916 -11.810 396 H ALA 902 HN ALA 902 -22.383 -11.606 -4.500 397 HA ALA 902 HA ALA 902 -19.938 -10.129 -3.896 398 HB1 ALA 902 HB1 ALA 902 -20.976 -9.862 -1.665 399 HB2 ALA 902 HB2 ALA 902 -22.140 -9.434 -2.925 400 HB3 ALA 902 HB3 ALA 902 -22.253 -11.013 -2.103 401 H ASP 903 HN ASP 903 -19.386 -12.622 -4.877 402 HA ASP 903 HA ASP 903 -17.600 -13.551 -2.734 403 HB2 ASP 903 HB1 ASP 903 -19.214 -15.486 -4.371 404 HB3 ASP 903 HB2 ASP 903 -18.004 -15.886 -3.159 405 H CYS 904 HN CYS 904 -15.624 -14.271 -3.495 406 HA CYS 904 HA CYS 904 -14.700 -13.630 -6.081 407 HB2 CYS 904 HB1 CYS 904 -13.666 -15.564 -3.950 408 HB3 CYS 904 HB2 CYS 904 -12.748 -15.023 -5.355 409 H SER 905 HN SER 905 -16.672 -16.236 -5.112 410 HA SER 905 HA SER 905 -15.927 -18.118 -7.287 411 HB2 SER 905 HB1 SER 905 -18.078 -18.328 -5.153 412 HB3 SER 905 HB2 SER 905 -17.555 -19.604 -6.265 413 HG SER 905 HG1 SER 905 -15.538 -19.628 -5.250 414 H LYS 906 HN LYS 906 -18.252 -15.572 -6.625 415 HA LYS 906 HA LYS 906 -20.250 -16.545 -8.560 416 HB2 LYS 906 HB1 LYS 906 -19.911 -13.989 -6.966 417 HB3 LYS 906 HB2 LYS 906 -21.200 -14.229 -8.174 418 HG2 LYS 906 HG1 LYS 906 -20.932 -15.624 -5.543 419 HG3 LYS 906 HG2 LYS 906 -22.155 -14.474 -6.068 420 HD2 LYS 906 HD1 LYS 906 -21.683 -17.290 -7.092 421 HD3 LYS 906 HD2 LYS 906 -23.013 -16.754 -6.056 422 HE2 LYS 906 HE1 LYS 906 -23.793 -15.274 -7.938 423 HE3 LYS 906 HE2 LYS 906 -22.533 -15.965 -8.961 424 HZ1 LYS 906 HZ1 LYS 906 -24.744 -17.501 -7.703 425 HZ2 LYS 906 HZ2 LYS 906 -24.654 -17.104 -9.280 426 HZ3 LYS 906 HZ3 LYS 906 -23.578 -18.155 -8.642 427 H SER 907 HN SER 907 -21.102 -14.810 -10.013 428 HA SER 907 HA SER 907 -19.183 -14.471 -12.190 429 HB2 SER 907 HB1 SER 907 -21.275 -14.207 -13.477 430 HB3 SER 907 HB2 SER 907 -21.348 -15.633 -12.415 431 HG SER 907 HG1 SER 907 -23.262 -14.361 -12.313 432 H GLN 908 HN GLN 908 -20.246 -12.431 -13.606 433 HA GLN 908 HA GLN 908 -20.715 -10.026 -12.052 434 HB2 GLN 908 HB1 GLN 908 -18.948 -8.694 -12.979 435 HB3 GLN 908 HB2 GLN 908 -18.259 -10.071 -12.121 436 HG2 GLN 908 HG1 GLN 908 -18.209 -11.164 -14.547 437 HG3 GLN 908 HG2 GLN 908 -18.442 -9.506 -15.058 438 HE21 GLN 908 HE21 GLN 908 -16.455 -9.380 -16.121 439 HE22 GLN 908 HE22 GLN 908 -14.891 -9.641 -15.351 440 H GLU 909 HN GLU 909 -21.193 -8.153 -13.542 441 HA GLU 909 HA GLU 909 -23.332 -8.755 -15.213 442 HB2 GLU 909 HB1 GLU 909 -21.872 -6.378 -14.390 443 HB3 GLU 909 HB2 GLU 909 -22.157 -6.280 -16.115 444 HG2 GLU 909 HG1 GLU 909 -23.981 -5.201 -15.184 445 HG3 GLU 909 HG2 GLU 909 -24.617 -6.774 -15.652 446 H MET 910 HN MET 910 -19.951 -8.480 -16.190 447 HA MET 910 HA MET 910 -20.527 -9.746 -18.801 448 HB2 MET 910 HB1 MET 910 -19.184 -7.024 -18.576 449 HB3 MET 910 HB2 MET 910 -19.111 -8.064 -20.005 450 HG2 MET 910 HG1 MET 910 -21.573 -7.888 -20.243 451 HG3 MET 910 HG2 MET 910 -21.613 -6.780 -18.859 452 HE1 MET 910 HE1 MET 910 -22.825 -6.156 -21.803 453 HE2 MET 910 HE2 MET 910 -22.966 -5.083 -20.391 454 HE3 MET 910 HE3 MET 910 -22.362 -4.444 -21.936 455 H SER 911 HN SER 911 -18.804 -11.098 -19.389 456 HA SER 911 HA SER 911 -16.512 -11.440 -17.656 457 HB2 SER 911 HB1 SER 911 -16.504 -12.285 -20.525 458 HB3 SER 911 HB2 SER 911 -15.714 -13.034 -19.146 459 HG SER 911 HG1 SER 911 -17.601 -14.197 -19.827 460 H ASN 912 HN ASN 912 -14.277 -11.140 -18.267 461 HA ASN 912 HA ASN 912 -13.948 -8.363 -18.317 462 HB2 ASN 912 HB1 ASN 912 -11.747 -10.404 -18.856 463 HB3 ASN 912 HB2 ASN 912 -11.521 -8.743 -18.310 464 HD21 ASN 912 HD21 ASN 912 -10.207 -10.300 -16.793 465 HD22 ASN 912 HD22 ASN 912 -11.061 -10.734 -15.322 466 H GLU 913 HN GLU 913 -13.552 -10.619 -20.967 467 HA GLU 913 HA GLU 913 -12.476 -8.671 -22.861 468 HB2 GLU 913 HB1 GLU 913 -12.540 -10.461 -24.449 469 HB3 GLU 913 HB2 GLU 913 -11.788 -11.005 -22.964 470 HG2 GLU 913 HG1 GLU 913 -14.732 -11.562 -23.348 471 HG3 GLU 913 HG2 GLU 913 -13.587 -12.439 -24.343 472 H GLU 914 HN GLU 914 -15.677 -9.275 -21.800 473 HA GLU 914 HA GLU 914 -16.875 -8.027 -24.236 474 HB2 GLU 914 HB1 GLU 914 -18.027 -9.479 -21.837 475 HB3 GLU 914 HB2 GLU 914 -18.972 -8.240 -22.644 476 HG2 GLU 914 HG1 GLU 914 -19.615 -10.270 -23.620 477 HG3 GLU 914 HG2 GLU 914 -18.692 -9.377 -24.817 478 H ILE 915 HN ILE 915 -16.270 -7.370 -20.725 479 HA ILE 915 HA ILE 915 -17.452 -4.742 -20.966 480 HB ILE 915 HB ILE 915 -17.580 -5.472 -18.833 481 HG12 ILE 915 HG11 ILE 915 -16.345 -3.913 -17.437 482 HG13 ILE 915 HG12 ILE 915 -15.179 -3.599 -18.723 483 HG21 ILE 915 HG21 ILE 915 -15.818 -6.240 -17.322 484 HG22 ILE 915 HG22 ILE 915 -15.993 -7.278 -18.705 485 HG23 ILE 915 HG23 ILE 915 -14.629 -6.137 -18.659 486 HD11 ILE 915 HD1 ILE 915 -18.164 -2.944 -18.740 487 HD12 ILE 915 HD2 ILE 915 -16.789 -1.803 -18.645 488 HD13 ILE 915 HD3 ILE 915 -17.112 -2.689 -20.104 489 H ASN 916 HN ASN 916 -13.970 -5.657 -20.817 490 HA ASN 916 HA ASN 916 -13.032 -3.053 -21.196 491 HB2 ASN 916 HB1 ASN 916 -10.908 -3.965 -21.761 492 HB3 ASN 916 HB2 ASN 916 -11.645 -4.935 -20.507 493 HD21 ASN 916 HD21 ASN 916 -10.034 -6.498 -21.083 494 HD22 ASN 916 HD22 ASN 916 -10.257 -7.537 -22.485 495 H GLU 917 HN GLU 917 -14.221 -5.145 -23.739 496 HA GLU 917 HA GLU 917 -13.641 -3.545 -26.025 497 HB2 GLU 917 HB1 GLU 917 -15.556 -5.685 -25.259 498 HB3 GLU 917 HB2 GLU 917 -16.015 -4.725 -26.648 499 HG2 GLU 917 HG1 GLU 917 -13.353 -6.184 -26.299 500 HG3 GLU 917 HG2 GLU 917 -14.729 -6.802 -27.210 501 H GLU 918 HN GLU 918 -16.243 -3.205 -23.638 502 HA GLU 918 HA GLU 918 -17.813 -1.219 -25.051 503 HB2 GLU 918 HB1 GLU 918 -18.511 -2.691 -23.063 504 HB3 GLU 918 HB2 GLU 918 -17.635 -1.552 -22.023 505 HG2 GLU 918 HG1 GLU 918 -19.152 0.221 -22.476 506 HG3 GLU 918 HG2 GLU 918 -19.739 -0.555 -23.951 507 H LEU 919 HN LEU 919 -15.081 -1.053 -22.776 508 HA LEU 919 HA LEU 919 -14.959 1.876 -22.700 509 HB2 LEU 919 HB1 LEU 919 -13.143 -0.397 -21.863 510 HB3 LEU 919 HB2 LEU 919 -12.708 1.294 -21.647 511 HG LEU 919 HG LEU 919 -15.346 0.805 -20.536 512 HD11 LEU 919 HD11 LEU 919 -14.711 -1.501 -20.271 513 HD12 LEU 919 HD12 LEU 919 -13.125 -1.063 -19.620 514 HD13 LEU 919 HD13 LEU 919 -14.597 -0.748 -18.678 515 HD21 LEU 919 HD21 LEU 919 -13.902 2.650 -19.853 516 HD22 LEU 919 HD22 LEU 919 -14.128 1.571 -18.438 517 HD23 LEU 919 HD23 LEU 919 -12.625 1.520 -19.386 518 H GLY 920 HN GLY 920 -13.570 -0.702 -24.611 519 HA2 GLY 920 HA1 GLY 920 -12.722 -0.530 -26.816 520 HA3 GLY 920 HA2 GLY 920 -12.443 1.198 -26.606 521 H ILE 921 HN ILE 921 -11.358 -1.443 -24.482 522 HA ILE 921 HA ILE 921 -8.468 -0.971 -25.042 523 HB ILE 921 HB ILE 921 -8.101 -0.698 -22.572 524 HG12 ILE 921 HG11 ILE 921 -11.100 -0.286 -22.469 525 HG13 ILE 921 HG12 ILE 921 -10.285 -1.716 -21.863 526 HG21 ILE 921 HG21 ILE 921 -8.564 1.652 -22.490 527 HG22 ILE 921 HG22 ILE 921 -8.160 1.241 -24.159 528 HG23 ILE 921 HG23 ILE 921 -9.855 1.514 -23.698 529 HD11 ILE 921 HD1 ILE 921 -9.083 -0.299 -20.198 530 HD12 ILE 921 HD2 ILE 921 -10.042 1.101 -20.758 531 HD13 ILE 921 HD3 ILE 921 -10.854 -0.290 -20.027 532 H GLY 922 HN GLY 922 -7.160 -2.489 -23.401 533 HA2 GLY 922 HA1 GLY 922 -8.426 -5.177 -23.184 534 HA3 GLY 922 HA2 GLY 922 -6.702 -4.815 -23.130 535 H GLN 923 HN GLN 923 -6.372 -5.675 -21.148 536 HA GLN 923 HA GLN 923 -6.868 -4.047 -18.830 537 HB2 GLN 923 HB1 GLN 923 -8.811 -5.941 -19.205 538 HB3 GLN 923 HB2 GLN 923 -7.618 -6.923 -18.382 539 HG2 GLN 923 HG1 GLN 923 -8.940 -6.121 -16.681 540 HG3 GLN 923 HG2 GLN 923 -7.537 -5.039 -16.636 541 HE21 GLN 923 HE21 GLN 923 -8.572 -3.116 -15.740 542 HE22 GLN 923 HE22 GLN 923 -9.910 -2.365 -16.575 543 H ASP 924 HN ASP 924 -5.679 -5.057 -16.918 544 HA ASP 924 HA ASP 924 -2.958 -5.472 -17.726 545 HB2 ASP 924 HB1 ASP 924 -3.790 -4.320 -15.659 546 HB3 ASP 924 HB2 ASP 924 -4.193 -5.891 -14.972 547 H GLU 925 HN GLU 925 -5.420 -7.749 -16.619 548 HA GLU 925 HA GLU 925 -3.698 -10.070 -16.346 549 HB2 GLU 925 HB1 GLU 925 -6.683 -9.870 -16.962 550 HB3 GLU 925 HB2 GLU 925 -5.833 -11.329 -16.494 551 HG2 GLU 925 HG1 GLU 925 -6.410 -8.865 -14.827 552 HG3 GLU 925 HG2 GLU 925 -6.991 -10.500 -14.562 553 H ALA 926 HN ALA 926 -5.534 -8.731 -19.049 554 HA ALA 926 HA ALA 926 -4.950 -10.845 -20.965 555 HB1 ALA 926 HB1 ALA 926 -6.931 -9.364 -21.110 556 HB2 ALA 926 HB2 ALA 926 -5.855 -7.970 -21.371 557 HB3 ALA 926 HB3 ALA 926 -5.921 -9.280 -22.566 558 H ASP 927 HN ASP 927 -3.598 -7.614 -20.363 559 HA ASP 927 HA ASP 927 -1.853 -6.474 -21.130 560 HB2 ASP 927 HB1 ASP 927 -0.668 -8.369 -19.930 561 HB3 ASP 927 HB2 ASP 927 -0.365 -9.088 -21.510 562 H ALA 928 HN ALA 928 -3.800 -7.791 -23.100 563 HA ALA 928 HA ALA 928 -2.541 -6.743 -25.574 564 HB1 ALA 928 HB1 ALA 928 -2.124 -9.174 -25.570 565 HB2 ALA 928 HB2 ALA 928 -3.857 -9.484 -25.323 566 HB3 ALA 928 HB3 ALA 928 -3.292 -8.733 -26.830 567 H1 ALA 1 HT1 ALA 1 -8.068 0.982 -7.937 568 H2 ALA 1 HT2 ALA 1 -6.645 1.557 -8.550 569 H3 ALA 1 HT3 ALA 1 -6.761 1.216 -6.966 570 HA ALA 1 HA ALA 1 -5.516 -0.486 -8.077 571 HB1 ALA 1 HB1 ALA 1 -6.750 -2.429 -7.232 572 HB2 ALA 1 HB2 ALA 1 -6.792 -1.092 -6.065 573 HB3 ALA 1 HB3 ALA 1 -8.225 -1.452 -7.060 574 H ARG 2 HN ARG 2 -5.454 0.145 -10.308 575 HA ARG 2 HA ARG 2 -5.811 -0.043 -12.544 576 HB2 ARG 2 HB1 ARG 2 -4.475 -1.943 -11.871 577 HB3 ARG 2 HB2 ARG 2 -5.905 -2.927 -11.614 578 HG2 ARG 2 HG1 ARG 2 -4.610 -3.452 -13.647 579 HG3 ARG 2 HG2 ARG 2 -6.306 -3.174 -13.950 580 HD2 ARG 2 HD1 ARG 2 -4.107 -1.084 -14.399 581 HD3 ARG 2 HD2 ARG 2 -4.656 -2.204 -15.650 582 HE ARG 2 HE ARG 2 -6.988 -0.918 -14.773 583 HH11 ARG 2 HH11 ARG 2 -4.077 0.019 -16.489 584 HH12 ARG 2 HH12 ARG 2 -4.804 1.470 -17.124 585 HH21 ARG 2 HH21 ARG 2 -7.790 1.083 -15.453 586 HH22 ARG 2 HH22 ARG 2 -6.870 1.996 -16.606 587 H THR 3 HN THR 3 -8.455 0.584 -11.385 588 HA THR 3 HA THR 3 -10.072 -1.080 -13.252 589 HB THR 3 HB THR 3 -10.783 -0.887 -10.826 590 HG1 THR 3 HG1 THR 3 -12.364 -1.496 -12.168 591 HG21 THR 3 HG21 THR 3 -11.699 1.935 -11.537 592 HG22 THR 3 HG22 THR 3 -11.966 1.061 -10.025 593 HG23 THR 3 HG23 THR 3 -10.326 1.557 -10.470 594 H MLZ 4 HN MLZ 4 -12.243 0.770 -13.645 595 HA MLZ 4 HA MLZ 4 -11.235 2.823 -15.453 596 HB2 MLZ 4 HB1 MLZ 4 -11.657 1.599 -17.503 597 HB3 MLZ 4 HB2 MLZ 4 -10.468 0.758 -16.574 598 HG2 MLZ 4 HG1 MLZ 4 -13.399 -0.066 -16.774 599 HG3 MLZ 4 HG2 MLZ 4 -12.041 -0.724 -17.704 600 HD2 MLZ 4 HD1 MLZ 4 -10.993 -1.313 -15.441 601 HD3 MLZ 4 HD2 MLZ 4 -12.594 -1.072 -14.754 602 HE2 MLZ 4 HE1 MLZ 4 -12.124 -2.968 -17.097 603 HE3 MLZ 4 HE2 MLZ 4 -11.812 -3.461 -15.434 604 HZ MLZ 4 HZ1 MLZ 4 -14.469 -2.509 -16.423 605 HCM1 MLZ 4 HC1 MLZ 4 -14.997 -4.890 -15.970 606 HCM2 MLZ 4 HC2 MLZ 4 -13.791 -4.675 -17.265 607 HCM3 MLZ 4 HC3 MLZ 4 -13.274 -5.134 -15.650 608 HZ2 MLZ 4 HZ2 MLZ 4 -14.137 -2.940 -14.882 609 H GLN 5 HN GLN 5 -12.866 3.761 -16.844 610 HA GLN 5 HA GLN 5 -15.041 4.403 -15.051 611 HB2 GLN 5 HB1 GLN 5 -15.211 6.443 -16.227 612 HB3 GLN 5 HB2 GLN 5 -13.514 6.046 -15.956 613 HG2 GLN 5 HG1 GLN 5 -13.431 5.227 -18.383 614 HG3 GLN 5 HG2 GLN 5 -15.048 5.910 -18.586 615 HE21 GLN 5 HE21 GLN 5 -13.491 6.994 -20.342 616 HE22 GLN 5 HE22 GLN 5 -12.858 8.550 -19.826 617 H THR 6 HN THR 6 -15.067 3.399 -18.471 618 HA THR 6 HA THR 6 -16.626 2.719 -19.927 619 HB THR 6 HB THR 6 -18.325 1.832 -17.597 620 HG1 THR 6 HG1 THR 6 -16.260 0.465 -18.953 621 HG21 THR 6 HG21 THR 6 -18.908 -0.012 -19.140 622 HG22 THR 6 HG22 THR 6 -19.377 1.541 -19.840 623 HG23 THR 6 HG23 THR 6 -17.908 0.720 -20.414 624 H ALA 7 HN ALA 7 -18.459 4.385 -17.360 625 HA ALA 7 HA ALA 7 -20.282 5.631 -17.284 626 HB1 ALA 7 HB1 ALA 7 -20.720 7.314 -18.979 627 HB2 ALA 7 HB2 ALA 7 -18.990 7.220 -18.600 628 HB3 ALA 7 HB3 ALA 7 -19.614 6.517 -20.110 629 H ARG 8 HN ARG 8 -20.470 4.223 -20.589 630 HA ARG 8 HA ARG 8 -22.255 3.432 -21.808 631 HB2 ARG 8 HB1 ARG 8 -21.616 1.476 -20.443 632 HB3 ARG 8 HB2 ARG 8 -22.830 1.935 -19.231 633 HG2 ARG 8 HG1 ARG 8 -24.488 1.782 -21.344 634 HG3 ARG 8 HG2 ARG 8 -23.192 0.823 -22.029 635 HD2 ARG 8 HD1 ARG 8 -24.608 0.319 -19.373 636 HD3 ARG 8 HD2 ARG 8 -24.960 -0.518 -20.890 637 HE ARG 8 HE ARG 8 -22.383 -1.142 -20.714 638 HH11 ARG 8 HH11 ARG 8 -24.817 -1.409 -18.195 639 HH12 ARG 8 HH12 ARG 8 -23.936 -2.669 -17.378 640 HH21 ARG 8 HH21 ARG 8 -21.310 -2.586 -19.631 641 HH22 ARG 8 HH22 ARG 8 -21.983 -3.387 -18.209 642 H TYR 9 HN TYR 9 -22.886 5.744 -21.635 643 HA TYR 9 HA TYR 9 -25.196 6.602 -20.159 644 HB2 TYR 9 HB1 TYR 9 -23.486 8.117 -21.063 645 HB3 TYR 9 HB2 TYR 9 -23.929 7.674 -22.705 646 HD1 TYR 9 HD1 TYR 9 -25.835 8.684 -23.801 647 HD2 TYR 9 HD2 TYR 9 -25.080 9.403 -19.615 648 HE1 TYR 9 HE1 TYR 9 -27.512 10.528 -23.818 649 HE2 TYR 9 HE2 TYR 9 -26.764 11.248 -19.632 650 HH TYR 9 HH TYR 9 -28.573 12.145 -22.597 Start of MODEL 6 1 H1 GLY 850 HT1 GLY 850 7.144 2.663 -9.391 2 H2 GLY 850 HT2 GLY 850 7.289 3.640 -10.700 3 H3 GLY 850 HT3 GLY 850 8.058 2.194 -10.664 4 HA2 GLY 850 HA1 GLY 850 5.135 2.581 -10.719 5 HA3 GLY 850 HA2 GLY 850 6.127 2.063 -12.093 6 H SER 851 HN SER 851 4.361 0.324 -11.878 7 HA SER 851 HA SER 851 5.556 -2.077 -10.705 8 HB2 SER 851 HB1 SER 851 3.708 -2.715 -9.320 9 HB3 SER 851 HB2 SER 851 4.191 -1.092 -8.818 10 HG SER 851 HG1 SER 851 2.465 -0.249 -10.006 11 H ARG 852 HN ARG 852 3.731 -3.943 -11.060 12 HA ARG 852 HA ARG 852 3.458 -4.188 -13.947 13 HB2 ARG 852 HB1 ARG 852 2.791 -5.948 -11.557 14 HB3 ARG 852 HB2 ARG 852 2.238 -6.375 -13.164 15 HG2 ARG 852 HG1 ARG 852 4.239 -7.569 -12.761 16 HG3 ARG 852 HG2 ARG 852 4.538 -6.382 -14.031 17 HD2 ARG 852 HD1 ARG 852 5.733 -4.939 -12.439 18 HD3 ARG 852 HD2 ARG 852 5.339 -6.056 -11.109 19 HE ARG 852 HE ARG 852 6.684 -7.478 -13.200 20 HH11 ARG 852 HH11 ARG 852 7.467 -5.154 -10.693 21 HH12 ARG 852 HH12 ARG 852 9.128 -5.673 -10.608 22 HH21 ARG 852 HH21 ARG 852 8.811 -8.089 -13.032 23 HH22 ARG 852 HH22 ARG 852 9.861 -7.292 -11.898 24 H ARG 853 HN ARG 853 1.411 -2.587 -11.829 25 HA ARG 853 HA ARG 853 -0.796 -2.603 -13.762 26 HB2 ARG 853 HB1 ARG 853 -2.498 -3.496 -12.454 27 HB3 ARG 853 HB2 ARG 853 -1.177 -4.582 -12.145 28 HG2 ARG 853 HG1 ARG 853 -2.212 -2.380 -10.315 29 HG3 ARG 853 HG2 ARG 853 -2.435 -4.110 -10.116 30 HD2 ARG 853 HD1 ARG 853 -0.111 -4.455 -9.583 31 HD3 ARG 853 HD2 ARG 853 0.328 -2.817 -10.060 32 HE ARG 853 HE ARG 853 -0.983 -3.625 -7.557 33 HH11 ARG 853 HH11 ARG 853 0.088 -0.856 -9.512 34 HH12 ARG 853 HH12 ARG 853 -0.287 0.239 -8.179 35 HH21 ARG 853 HH21 ARG 853 -1.263 -2.047 -5.946 36 HH22 ARG 853 HH22 ARG 853 -0.909 -0.373 -6.370 37 H ALA 854 HN ALA 854 -2.570 -1.222 -13.068 38 HA ALA 854 HA ALA 854 -3.559 0.665 -12.475 39 HB1 ALA 854 HB1 ALA 854 -3.122 1.836 -10.473 40 HB2 ALA 854 HB2 ALA 854 -2.778 0.125 -10.145 41 HB3 ALA 854 HB3 ALA 854 -1.447 1.270 -10.408 42 H SER 855 HN SER 855 -3.762 2.783 -12.746 43 HA SER 855 HA SER 855 -1.743 4.629 -13.638 44 HB2 SER 855 HB1 SER 855 -2.631 4.963 -15.887 45 HB3 SER 855 HB2 SER 855 -1.915 3.376 -15.693 46 HG SER 855 HG1 SER 855 -3.950 2.456 -15.614 47 H VAL 856 HN VAL 856 -3.095 6.574 -14.687 48 HA VAL 856 HA VAL 856 -4.962 7.469 -12.622 49 HB VAL 856 HB VAL 856 -5.131 9.554 -13.905 50 HG11 VAL 856 HG11 VAL 856 -2.272 8.631 -13.474 51 HG12 VAL 856 HG12 VAL 856 -2.861 10.308 -13.533 52 HG13 VAL 856 HG13 VAL 856 -3.393 9.234 -12.229 53 HG21 VAL 856 HG21 VAL 856 -3.181 8.308 -15.884 54 HG22 VAL 856 HG22 VAL 856 -4.889 8.699 -16.201 55 HG23 VAL 856 HG23 VAL 856 -3.737 9.992 -15.846 56 H GLY 857 HN GLY 857 -7.023 8.491 -13.088 57 HA2 GLY 857 HA1 GLY 857 -8.650 7.649 -15.350 58 HA3 GLY 857 HA2 GLY 857 -9.036 6.794 -13.854 59 H SER 858 HN SER 858 -10.859 7.671 -13.136 60 HA SER 858 HA SER 858 -11.109 10.570 -12.595 61 HB2 SER 858 HB1 SER 858 -13.187 9.060 -14.227 62 HB3 SER 858 HB2 SER 858 -13.312 10.732 -13.666 63 HG SER 858 HG1 SER 858 -11.527 11.254 -14.996 64 H GLU 859 HN GLU 859 -12.406 11.092 -10.924 65 HA GLU 859 HA GLU 859 -13.806 8.931 -9.435 66 HB2 GLU 859 HB1 GLU 859 -12.444 11.461 -8.458 67 HB3 GLU 859 HB2 GLU 859 -13.227 10.291 -7.412 68 HG2 GLU 859 HG1 GLU 859 -10.974 9.827 -7.147 69 HG3 GLU 859 HG2 GLU 859 -11.579 8.545 -8.190 70 H PHE 860 HN PHE 860 -14.545 11.040 -11.264 71 HA PHE 860 HA PHE 860 -16.819 12.487 -9.906 72 HB2 PHE 860 HB1 PHE 860 -14.937 13.267 -12.170 73 HB3 PHE 860 HB2 PHE 860 -16.324 14.203 -11.694 74 HD1 PHE 860 HD1 PHE 860 -12.834 13.553 -11.072 75 HD2 PHE 860 HD2 PHE 860 -16.432 15.015 -9.195 76 HE1 PHE 860 HE1 PHE 860 -11.472 14.628 -9.297 77 HE2 PHE 860 HE2 PHE 860 -15.065 16.100 -7.426 78 HZ PHE 860 HZ PHE 860 -12.584 15.903 -7.473 79 H THR 861 HN THR 861 -15.978 10.673 -12.698 80 HA THR 861 HA THR 861 -18.097 11.051 -14.515 81 HB THR 861 HB THR 861 -17.414 8.588 -15.153 82 HG1 THR 861 HG1 THR 861 -16.439 8.033 -13.209 83 HG21 THR 861 HG21 THR 861 -15.328 9.387 -16.164 84 HG22 THR 861 HG22 THR 861 -16.668 10.532 -16.376 85 HG23 THR 861 HG23 THR 861 -15.400 10.862 -15.168 86 H GLU 862 HN GLU 862 -19.517 9.218 -15.232 87 HA GLU 862 HA GLU 862 -21.628 8.638 -13.379 88 HB2 GLU 862 HB1 GLU 862 -21.613 8.885 -15.945 89 HB3 GLU 862 HB2 GLU 862 -21.074 7.202 -15.990 90 HG2 GLU 862 HG1 GLU 862 -23.153 6.492 -14.910 91 HG3 GLU 862 HG2 GLU 862 -23.584 8.160 -14.552 92 H SER 863 HN SER 863 -22.449 6.199 -13.247 93 HA SER 863 HA SER 863 -20.879 4.764 -11.407 94 HB2 SER 863 HB1 SER 863 -22.415 2.872 -11.874 95 HB3 SER 863 HB2 SER 863 -23.237 4.405 -11.536 96 HG SER 863 HG1 SER 863 -24.165 3.327 -13.328 97 H ALA 864 HN ALA 864 -19.511 3.032 -11.476 98 HA ALA 864 HA ALA 864 -18.210 2.468 -14.107 99 HB1 ALA 864 HB1 ALA 864 -16.822 3.876 -11.800 100 HB2 ALA 864 HB2 ALA 864 -16.051 3.308 -13.253 101 HB3 ALA 864 HB3 ALA 864 -17.260 4.607 -13.357 102 H TRP 865 HN TRP 865 -15.971 1.216 -13.470 103 HA TRP 865 HA TRP 865 -16.976 -1.140 -11.960 104 HB2 TRP 865 HB1 TRP 865 -14.736 -0.808 -13.931 105 HB3 TRP 865 HB2 TRP 865 -15.177 -2.327 -13.161 106 HD1 TRP 865 HD1 TRP 865 -16.705 0.286 -15.556 107 HE1 TRP 865 HE1 TRP 865 -18.580 -0.745 -16.909 108 HE3 TRP 865 HE3 TRP 865 -16.633 -4.380 -13.484 109 HZ2 TRP 865 HZ2 TRP 865 -20.039 -3.305 -16.950 110 HZ3 TRP 865 HZ3 TRP 865 -18.239 -6.130 -14.238 111 HH2 TRP 865 HH2 TRP 865 -19.953 -5.595 -15.944 112 H VAL 866 HN VAL 866 -15.339 -2.465 -10.853 113 HA VAL 866 HA VAL 866 -12.908 -1.187 -9.806 114 HB VAL 866 HB VAL 866 -14.575 -0.564 -8.146 115 HG11 VAL 866 HG11 VAL 866 -16.161 -2.458 -8.458 116 HG12 VAL 866 HG12 VAL 866 -15.003 -3.547 -7.678 117 HG13 VAL 866 HG13 VAL 866 -15.723 -2.196 -6.780 118 HG21 VAL 866 HG21 VAL 866 -12.779 -2.721 -6.977 119 HG22 VAL 866 HG22 VAL 866 -12.260 -1.064 -7.386 120 HG23 VAL 866 HG23 VAL 866 -13.504 -1.336 -6.149 121 H ARG 867 HN ARG 867 -11.309 -2.718 -9.220 122 HA ARG 867 HA ARG 867 -11.828 -5.558 -10.011 123 HB2 ARG 867 HB1 ARG 867 -10.098 -4.002 -11.125 124 HB3 ARG 867 HB2 ARG 867 -9.159 -4.167 -9.680 125 HG2 ARG 867 HG1 ARG 867 -9.310 -6.733 -10.179 126 HG3 ARG 867 HG2 ARG 867 -9.870 -6.202 -11.811 127 HD2 ARG 867 HD1 ARG 867 -7.846 -4.936 -12.154 128 HD3 ARG 867 HD2 ARG 867 -7.309 -5.273 -10.500 129 HE ARG 867 HE ARG 867 -6.175 -6.979 -11.309 130 HH11 ARG 867 HH11 ARG 867 -9.174 -7.341 -13.018 131 HH12 ARG 867 HH12 ARG 867 -8.489 -8.331 -14.263 132 HH21 ARG 867 HH21 ARG 867 -5.315 -8.246 -12.925 133 HH22 ARG 867 HH22 ARG 867 -6.370 -8.866 -14.162 134 H CYS 868 HN CYS 868 -11.864 -7.082 -8.428 135 HA CYS 868 HA CYS 868 -11.652 -6.451 -5.685 136 HB2 CYS 868 HB1 CYS 868 -13.051 -8.236 -6.509 137 HB3 CYS 868 HB2 CYS 868 -11.655 -9.094 -7.166 138 H ASP 869 HN ASP 869 -10.035 -6.277 -4.288 139 HA ASP 869 HA ASP 869 -7.245 -6.744 -4.967 140 HB2 ASP 869 HB1 ASP 869 -8.690 -5.995 -2.395 141 HB3 ASP 869 HB2 ASP 869 -6.943 -6.182 -2.497 142 H ASP 870 HN ASP 870 -9.677 -8.863 -3.720 143 HA ASP 870 HA ASP 870 -7.667 -10.791 -2.647 144 HB2 ASP 870 HB1 ASP 870 -10.631 -10.423 -2.290 145 HB3 ASP 870 HB2 ASP 870 -10.009 -12.050 -2.241 146 H CYS 871 HN CYS 871 -9.594 -10.190 -5.460 147 HA CYS 871 HA CYS 871 -8.646 -12.751 -6.673 148 HB2 CYS 871 HB1 CYS 871 -11.187 -11.182 -7.321 149 HB3 CYS 871 HB2 CYS 871 -10.612 -12.646 -8.146 150 H PHE 872 HN PHE 872 -10.147 -10.371 -8.403 151 HA PHE 872 HA PHE 872 -8.509 -8.671 -9.770 152 HB2 PHE 872 HB1 PHE 872 -7.852 -9.762 -11.776 153 HB3 PHE 872 HB2 PHE 872 -7.023 -10.477 -10.434 154 HD1 PHE 872 HD1 PHE 872 -9.527 -10.999 -13.110 155 HD2 PHE 872 HD2 PHE 872 -7.484 -12.859 -9.793 156 HE1 PHE 872 HE1 PHE 872 -10.315 -13.222 -13.868 157 HE2 PHE 872 HE2 PHE 872 -8.286 -15.082 -10.551 158 HZ PHE 872 HZ PHE 872 -9.704 -15.269 -12.587 159 H LYS 873 HN LYS 873 -11.108 -10.997 -9.736 160 HA LYS 873 HA LYS 873 -12.969 -10.601 -11.601 161 HB2 LYS 873 HB1 LYS 873 -12.932 -11.307 -8.878 162 HB3 LYS 873 HB2 LYS 873 -14.040 -9.947 -8.916 163 HG2 LYS 873 HG1 LYS 873 -14.426 -12.255 -10.813 164 HG3 LYS 873 HG2 LYS 873 -14.898 -12.376 -9.106 165 HD2 LYS 873 HD1 LYS 873 -15.813 -10.059 -10.754 166 HD3 LYS 873 HD2 LYS 873 -16.696 -11.594 -10.804 167 HE2 LYS 873 HE1 LYS 873 -15.989 -10.203 -8.209 168 HE3 LYS 873 HE2 LYS 873 -17.432 -9.732 -9.126 169 HZ1 LYS 873 HZ1 LYS 873 -16.935 -12.467 -8.093 170 HZ2 LYS 873 HZ2 LYS 873 -17.935 -11.371 -7.402 171 HZ3 LYS 873 HZ3 LYS 873 -18.271 -11.951 -8.905 172 H TRP 874 HN TRP 874 -14.319 -9.085 -12.419 173 HA TRP 874 HA TRP 874 -13.915 -6.246 -11.583 174 HB2 TRP 874 HB1 TRP 874 -15.185 -7.300 -14.129 175 HB3 TRP 874 HB2 TRP 874 -14.895 -5.643 -13.719 176 HD1 TRP 874 HD1 TRP 874 -12.918 -8.620 -15.068 177 HE1 TRP 874 HE1 TRP 874 -10.486 -7.866 -15.549 178 HE3 TRP 874 HE3 TRP 874 -13.088 -3.958 -12.993 179 HZ2 TRP 874 HZ2 TRP 874 -8.872 -5.649 -15.036 180 HZ3 TRP 874 HZ3 TRP 874 -11.006 -2.669 -12.790 181 HH2 TRP 874 HH2 TRP 874 -8.889 -3.435 -13.799 182 H ARG 875 HN ARG 875 -15.617 -4.902 -11.102 183 HA ARG 875 HA ARG 875 -18.373 -5.960 -11.161 184 HB2 ARG 875 HB1 ARG 875 -16.815 -5.316 -8.644 185 HB3 ARG 875 HB2 ARG 875 -18.514 -4.895 -8.686 186 HG2 ARG 875 HG1 ARG 875 -17.320 -7.669 -8.986 187 HG3 ARG 875 HG2 ARG 875 -18.303 -7.069 -7.670 188 HD2 ARG 875 HD1 ARG 875 -19.185 -7.823 -10.445 189 HD3 ARG 875 HD2 ARG 875 -19.766 -8.411 -8.889 190 HE ARG 875 HE ARG 875 -20.405 -5.714 -8.813 191 HH11 ARG 875 HH11 ARG 875 -21.400 -8.280 -11.001 192 HH12 ARG 875 HH12 ARG 875 -22.661 -7.246 -11.664 193 HH21 ARG 875 HH21 ARG 875 -22.077 -4.537 -9.817 194 HH22 ARG 875 HH22 ARG 875 -23.022 -5.386 -11.028 195 H ARG 876 HN ARG 876 -19.718 -4.606 -11.837 196 HA ARG 876 HA ARG 876 -19.366 -1.692 -12.151 197 HB2 ARG 876 HB1 ARG 876 -20.464 -3.343 -13.699 198 HB3 ARG 876 HB2 ARG 876 -21.763 -3.494 -12.552 199 HG2 ARG 876 HG1 ARG 876 -20.819 -0.941 -13.964 200 HG3 ARG 876 HG2 ARG 876 -22.203 -1.902 -14.444 201 HD2 ARG 876 HD1 ARG 876 -21.772 -0.279 -11.963 202 HD3 ARG 876 HD2 ARG 876 -23.016 0.018 -13.191 203 HE ARG 876 HE ARG 876 -23.394 -1.490 -10.835 204 HH11 ARG 876 HH11 ARG 876 -24.165 -2.129 -14.209 205 HH12 ARG 876 HH12 ARG 876 -24.894 -3.670 -13.798 206 HH21 ARG 876 HH21 ARG 876 -24.531 -3.375 -10.429 207 HH22 ARG 876 HH22 ARG 876 -25.069 -4.294 -11.806 208 H ILE 877 HN ILE 877 -19.490 -0.351 -10.641 209 HA ILE 877 HA ILE 877 -21.404 -0.652 -8.362 210 HB ILE 877 HB ILE 877 -19.738 0.255 -6.866 211 HG12 ILE 877 HG11 ILE 877 -17.877 0.439 -9.271 212 HG13 ILE 877 HG12 ILE 877 -18.618 1.778 -8.415 213 HG21 ILE 877 HG21 ILE 877 -18.379 -1.945 -8.447 214 HG22 ILE 877 HG22 ILE 877 -18.242 -1.612 -6.710 215 HG23 ILE 877 HG23 ILE 877 -19.764 -2.227 -7.364 216 HD11 ILE 877 HD1 ILE 877 -17.371 1.305 -6.398 217 HD12 ILE 877 HD2 ILE 877 -16.613 -0.103 -7.148 218 HD13 ILE 877 HD3 ILE 877 -16.274 1.514 -7.771 219 HA PRO 878 HA PRO 878 -22.457 3.588 -9.392 220 HB2 PRO 878 HB1 PRO 878 -23.334 4.644 -7.017 221 HB3 PRO 878 HB2 PRO 878 -24.257 3.395 -7.911 222 HG2 PRO 878 HG1 PRO 878 -22.334 2.987 -5.594 223 HG3 PRO 878 HG2 PRO 878 -23.992 2.334 -5.778 224 HD2 PRO 878 HD1 PRO 878 -21.785 0.872 -6.406 225 HD3 PRO 878 HD2 PRO 878 -23.284 0.740 -7.369 226 H ALA 879 HN ALA 879 -21.517 5.565 -9.490 227 HA ALA 879 HA ALA 879 -18.854 5.993 -8.862 228 HB1 ALA 879 HB1 ALA 879 -21.066 8.041 -9.310 229 HB2 ALA 879 HB2 ALA 879 -19.323 8.330 -9.497 230 HB3 ALA 879 HB3 ALA 879 -20.144 7.189 -10.573 231 H SER 880 HN SER 880 -21.540 6.491 -6.648 232 HA SER 880 HA SER 880 -20.318 8.247 -4.738 233 HB2 SER 880 HB1 SER 880 -21.928 7.211 -3.161 234 HB3 SER 880 HB2 SER 880 -22.688 7.722 -4.679 235 HG SER 880 HG1 SER 880 -23.328 5.599 -4.007 236 H VAL 881 HN VAL 881 -19.775 4.850 -5.484 237 HA VAL 881 HA VAL 881 -17.911 4.549 -3.185 238 HB VAL 881 HB VAL 881 -18.907 2.498 -5.209 239 HG11 VAL 881 HG11 VAL 881 -17.349 2.074 -2.624 240 HG12 VAL 881 HG12 VAL 881 -18.024 0.796 -3.656 241 HG13 VAL 881 HG13 VAL 881 -16.725 1.814 -4.273 242 HG21 VAL 881 HG21 VAL 881 -20.234 1.573 -3.338 243 HG22 VAL 881 HG22 VAL 881 -19.716 2.924 -2.303 244 HG23 VAL 881 HG23 VAL 881 -20.735 3.217 -3.726 245 H VAL 882 HN VAL 882 -17.912 4.719 -6.731 246 HA VAL 882 HA VAL 882 -15.219 3.944 -7.037 247 HB VAL 882 HB VAL 882 -15.283 4.661 -9.200 248 HG11 VAL 882 HG11 VAL 882 -18.030 3.907 -8.409 249 HG12 VAL 882 HG12 VAL 882 -17.777 4.460 -10.039 250 HG13 VAL 882 HG13 VAL 882 -16.842 3.087 -9.426 251 HG21 VAL 882 HG21 VAL 882 -16.695 6.412 -10.246 252 HG22 VAL 882 HG22 VAL 882 -16.998 7.008 -8.600 253 HG23 VAL 882 HG23 VAL 882 -15.358 6.928 -9.233 254 H GLY 883 HN GLY 883 -16.533 6.964 -6.084 255 HA2 GLY 883 HA1 GLY 883 -14.061 8.538 -6.252 256 HA3 GLY 883 HA2 GLY 883 -15.582 9.024 -5.496 257 H SER 884 HN SER 884 -15.284 6.281 -3.957 258 HA SER 884 HA SER 884 -13.716 7.366 -1.672 259 HB2 SER 884 HB1 SER 884 -16.077 6.621 -1.368 260 HB3 SER 884 HB2 SER 884 -15.592 4.975 -1.803 261 HG SER 884 HG1 SER 884 -14.260 4.919 0.027 262 H ILE 885 HN ILE 885 -13.801 4.612 -3.926 263 HA ILE 885 HA ILE 885 -11.682 3.127 -2.584 264 HB ILE 885 HB ILE 885 -13.380 2.798 -5.028 265 HG12 ILE 885 HG11 ILE 885 -13.842 0.618 -4.093 266 HG13 ILE 885 HG12 ILE 885 -12.585 0.772 -2.869 267 HG21 ILE 885 HG21 ILE 885 -11.231 2.229 -6.004 268 HG22 ILE 885 HG22 ILE 885 -10.853 1.159 -4.624 269 HG23 ILE 885 HG23 ILE 885 -12.195 0.782 -5.731 270 HD11 ILE 885 HD1 ILE 885 -13.857 2.449 -1.681 271 HD12 ILE 885 HD2 ILE 885 -14.996 2.596 -3.041 272 HD13 ILE 885 HD3 ILE 885 -14.967 1.122 -2.070 273 H ASP 886 HN ASP 886 -9.617 3.247 -2.787 274 HA ASP 886 HA ASP 886 -8.260 4.733 -4.995 275 HB2 ASP 886 HB1 ASP 886 -7.745 4.892 -1.995 276 HB3 ASP 886 HB2 ASP 886 -6.663 5.552 -3.211 277 H GLU 887 HN GLU 887 -5.766 4.283 -4.872 278 HA GLU 887 HA GLU 887 -5.229 1.485 -5.129 279 HB2 GLU 887 HB1 GLU 887 -3.937 3.238 -6.233 280 HB3 GLU 887 HB2 GLU 887 -3.358 3.846 -4.670 281 HG2 GLU 887 HG1 GLU 887 -2.065 1.846 -4.277 282 HG3 GLU 887 HG2 GLU 887 -2.858 1.002 -5.611 283 H SER 888 HN SER 888 -5.110 3.589 -2.300 284 HA SER 888 HA SER 888 -3.752 1.686 -0.546 285 HB2 SER 888 HB1 SER 888 -4.285 3.363 1.183 286 HB3 SER 888 HB2 SER 888 -3.507 4.089 -0.235 287 HG SER 888 HG1 SER 888 -5.344 5.291 0.490 288 H SER 889 HN SER 889 -6.939 1.805 -1.749 289 HA SER 889 HA SER 889 -8.344 0.860 0.654 290 HB2 SER 889 HB1 SER 889 -9.211 1.021 -2.261 291 HB3 SER 889 HB2 SER 889 -10.254 0.574 -0.909 292 HG SER 889 HG1 SER 889 -8.784 2.951 -0.687 293 H ARG 890 HN ARG 890 -9.623 -1.145 0.554 294 HA ARG 890 HA ARG 890 -8.389 -3.421 -0.914 295 HB2 ARG 890 HB1 ARG 890 -8.533 -4.834 1.098 296 HB3 ARG 890 HB2 ARG 890 -7.309 -3.571 1.160 297 HG2 ARG 890 HG1 ARG 890 -8.732 -2.204 2.646 298 HG3 ARG 890 HG2 ARG 890 -10.011 -3.430 2.576 299 HD2 ARG 890 HD1 ARG 890 -8.492 -5.096 3.573 300 HD3 ARG 890 HD2 ARG 890 -7.187 -3.912 3.629 301 HE ARG 890 HE ARG 890 -9.544 -4.092 5.389 302 HH11 ARG 890 HH11 ARG 890 -6.876 -2.011 4.460 303 HH12 ARG 890 HH12 ARG 890 -6.993 -1.067 5.918 304 HH21 ARG 890 HH21 ARG 890 -9.631 -2.847 7.219 305 HH22 ARG 890 HH22 ARG 890 -8.512 -1.532 7.434 306 H TRP 891 HN TRP 891 -10.203 -2.760 -2.249 307 HA TRP 891 HA TRP 891 -12.949 -3.323 -1.325 308 HB2 TRP 891 HB1 TRP 891 -12.402 -1.493 -2.927 309 HB3 TRP 891 HB2 TRP 891 -12.007 -2.724 -4.128 310 HD1 TRP 891 HD1 TRP 891 -14.778 -0.875 -2.537 311 HE1 TRP 891 HE1 TRP 891 -17.028 -1.415 -3.609 312 HE3 TRP 891 HE3 TRP 891 -13.418 -5.075 -5.122 313 HZ2 TRP 891 HZ2 TRP 891 -18.182 -3.616 -5.097 314 HZ3 TRP 891 HZ3 TRP 891 -15.156 -6.465 -6.231 315 HH2 TRP 891 HH2 TRP 891 -17.530 -5.745 -6.199 316 H ILE 892 HN ILE 892 -13.924 -5.321 -1.527 317 HA ILE 892 HA ILE 892 -12.859 -7.270 -3.487 318 HB ILE 892 HB ILE 892 -12.845 -9.070 -1.863 319 HG12 ILE 892 HG11 ILE 892 -13.347 -7.073 0.366 320 HG13 ILE 892 HG12 ILE 892 -14.655 -7.984 -0.386 321 HG21 ILE 892 HG21 ILE 892 -10.860 -8.502 -0.595 322 HG22 ILE 892 HG22 ILE 892 -10.764 -7.725 -2.180 323 HG23 ILE 892 HG23 ILE 892 -11.183 -6.774 -0.742 324 HD11 ILE 892 HD1 ILE 892 -12.310 -9.331 0.956 325 HD12 ILE 892 HD2 ILE 892 -13.921 -9.081 1.648 326 HD13 ILE 892 HD3 ILE 892 -13.741 -10.092 0.194 327 H CYS 893 HN CYS 893 -14.280 -9.117 -3.940 328 HA CYS 893 HA CYS 893 -16.895 -8.514 -4.498 329 HB2 CYS 893 HB1 CYS 893 -15.977 -11.289 -3.717 330 HB3 CYS 893 HB2 CYS 893 -17.296 -10.837 -4.797 331 H MET 894 HN MET 894 -15.756 -9.962 -1.345 332 HA MET 894 HA MET 894 -18.450 -10.467 -0.431 333 HB2 MET 894 HB1 MET 894 -15.944 -10.178 1.254 334 HB3 MET 894 HB2 MET 894 -17.472 -10.903 1.746 335 HG2 MET 894 HG1 MET 894 -17.221 -12.577 -0.110 336 HG3 MET 894 HG2 MET 894 -15.594 -11.963 -0.399 337 HE1 MET 894 HE1 MET 894 -13.534 -12.357 1.155 338 HE2 MET 894 HE2 MET 894 -14.337 -11.480 2.482 339 HE3 MET 894 HE3 MET 894 -13.622 -13.077 2.777 340 H ASN 895 HN ASN 895 -16.843 -7.504 -0.729 341 HA ASN 895 HA ASN 895 -18.598 -6.132 1.248 342 HB2 ASN 895 HB1 ASN 895 -16.805 -4.908 1.677 343 HB3 ASN 895 HB2 ASN 895 -15.863 -5.862 0.542 344 HD21 ASN 895 HD21 ASN 895 -16.226 -5.147 -1.890 345 HD22 ASN 895 HD22 ASN 895 -16.171 -3.401 -2.102 346 H ASN 896 HN ASN 896 -18.593 -6.962 -1.988 347 HA ASN 896 HA ASN 896 -19.271 -4.721 -3.447 348 HB2 ASN 896 HB1 ASN 896 -18.761 -6.955 -4.389 349 HB3 ASN 896 HB2 ASN 896 -20.302 -7.555 -3.780 350 HD21 ASN 896 HD21 ASN 896 -20.428 -8.280 -6.050 351 HD22 ASN 896 HD22 ASN 896 -21.291 -7.165 -7.099 352 H SER 897 HN SER 897 -20.934 -3.505 -3.867 353 HA SER 897 HA SER 897 -23.249 -3.171 -2.264 354 HB2 SER 897 HB1 SER 897 -22.568 -2.365 -5.118 355 HB3 SER 897 HB2 SER 897 -24.092 -1.933 -4.352 356 HG SER 897 HG1 SER 897 -21.463 -1.256 -3.435 357 H ASP 898 HN ASP 898 -22.909 -4.908 -5.347 358 HA ASP 898 HA ASP 898 -25.791 -5.617 -5.324 359 HB2 ASP 898 HB1 ASP 898 -23.744 -6.210 -7.446 360 HB3 ASP 898 HB2 ASP 898 -25.470 -6.458 -7.563 361 H LYS 899 HN LYS 899 -26.297 -7.135 -4.067 362 HA LYS 899 HA LYS 899 -24.756 -9.280 -3.077 363 HB2 LYS 899 HB1 LYS 899 -27.779 -8.900 -3.183 364 HB3 LYS 899 HB2 LYS 899 -26.955 -10.130 -2.229 365 HG2 LYS 899 HG1 LYS 899 -26.210 -7.219 -1.844 366 HG3 LYS 899 HG2 LYS 899 -27.675 -7.856 -1.107 367 HD2 LYS 899 HD1 LYS 899 -25.016 -9.255 -0.765 368 HD3 LYS 899 HD2 LYS 899 -25.535 -7.921 0.300 369 HE2 LYS 899 HE1 LYS 899 -27.591 -9.175 0.871 370 HE3 LYS 899 HE2 LYS 899 -27.095 -10.498 -0.187 371 HZ1 LYS 899 HZ1 LYS 899 -26.516 -10.949 2.132 372 HZ2 LYS 899 HZ2 LYS 899 -25.147 -10.827 1.254 373 HZ3 LYS 899 HZ3 LYS 899 -25.609 -9.598 2.229 374 H ARG 900 HN ARG 900 -26.240 -9.092 -6.103 375 HA ARG 900 HA ARG 900 -26.653 -11.921 -6.724 376 HB2 ARG 900 HB1 ARG 900 -26.151 -9.421 -8.397 377 HB3 ARG 900 HB2 ARG 900 -26.369 -11.025 -9.103 378 HG2 ARG 900 HG1 ARG 900 -28.634 -11.182 -8.125 379 HG3 ARG 900 HG2 ARG 900 -28.415 -9.612 -7.335 380 HD2 ARG 900 HD1 ARG 900 -29.728 -9.294 -9.340 381 HD3 ARG 900 HD2 ARG 900 -28.146 -8.525 -9.541 382 HE ARG 900 HE ARG 900 -28.265 -11.261 -10.575 383 HH11 ARG 900 HH11 ARG 900 -28.940 -7.945 -11.480 384 HH12 ARG 900 HH12 ARG 900 -28.789 -8.284 -13.182 385 HH21 ARG 900 HH21 ARG 900 -28.110 -11.629 -12.758 386 HH22 ARG 900 HH22 ARG 900 -28.344 -10.321 -13.879 387 H PHE 901 HN PHE 901 -23.849 -9.825 -6.594 388 HA PHE 901 HA PHE 901 -22.090 -12.073 -7.542 389 HB2 PHE 901 HB1 PHE 901 -21.830 -9.139 -8.285 390 HB3 PHE 901 HB2 PHE 901 -20.876 -10.471 -8.915 391 HD1 PHE 901 HD1 PHE 901 -21.950 -12.123 -10.523 392 HD2 PHE 901 HD2 PHE 901 -23.927 -8.513 -9.259 393 HE1 PHE 901 HE1 PHE 901 -23.515 -12.317 -12.433 394 HE2 PHE 901 HE2 PHE 901 -25.499 -8.710 -11.166 395 HZ PHE 901 HZ PHE 901 -25.298 -10.614 -12.756 396 H ALA 902 HN ALA 902 -22.688 -10.894 -4.813 397 HA ALA 902 HA ALA 902 -20.171 -9.635 -4.050 398 HB1 ALA 902 HB1 ALA 902 -22.377 -8.577 -3.457 399 HB2 ALA 902 HB2 ALA 902 -22.751 -10.007 -2.457 400 HB3 ALA 902 HB3 ALA 902 -21.394 -8.948 -2.030 401 H ASP 903 HN ASP 903 -19.731 -12.216 -4.626 402 HA ASP 903 HA ASP 903 -18.272 -12.851 -2.185 403 HB2 ASP 903 HB1 ASP 903 -20.139 -14.853 -3.442 404 HB3 ASP 903 HB2 ASP 903 -18.701 -15.366 -2.578 405 H CYS 904 HN CYS 904 -16.307 -13.787 -2.532 406 HA CYS 904 HA CYS 904 -15.062 -13.398 -5.039 407 HB2 CYS 904 HB1 CYS 904 -14.327 -14.926 -2.505 408 HB3 CYS 904 HB2 CYS 904 -13.229 -14.700 -3.865 409 H SER 905 HN SER 905 -17.206 -15.819 -4.181 410 HA SER 905 HA SER 905 -16.156 -17.882 -6.039 411 HB2 SER 905 HB1 SER 905 -18.611 -17.933 -4.251 412 HB3 SER 905 HB2 SER 905 -17.988 -19.272 -5.238 413 HG SER 905 HG1 SER 905 -17.294 -19.417 -3.048 414 H LYS 906 HN LYS 906 -18.458 -15.235 -5.952 415 HA LYS 906 HA LYS 906 -20.216 -16.285 -8.068 416 HB2 LYS 906 HB1 LYS 906 -19.951 -13.596 -6.681 417 HB3 LYS 906 HB2 LYS 906 -21.118 -13.926 -7.973 418 HG2 LYS 906 HG1 LYS 906 -21.120 -15.120 -5.234 419 HG3 LYS 906 HG2 LYS 906 -22.256 -13.951 -5.922 420 HD2 LYS 906 HD1 LYS 906 -21.843 -16.852 -6.717 421 HD3 LYS 906 HD2 LYS 906 -23.212 -16.187 -5.816 422 HE2 LYS 906 HE1 LYS 906 -23.732 -14.773 -7.859 423 HE3 LYS 906 HE2 LYS 906 -22.493 -15.679 -8.731 424 HZ1 LYS 906 HZ1 LYS 906 -23.768 -17.718 -8.282 425 HZ2 LYS 906 HZ2 LYS 906 -24.915 -16.869 -7.484 426 HZ3 LYS 906 HZ3 LYS 906 -24.697 -16.640 -9.083 427 H SER 907 HN SER 907 -20.748 -14.659 -9.807 428 HA SER 907 HA SER 907 -18.324 -14.387 -11.519 429 HB2 SER 907 HB1 SER 907 -20.137 -15.964 -12.177 430 HB3 SER 907 HB2 SER 907 -21.239 -14.582 -12.333 431 HG SER 907 HG1 SER 907 -20.172 -15.269 -14.317 432 H GLN 908 HN GLN 908 -19.726 -12.712 -13.395 433 HA GLN 908 HA GLN 908 -20.440 -10.190 -12.086 434 HB2 GLN 908 HB1 GLN 908 -18.728 -8.834 -13.059 435 HB3 GLN 908 HB2 GLN 908 -17.944 -10.155 -12.195 436 HG2 GLN 908 HG1 GLN 908 -17.998 -11.320 -14.617 437 HG3 GLN 908 HG2 GLN 908 -18.243 -9.672 -15.140 438 HE21 GLN 908 HE21 GLN 908 -16.293 -9.317 -16.180 439 HE22 GLN 908 HE22 GLN 908 -14.718 -9.511 -15.402 440 H GLU 909 HN GLU 909 -21.208 -8.550 -13.704 441 HA GLU 909 HA GLU 909 -23.133 -9.795 -15.396 442 HB2 GLU 909 HB1 GLU 909 -22.252 -6.921 -15.027 443 HB3 GLU 909 HB2 GLU 909 -23.545 -7.363 -16.157 444 HG2 GLU 909 HG1 GLU 909 -24.938 -8.244 -14.447 445 HG3 GLU 909 HG2 GLU 909 -23.614 -8.311 -13.291 446 H MET 910 HN MET 910 -19.903 -8.715 -16.256 447 HA MET 910 HA MET 910 -20.282 -9.806 -18.980 448 HB2 MET 910 HB1 MET 910 -19.134 -7.011 -18.556 449 HB3 MET 910 HB2 MET 910 -19.155 -7.936 -20.052 450 HG2 MET 910 HG1 MET 910 -20.887 -6.529 -20.436 451 HG3 MET 910 HG2 MET 910 -21.759 -7.899 -19.763 452 HE1 MET 910 HE1 MET 910 -23.893 -4.886 -18.505 453 HE2 MET 910 HE2 MET 910 -23.111 -5.110 -20.086 454 HE3 MET 910 HE3 MET 910 -23.900 -6.487 -19.279 455 H SER 911 HN SER 911 -18.472 -10.957 -19.596 456 HA SER 911 HA SER 911 -16.270 -11.324 -17.735 457 HB2 SER 911 HB1 SER 911 -16.136 -12.043 -20.647 458 HB3 SER 911 HB2 SER 911 -15.320 -12.806 -19.288 459 HG SER 911 HG1 SER 911 -17.268 -13.666 -18.577 460 H ASN 912 HN ASN 912 -13.941 -11.004 -18.344 461 HA ASN 912 HA ASN 912 -13.534 -8.187 -18.424 462 HB2 ASN 912 HB1 ASN 912 -11.916 -9.475 -17.247 463 HB3 ASN 912 HB2 ASN 912 -11.654 -10.569 -18.616 464 HD21 ASN 912 HD21 ASN 912 -11.170 -7.215 -17.519 465 HD22 ASN 912 HD22 ASN 912 -9.751 -6.960 -18.542 466 H GLU 913 HN GLU 913 -13.296 -10.559 -21.023 467 HA GLU 913 HA GLU 913 -12.355 -8.650 -23.032 468 HB2 GLU 913 HB1 GLU 913 -12.428 -10.492 -24.546 469 HB3 GLU 913 HB2 GLU 913 -11.639 -10.999 -23.070 470 HG2 GLU 913 HG1 GLU 913 -14.597 -11.580 -23.377 471 HG3 GLU 913 HG2 GLU 913 -13.464 -12.469 -24.372 472 H GLU 914 HN GLU 914 -15.298 -8.855 -21.646 473 HA GLU 914 HA GLU 914 -16.853 -8.061 -24.078 474 HB2 GLU 914 HB1 GLU 914 -17.868 -9.127 -21.424 475 HB3 GLU 914 HB2 GLU 914 -18.849 -8.668 -22.814 476 HG2 GLU 914 HG1 GLU 914 -17.759 -10.490 -24.133 477 HG3 GLU 914 HG2 GLU 914 -16.891 -10.997 -22.680 478 H ILE 915 HN ILE 915 -16.164 -7.271 -20.610 479 HA ILE 915 HA ILE 915 -17.557 -4.730 -20.766 480 HB ILE 915 HB ILE 915 -17.373 -5.493 -18.590 481 HG12 ILE 915 HG11 ILE 915 -16.116 -3.816 -17.340 482 HG13 ILE 915 HG12 ILE 915 -15.156 -3.411 -18.761 483 HG21 ILE 915 HG21 ILE 915 -14.420 -6.017 -18.973 484 HG22 ILE 915 HG22 ILE 915 -15.206 -5.918 -17.375 485 HG23 ILE 915 HG23 ILE 915 -15.738 -7.125 -18.496 486 HD11 ILE 915 HD1 ILE 915 -17.140 -2.553 -19.896 487 HD12 ILE 915 HD2 ILE 915 -18.176 -3.083 -18.582 488 HD13 ILE 915 HD3 ILE 915 -16.958 -1.792 -18.346 489 H ASN 916 HN ASN 916 -14.064 -5.485 -20.973 490 HA ASN 916 HA ASN 916 -13.174 -2.875 -21.316 491 HB2 ASN 916 HB1 ASN 916 -11.131 -3.803 -22.210 492 HB3 ASN 916 HB2 ASN 916 -11.708 -4.878 -20.958 493 HD21 ASN 916 HD21 ASN 916 -9.818 -5.727 -22.853 494 HD22 ASN 916 HD22 ASN 916 -10.583 -6.879 -23.929 495 H GLU 917 HN GLU 917 -14.629 -4.845 -23.813 496 HA GLU 917 HA GLU 917 -14.253 -3.211 -26.114 497 HB2 GLU 917 HB1 GLU 917 -16.055 -5.387 -25.170 498 HB3 GLU 917 HB2 GLU 917 -16.635 -4.451 -26.529 499 HG2 GLU 917 HG1 GLU 917 -13.942 -5.889 -26.355 500 HG3 GLU 917 HG2 GLU 917 -15.372 -6.522 -27.162 501 H GLU 918 HN GLU 918 -16.614 -2.936 -23.476 502 HA GLU 918 HA GLU 918 -18.433 -1.120 -24.770 503 HB2 GLU 918 HB1 GLU 918 -18.803 -2.532 -22.613 504 HB3 GLU 918 HB2 GLU 918 -17.906 -1.281 -21.765 505 HG2 GLU 918 HG1 GLU 918 -20.257 -0.880 -21.512 506 HG3 GLU 918 HG2 GLU 918 -19.537 0.422 -22.442 507 H LEU 919 HN LEU 919 -15.560 -0.602 -22.714 508 HA LEU 919 HA LEU 919 -15.737 2.336 -22.962 509 HB2 LEU 919 HB1 LEU 919 -13.439 0.691 -21.849 510 HB3 LEU 919 HB2 LEU 919 -13.749 2.400 -21.643 511 HG LEU 919 HG LEU 919 -16.081 1.350 -20.612 512 HD11 LEU 919 HD11 LEU 919 -15.295 -0.474 -19.041 513 HD12 LEU 919 HD12 LEU 919 -15.435 -0.949 -20.735 514 HD13 LEU 919 HD13 LEU 919 -13.836 -0.623 -20.048 515 HD21 LEU 919 HD21 LEU 919 -14.691 3.059 -19.557 516 HD22 LEU 919 HD22 LEU 919 -15.049 1.771 -18.388 517 HD23 LEU 919 HD23 LEU 919 -13.451 1.856 -19.177 518 H GLY 920 HN GLY 920 -13.928 -0.327 -24.386 519 HA2 GLY 920 HA1 GLY 920 -13.017 -0.378 -26.575 520 HA3 GLY 920 HA2 GLY 920 -12.970 1.387 -26.630 521 H ILE 921 HN ILE 921 -11.713 -0.990 -24.263 522 HA ILE 921 HA ILE 921 -8.975 0.199 -24.474 523 HB ILE 921 HB ILE 921 -8.771 0.085 -22.066 524 HG12 ILE 921 HG11 ILE 921 -11.693 -0.776 -21.991 525 HG13 ILE 921 HG12 ILE 921 -10.297 -1.791 -21.615 526 HG21 ILE 921 HG21 ILE 921 -9.593 2.143 -23.206 527 HG22 ILE 921 HG22 ILE 921 -11.258 1.671 -22.803 528 HG23 ILE 921 HG23 ILE 921 -10.086 2.022 -21.516 529 HD11 ILE 921 HD1 ILE 921 -9.688 -0.247 -19.754 530 HD12 ILE 921 HD2 ILE 921 -11.221 0.622 -20.034 531 HD13 ILE 921 HD3 ILE 921 -11.242 -1.082 -19.546 532 H GLY 922 HN GLY 922 -7.323 -1.099 -23.318 533 HA2 GLY 922 HA1 GLY 922 -7.574 -4.040 -23.878 534 HA3 GLY 922 HA2 GLY 922 -6.168 -3.088 -24.347 535 H GLN 923 HN GLN 923 -7.916 -4.521 -21.703 536 HA GLN 923 HA GLN 923 -6.405 -3.408 -19.567 537 HB2 GLN 923 HB1 GLN 923 -8.756 -4.721 -19.701 538 HB3 GLN 923 HB2 GLN 923 -7.763 -6.078 -19.207 539 HG2 GLN 923 HG1 GLN 923 -8.790 -5.161 -17.283 540 HG3 GLN 923 HG2 GLN 923 -7.093 -4.718 -17.172 541 HE21 GLN 923 HE21 GLN 923 -9.495 -3.367 -15.933 542 HE22 GLN 923 HE22 GLN 923 -9.348 -1.709 -16.513 543 H ASP 924 HN ASP 924 -5.153 -4.480 -17.997 544 HA ASP 924 HA ASP 924 -2.786 -5.717 -19.050 545 HB2 ASP 924 HB1 ASP 924 -3.735 -5.656 -16.160 546 HB3 ASP 924 HB2 ASP 924 -2.083 -5.887 -16.719 547 H GLU 925 HN GLU 925 -5.681 -7.060 -17.636 548 HA GLU 925 HA GLU 925 -4.902 -9.809 -17.313 549 HB2 GLU 925 HB1 GLU 925 -6.845 -8.540 -16.340 550 HB3 GLU 925 HB2 GLU 925 -7.622 -8.560 -17.912 551 HG2 GLU 925 HG1 GLU 925 -7.664 -11.039 -17.879 552 HG3 GLU 925 HG2 GLU 925 -6.866 -11.030 -16.299 553 H ALA 926 HN ALA 926 -6.384 -8.006 -19.963 554 HA ALA 926 HA ALA 926 -6.771 -10.265 -21.765 555 HB1 ALA 926 HB1 ALA 926 -6.815 -7.261 -22.271 556 HB2 ALA 926 HB2 ALA 926 -7.458 -8.521 -23.344 557 HB3 ALA 926 HB3 ALA 926 -8.212 -8.245 -21.762 558 H ASP 927 HN ASP 927 -4.440 -7.628 -21.565 559 HA ASP 927 HA ASP 927 -2.602 -7.019 -22.577 560 HB2 ASP 927 HB1 ASP 927 -0.768 -8.468 -22.803 561 HB3 ASP 927 HB2 ASP 927 -1.685 -8.914 -21.384 562 H ALA 928 HN ALA 928 -4.942 -8.124 -24.397 563 HA ALA 928 HA ALA 928 -3.880 -8.241 -27.049 564 HB1 ALA 928 HB1 ALA 928 -6.097 -9.109 -26.410 565 HB2 ALA 928 HB2 ALA 928 -6.655 -7.457 -26.053 566 HB3 ALA 928 HB3 ALA 928 -6.235 -7.916 -27.715 567 H1 ALA 1 HT1 ALA 1 -9.130 -3.256 -6.576 568 H2 ALA 1 HT2 ALA 1 -8.612 -1.808 -5.994 569 H3 ALA 1 HT3 ALA 1 -7.989 -3.201 -5.393 570 HA ALA 1 HA ALA 1 -6.364 -2.287 -6.803 571 HB1 ALA 1 HB1 ALA 1 -6.165 -4.121 -8.521 572 HB2 ALA 1 HB2 ALA 1 -6.497 -4.719 -6.897 573 HB3 ALA 1 HB3 ALA 1 -7.801 -4.658 -8.081 574 H ARG 2 HN ARG 2 -5.867 -2.071 -9.343 575 HA ARG 2 HA ARG 2 -7.024 0.361 -10.130 576 HB2 ARG 2 HB1 ARG 2 -5.758 0.204 -12.108 577 HB3 ARG 2 HB2 ARG 2 -4.818 -0.580 -10.859 578 HG2 ARG 2 HG1 ARG 2 -4.740 -2.543 -11.956 579 HG3 ARG 2 HG2 ARG 2 -6.449 -2.581 -12.284 580 HD2 ARG 2 HD1 ARG 2 -4.331 -1.178 -13.946 581 HD3 ARG 2 HD2 ARG 2 -5.252 -2.631 -14.347 582 HE ARG 2 HE ARG 2 -6.973 -0.325 -13.876 583 HH11 ARG 2 HH11 ARG 2 -5.004 -1.844 -16.378 584 HH12 ARG 2 HH12 ARG 2 -5.973 -1.112 -17.638 585 HH21 ARG 2 HH21 ARG 2 -7.982 0.725 -15.565 586 HH22 ARG 2 HH22 ARG 2 -7.531 0.311 -17.198 587 H THR 3 HN THR 3 -8.334 1.012 -11.985 588 HA THR 3 HA THR 3 -9.964 -1.054 -13.259 589 HB THR 3 HB THR 3 -10.941 -0.778 -10.932 590 HG1 THR 3 HG1 THR 3 -12.416 -1.515 -12.265 591 HG21 THR 3 HG21 THR 3 -12.183 1.171 -10.325 592 HG22 THR 3 HG22 THR 3 -10.556 1.717 -10.734 593 HG23 THR 3 HG23 THR 3 -11.894 1.956 -11.884 594 H MLZ 4 HN MLZ 4 -12.181 0.539 -13.904 595 HA MLZ 4 HA MLZ 4 -11.188 2.560 -15.794 596 HB2 MLZ 4 HB1 MLZ 4 -11.859 1.389 -17.718 597 HB3 MLZ 4 HB2 MLZ 4 -10.972 0.194 -16.819 598 HG2 MLZ 4 HG1 MLZ 4 -14.025 0.401 -16.790 599 HG3 MLZ 4 HG2 MLZ 4 -13.117 -0.523 -17.972 600 HD2 MLZ 4 HD1 MLZ 4 -12.821 -1.109 -15.041 601 HD3 MLZ 4 HD2 MLZ 4 -14.143 -1.781 -15.990 602 HE2 MLZ 4 HE1 MLZ 4 -11.346 -2.051 -17.054 603 HE3 MLZ 4 HE2 MLZ 4 -11.806 -3.051 -15.657 604 HZ MLZ 4 HZ1 MLZ 4 -13.344 -2.994 -18.210 605 HCM1 MLZ 4 HC1 MLZ 4 -12.294 -5.169 -18.618 606 HCM2 MLZ 4 HC2 MLZ 4 -11.095 -3.864 -18.536 607 HCM3 MLZ 4 HC3 MLZ 4 -11.352 -4.921 -17.133 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.606 -3.994 -16.935 609 H GLN 5 HN GLN 5 -12.973 3.710 -16.874 610 HA GLN 5 HA GLN 5 -15.354 3.970 -15.086 611 HB2 GLN 5 HB1 GLN 5 -13.585 6.136 -16.274 612 HB3 GLN 5 HB2 GLN 5 -15.171 6.406 -15.560 613 HG2 GLN 5 HG1 GLN 5 -13.794 6.912 -13.805 614 HG3 GLN 5 HG2 GLN 5 -14.291 5.280 -13.422 615 HE21 GLN 5 HE21 GLN 5 -12.189 6.153 -12.045 616 HE22 GLN 5 HE22 GLN 5 -10.731 5.342 -12.631 617 H THR 6 HN THR 6 -16.852 2.889 -16.274 618 HA THR 6 HA THR 6 -17.371 3.248 -19.052 619 HB THR 6 HB THR 6 -19.792 2.519 -18.229 620 HG1 THR 6 HG1 THR 6 -19.426 2.631 -16.043 621 HG21 THR 6 HG21 THR 6 -19.066 0.203 -18.427 622 HG22 THR 6 HG22 THR 6 -18.287 1.203 -19.653 623 HG23 THR 6 HG23 THR 6 -17.361 0.697 -18.218 624 H ALA 7 HN ALA 7 -18.435 4.756 -20.169 625 HA ALA 7 HA ALA 7 -20.175 6.772 -18.862 626 HB1 ALA 7 HB1 ALA 7 -17.629 7.450 -20.397 627 HB2 ALA 7 HB2 ALA 7 -18.782 8.615 -19.706 628 HB3 ALA 7 HB3 ALA 7 -17.832 7.572 -18.635 629 H ARG 8 HN ARG 8 -20.600 4.628 -20.878 630 HA ARG 8 HA ARG 8 -20.963 5.923 -23.494 631 HB2 ARG 8 HB1 ARG 8 -21.700 3.127 -22.525 632 HB3 ARG 8 HB2 ARG 8 -21.788 3.696 -24.189 633 HG2 ARG 8 HG1 ARG 8 -19.278 3.319 -22.512 634 HG3 ARG 8 HG2 ARG 8 -19.823 2.342 -23.866 635 HD2 ARG 8 HD1 ARG 8 -18.882 5.232 -24.019 636 HD3 ARG 8 HD2 ARG 8 -17.957 3.820 -24.497 637 HE ARG 8 HE ARG 8 -20.093 5.131 -26.001 638 HH11 ARG 8 HH11 ARG 8 -18.340 2.085 -25.745 639 HH12 ARG 8 HH12 ARG 8 -18.695 1.667 -27.402 640 HH21 ARG 8 HH21 ARG 8 -20.529 4.492 -28.070 641 HH22 ARG 8 HH22 ARG 8 -19.910 2.980 -28.665 642 H TYR 9 HN TYR 9 -22.302 7.608 -22.538 643 HA TYR 9 HA TYR 9 -25.049 7.163 -21.823 644 HB2 TYR 9 HB1 TYR 9 -25.317 9.547 -22.067 645 HB3 TYR 9 HB2 TYR 9 -23.853 9.175 -21.186 646 HD1 TYR 9 HD1 TYR 9 -25.217 10.434 -24.406 647 HD2 TYR 9 HD2 TYR 9 -21.674 9.856 -22.017 648 HE1 TYR 9 HE1 TYR 9 -23.941 11.927 -25.939 649 HE2 TYR 9 HE2 TYR 9 -20.394 11.340 -23.557 650 HH TYR 9 HH TYR 9 -21.917 12.889 -26.411 Start of MODEL 7 1 H1 GLY 850 HT1 GLY 850 -6.006 -10.643 -7.453 2 H2 GLY 850 HT2 GLY 850 -5.602 -10.149 -5.945 3 H3 GLY 850 HT3 GLY 850 -5.007 -11.565 -6.534 4 HA2 GLY 850 HA1 GLY 850 -3.285 -9.895 -6.597 5 HA3 GLY 850 HA2 GLY 850 -3.755 -10.385 -8.237 6 H SER 851 HN SER 851 -2.707 -7.758 -6.922 7 HA SER 851 HA SER 851 -4.614 -5.876 -8.189 8 HB2 SER 851 HB1 SER 851 -4.986 -4.634 -6.166 9 HB3 SER 851 HB2 SER 851 -5.438 -6.315 -5.882 10 HG SER 851 HG1 SER 851 -3.527 -6.625 -4.747 11 H ARG 852 HN ARG 852 -3.800 -3.517 -7.530 12 HA ARG 852 HA ARG 852 -2.397 -1.865 -8.207 13 HB2 ARG 852 HB1 ARG 852 -0.338 -3.550 -6.728 14 HB3 ARG 852 HB2 ARG 852 -0.031 -1.951 -7.381 15 HG2 ARG 852 HG1 ARG 852 -0.473 -1.546 -5.158 16 HG3 ARG 852 HG2 ARG 852 -1.947 -1.067 -5.995 17 HD2 ARG 852 HD1 ARG 852 -2.890 -3.346 -5.345 18 HD3 ARG 852 HD2 ARG 852 -1.463 -3.581 -4.332 19 HE ARG 852 HE ARG 852 -2.371 -1.208 -3.399 20 HH11 ARG 852 HH11 ARG 852 -4.187 -4.177 -3.952 21 HH12 ARG 852 HH12 ARG 852 -5.610 -3.522 -3.145 22 HH21 ARG 852 HH21 ARG 852 -4.112 -0.612 -2.175 23 HH22 ARG 852 HH22 ARG 852 -5.492 -1.665 -2.008 24 H ARG 853 HN ARG 853 -3.038 -3.782 -10.096 25 HA ARG 853 HA ARG 853 -0.759 -4.179 -11.933 26 HB2 ARG 853 HB1 ARG 853 -3.725 -4.886 -11.972 27 HB3 ARG 853 HB2 ARG 853 -2.698 -5.175 -13.356 28 HG2 ARG 853 HG1 ARG 853 -2.068 -6.359 -10.620 29 HG3 ARG 853 HG2 ARG 853 -3.083 -7.147 -11.827 30 HD2 ARG 853 HD1 ARG 853 -1.169 -6.907 -13.493 31 HD3 ARG 853 HD2 ARG 853 -0.162 -6.357 -12.152 32 HE ARG 853 HE ARG 853 0.031 -8.531 -11.408 33 HH11 ARG 853 HH11 ARG 853 -2.711 -8.506 -13.651 34 HH12 ARG 853 HH12 ARG 853 -2.790 -10.239 -13.671 35 HH21 ARG 853 HH21 ARG 853 -0.061 -10.727 -11.622 36 HH22 ARG 853 HH22 ARG 853 -1.172 -11.459 -12.741 37 H ALA 854 HN ALA 854 -0.883 -3.645 -14.101 38 HA ALA 854 HA ALA 854 -0.928 -2.326 -15.902 39 HB1 ALA 854 HB1 ALA 854 -3.184 -3.265 -15.928 40 HB2 ALA 854 HB2 ALA 854 -3.794 -1.858 -15.033 41 HB3 ALA 854 HB3 ALA 854 -3.151 -1.660 -16.675 42 H SER 855 HN SER 855 -1.422 -0.169 -16.953 43 HA SER 855 HA SER 855 -0.315 2.005 -15.324 44 HB2 SER 855 HB1 SER 855 -0.400 3.270 -17.442 45 HB3 SER 855 HB2 SER 855 0.583 1.820 -17.463 46 HG SER 855 HG1 SER 855 -1.997 2.210 -18.628 47 H VAL 856 HN VAL 856 -1.151 4.009 -15.255 48 HA VAL 856 HA VAL 856 -2.510 5.527 -14.369 49 HB VAL 856 HB VAL 856 -4.328 6.373 -15.646 50 HG11 VAL 856 HG11 VAL 856 -3.162 6.840 -17.697 51 HG12 VAL 856 HG12 VAL 856 -2.031 6.821 -16.335 52 HG13 VAL 856 HG13 VAL 856 -2.089 5.444 -17.464 53 HG21 VAL 856 HG21 VAL 856 -5.466 4.270 -16.321 54 HG22 VAL 856 HG22 VAL 856 -5.214 5.417 -17.646 55 HG23 VAL 856 HG23 VAL 856 -4.168 3.994 -17.514 56 H GLY 857 HN GLY 857 -4.660 6.274 -13.576 57 HA2 GLY 857 HA1 GLY 857 -6.727 4.669 -12.650 58 HA3 GLY 857 HA2 GLY 857 -5.463 4.528 -11.422 59 H SER 858 HN SER 858 -8.195 6.092 -11.975 60 HA SER 858 HA SER 858 -7.608 8.393 -10.248 61 HB2 SER 858 HB1 SER 858 -7.021 9.117 -12.596 62 HB3 SER 858 HB2 SER 858 -8.718 8.863 -13.037 63 HG SER 858 HG1 SER 858 -8.214 11.052 -12.442 64 H GLU 859 HN GLU 859 -9.774 9.778 -10.186 65 HA GLU 859 HA GLU 859 -12.059 8.028 -9.504 66 HB2 GLU 859 HB1 GLU 859 -11.831 11.069 -9.465 67 HB3 GLU 859 HB2 GLU 859 -13.177 10.106 -8.883 68 HG2 GLU 859 HG1 GLU 859 -12.048 10.653 -6.952 69 HG3 GLU 859 HG2 GLU 859 -11.599 8.979 -7.254 70 H PHE 860 HN PHE 860 -14.283 9.005 -10.367 71 HA PHE 860 HA PHE 860 -14.392 9.820 -13.037 72 HB2 PHE 860 HB1 PHE 860 -15.640 7.156 -12.608 73 HB3 PHE 860 HB2 PHE 860 -15.473 8.042 -14.087 74 HD1 PHE 860 HD1 PHE 860 -13.307 8.162 -15.307 75 HD2 PHE 860 HD2 PHE 860 -13.827 5.652 -11.842 76 HE1 PHE 860 HE1 PHE 860 -11.255 6.918 -15.903 77 HE2 PHE 860 HE2 PHE 860 -11.765 4.405 -12.440 78 HZ PHE 860 HZ PHE 860 -10.473 5.028 -14.473 79 H THR 861 HN THR 861 -15.889 10.958 -12.852 80 HA THR 861 HA THR 861 -18.300 10.959 -11.159 81 HB THR 861 HB THR 861 -19.157 12.627 -13.000 82 HG1 THR 861 HG1 THR 861 -17.544 12.289 -14.523 83 HG21 THR 861 HG21 THR 861 -17.990 14.451 -11.847 84 HG22 THR 861 HG22 THR 861 -18.605 13.214 -10.730 85 HG23 THR 861 HG23 THR 861 -16.864 13.276 -11.118 86 H GLU 862 HN GLU 862 -20.387 10.571 -11.761 87 HA GLU 862 HA GLU 862 -21.993 9.141 -12.326 88 HB2 GLU 862 HB1 GLU 862 -21.455 10.347 -14.645 89 HB3 GLU 862 HB2 GLU 862 -21.040 8.682 -15.112 90 HG2 GLU 862 HG1 GLU 862 -23.283 7.938 -14.403 91 HG3 GLU 862 HG2 GLU 862 -23.660 9.556 -13.823 92 H SER 863 HN SER 863 -22.617 6.934 -12.850 93 HA SER 863 HA SER 863 -21.192 5.172 -11.290 94 HB2 SER 863 HB1 SER 863 -22.589 3.371 -12.085 95 HB3 SER 863 HB2 SER 863 -23.550 4.836 -11.859 96 HG SER 863 HG1 SER 863 -23.651 5.114 -14.055 97 H ALA 864 HN ALA 864 -19.746 3.558 -11.427 98 HA ALA 864 HA ALA 864 -18.185 3.265 -13.966 99 HB1 ALA 864 HB1 ALA 864 -17.135 4.130 -11.238 100 HB2 ALA 864 HB2 ALA 864 -16.144 3.845 -12.680 101 HB3 ALA 864 HB3 ALA 864 -17.300 5.189 -12.655 102 H TRP 865 HN TRP 865 -16.348 1.535 -13.570 103 HA TRP 865 HA TRP 865 -17.494 -0.731 -11.983 104 HB2 TRP 865 HB1 TRP 865 -15.169 -0.512 -13.893 105 HB3 TRP 865 HB2 TRP 865 -15.698 -2.002 -13.118 106 HD1 TRP 865 HD1 TRP 865 -16.903 0.561 -15.718 107 HE1 TRP 865 HE1 TRP 865 -18.750 -0.457 -17.173 108 HE3 TRP 865 HE3 TRP 865 -17.386 -3.912 -13.320 109 HZ2 TRP 865 HZ2 TRP 865 -20.217 -2.964 -17.296 110 HZ3 TRP 865 HZ3 TRP 865 -18.968 -5.654 -14.174 111 HH2 TRP 865 HH2 TRP 865 -20.387 -5.167 -16.124 112 H VAL 866 HN VAL 866 -15.923 -2.067 -10.781 113 HA VAL 866 HA VAL 866 -13.455 -0.825 -9.796 114 HB VAL 866 HB VAL 866 -15.048 -0.104 -8.121 115 HG11 VAL 866 HG11 VAL 866 -16.688 -1.994 -8.336 116 HG12 VAL 866 HG12 VAL 866 -15.538 -3.048 -7.505 117 HG13 VAL 866 HG13 VAL 866 -16.223 -1.641 -6.668 118 HG21 VAL 866 HG21 VAL 866 -13.913 -0.822 -6.148 119 HG22 VAL 866 HG22 VAL 866 -13.277 -2.264 -6.945 120 HG23 VAL 866 HG23 VAL 866 -12.723 -0.649 -7.452 121 H ARG 867 HN ARG 867 -11.870 -2.323 -9.248 122 HA ARG 867 HA ARG 867 -12.311 -5.121 -10.094 123 HB2 ARG 867 HB1 ARG 867 -10.139 -3.379 -10.320 124 HB3 ARG 867 HB2 ARG 867 -9.663 -4.395 -8.976 125 HG2 ARG 867 HG1 ARG 867 -9.964 -6.419 -10.337 126 HG3 ARG 867 HG2 ARG 867 -10.563 -5.463 -11.691 127 HD2 ARG 867 HD1 ARG 867 -8.522 -5.357 -12.448 128 HD3 ARG 867 HD2 ARG 867 -8.143 -4.193 -11.201 129 HE ARG 867 HE ARG 867 -7.649 -6.595 -9.920 130 HH11 ARG 867 HH11 ARG 867 -6.757 -5.679 -13.185 131 HH12 ARG 867 HH12 ARG 867 -5.451 -6.803 -13.262 132 HH21 ARG 867 HH21 ARG 867 -5.862 -7.933 -10.017 133 HH22 ARG 867 HH22 ARG 867 -5.020 -8.086 -11.546 134 H CYS 868 HN CYS 868 -12.252 -6.909 -8.751 135 HA CYS 868 HA CYS 868 -12.028 -6.585 -5.839 136 HB2 CYS 868 HB1 CYS 868 -13.483 -8.327 -6.682 137 HB3 CYS 868 HB2 CYS 868 -12.158 -9.037 -7.614 138 H ASP 869 HN ASP 869 -10.165 -6.278 -4.826 139 HA ASP 869 HA ASP 869 -7.564 -6.639 -6.030 140 HB2 ASP 869 HB1 ASP 869 -8.559 -6.105 -3.204 141 HB3 ASP 869 HB2 ASP 869 -6.852 -6.343 -3.549 142 H ASP 870 HN ASP 870 -9.652 -8.941 -4.488 143 HA ASP 870 HA ASP 870 -7.432 -10.729 -3.686 144 HB2 ASP 870 HB1 ASP 870 -9.530 -10.369 -2.290 145 HB3 ASP 870 HB2 ASP 870 -10.423 -11.251 -3.517 146 H CYS 871 HN CYS 871 -10.166 -10.636 -6.000 147 HA CYS 871 HA CYS 871 -9.025 -12.797 -7.650 148 HB2 CYS 871 HB1 CYS 871 -11.537 -11.085 -7.999 149 HB3 CYS 871 HB2 CYS 871 -11.055 -12.473 -9.001 150 H PHE 872 HN PHE 872 -10.514 -10.325 -9.188 151 HA PHE 872 HA PHE 872 -8.898 -8.479 -10.311 152 HB2 PHE 872 HB1 PHE 872 -8.224 -9.461 -12.523 153 HB3 PHE 872 HB2 PHE 872 -7.292 -9.985 -11.148 154 HD1 PHE 872 HD1 PHE 872 -10.062 -11.073 -13.447 155 HD2 PHE 872 HD2 PHE 872 -6.993 -12.317 -10.691 156 HE1 PHE 872 HE1 PHE 872 -10.469 -13.433 -14.066 157 HE2 PHE 872 HE2 PHE 872 -7.413 -14.685 -11.304 158 HZ PHE 872 HZ PHE 872 -9.148 -15.249 -12.992 159 H LYS 873 HN LYS 873 -11.502 -10.693 -10.576 160 HA LYS 873 HA LYS 873 -13.304 -9.998 -12.458 161 HB2 LYS 873 HB1 LYS 873 -13.509 -11.392 -10.359 162 HB3 LYS 873 HB2 LYS 873 -14.025 -9.905 -9.530 163 HG2 LYS 873 HG1 LYS 873 -16.021 -9.769 -10.812 164 HG3 LYS 873 HG2 LYS 873 -15.316 -10.728 -12.120 165 HD2 LYS 873 HD1 LYS 873 -16.857 -12.186 -11.127 166 HD3 LYS 873 HD2 LYS 873 -15.251 -12.695 -10.604 167 HE2 LYS 873 HE1 LYS 873 -15.788 -11.035 -8.561 168 HE3 LYS 873 HE2 LYS 873 -17.462 -11.295 -9.050 169 HZ1 LYS 873 HZ1 LYS 873 -16.841 -12.885 -7.357 170 HZ2 LYS 873 HZ2 LYS 873 -17.041 -13.714 -8.764 171 HZ3 LYS 873 HZ3 LYS 873 -15.535 -13.391 -8.205 172 H TRP 874 HN TRP 874 -14.879 -8.394 -12.804 173 HA TRP 874 HA TRP 874 -14.483 -5.771 -11.442 174 HB2 TRP 874 HB1 TRP 874 -15.598 -6.244 -14.224 175 HB3 TRP 874 HB2 TRP 874 -15.322 -4.689 -13.448 176 HD1 TRP 874 HD1 TRP 874 -13.544 -7.370 -15.361 177 HE1 TRP 874 HE1 TRP 874 -11.036 -6.800 -15.643 178 HE3 TRP 874 HE3 TRP 874 -13.284 -3.249 -12.369 179 HZ2 TRP 874 HZ2 TRP 874 -9.218 -4.869 -14.745 180 HZ3 TRP 874 HZ3 TRP 874 -11.078 -2.138 -12.004 181 HH2 TRP 874 HH2 TRP 874 -9.090 -2.805 -13.259 182 H ARG 875 HN ARG 875 -16.285 -4.497 -10.912 183 HA ARG 875 HA ARG 875 -19.024 -5.614 -11.199 184 HB2 ARG 875 HB1 ARG 875 -17.660 -4.859 -8.577 185 HB3 ARG 875 HB2 ARG 875 -19.401 -4.790 -8.748 186 HG2 ARG 875 HG1 ARG 875 -17.667 -7.280 -9.000 187 HG3 ARG 875 HG2 ARG 875 -18.753 -6.879 -7.684 188 HD2 ARG 875 HD1 ARG 875 -19.473 -7.692 -10.496 189 HD3 ARG 875 HD2 ARG 875 -19.859 -8.513 -8.982 190 HE ARG 875 HE ARG 875 -21.124 -6.046 -8.729 191 HH11 ARG 875 HH11 ARG 875 -21.388 -8.640 -11.064 192 HH12 ARG 875 HH12 ARG 875 -22.956 -8.043 -11.618 193 HH21 ARG 875 HH21 ARG 875 -23.275 -5.566 -9.418 194 HH22 ARG 875 HH22 ARG 875 -23.860 -6.437 -10.842 195 H ARG 876 HN ARG 876 -20.533 -4.100 -11.572 196 HA ARG 876 HA ARG 876 -19.711 -1.322 -12.039 197 HB2 ARG 876 HB1 ARG 876 -21.205 -2.612 -13.583 198 HB3 ARG 876 HB2 ARG 876 -22.419 -2.693 -12.310 199 HG2 ARG 876 HG1 ARG 876 -23.060 -0.980 -13.829 200 HG3 ARG 876 HG2 ARG 876 -22.557 -0.173 -12.344 201 HD2 ARG 876 HD1 ARG 876 -20.397 0.414 -13.363 202 HD3 ARG 876 HD2 ARG 876 -20.777 -0.517 -14.805 203 HE ARG 876 HE ARG 876 -21.843 2.136 -14.049 204 HH11 ARG 876 HH11 ARG 876 -22.166 -0.524 -16.327 205 HH12 ARG 876 HH12 ARG 876 -23.243 0.412 -17.351 206 HH21 ARG 876 HH21 ARG 876 -23.132 3.227 -15.430 207 HH22 ARG 876 HH22 ARG 876 -23.626 2.484 -16.956 208 H ILE 877 HN ILE 877 -19.924 0.298 -10.692 209 HA ILE 877 HA ILE 877 -21.675 0.155 -8.272 210 HB ILE 877 HB ILE 877 -19.857 1.119 -6.955 211 HG12 ILE 877 HG11 ILE 877 -18.064 0.832 -9.391 212 HG13 ILE 877 HG12 ILE 877 -18.704 2.354 -8.813 213 HG21 ILE 877 HG21 ILE 877 -20.163 -1.371 -7.180 214 HG22 ILE 877 HG22 ILE 877 -18.843 -1.364 -8.368 215 HG23 ILE 877 HG23 ILE 877 -18.549 -0.874 -6.679 216 HD11 ILE 877 HD1 ILE 877 -16.368 1.924 -8.112 217 HD12 ILE 877 HD2 ILE 877 -17.482 2.269 -6.790 218 HD13 ILE 877 HD3 ILE 877 -16.940 0.611 -7.073 219 HA PRO 878 HA PRO 878 -22.458 4.506 -9.203 220 HB2 PRO 878 HB1 PRO 878 -22.933 5.600 -6.736 221 HB3 PRO 878 HB2 PRO 878 -24.096 4.504 -7.546 222 HG2 PRO 878 HG1 PRO 878 -22.009 3.782 -5.459 223 HG3 PRO 878 HG2 PRO 878 -23.752 3.363 -5.465 224 HD2 PRO 878 HD1 PRO 878 -21.868 1.625 -6.355 225 HD3 PRO 878 HD2 PRO 878 -23.451 1.751 -7.168 226 H ALA 879 HN ALA 879 -21.276 6.354 -9.346 227 HA ALA 879 HA ALA 879 -18.558 6.561 -8.925 228 HB1 ALA 879 HB1 ALA 879 -20.618 8.825 -8.831 229 HB2 ALA 879 HB2 ALA 879 -18.915 8.965 -9.322 230 HB3 ALA 879 HB3 ALA 879 -20.061 8.038 -10.311 231 H SER 880 HN SER 880 -21.046 7.184 -6.504 232 HA SER 880 HA SER 880 -19.579 8.654 -4.567 233 HB2 SER 880 HB1 SER 880 -21.711 6.537 -4.073 234 HB3 SER 880 HB2 SER 880 -21.270 7.872 -2.994 235 HG SER 880 HG1 SER 880 -22.099 9.330 -4.498 236 H VAL 881 HN VAL 881 -19.455 5.240 -5.427 237 HA VAL 881 HA VAL 881 -17.682 4.615 -3.124 238 HB VAL 881 HB VAL 881 -18.946 2.836 -5.242 239 HG11 VAL 881 HG11 VAL 881 -18.121 0.910 -3.983 240 HG12 VAL 881 HG12 VAL 881 -16.746 1.875 -4.523 241 HG13 VAL 881 HG13 VAL 881 -17.292 1.977 -2.832 242 HG21 VAL 881 HG21 VAL 881 -20.226 1.899 -3.362 243 HG22 VAL 881 HG22 VAL 881 -19.460 3.055 -2.250 244 HG23 VAL 881 HG23 VAL 881 -20.541 3.627 -3.535 245 H VAL 882 HN VAL 882 -17.610 4.953 -6.674 246 HA VAL 882 HA VAL 882 -14.905 4.025 -6.790 247 HB VAL 882 HB VAL 882 -16.673 4.381 -8.732 248 HG11 VAL 882 HG11 VAL 882 -14.787 6.707 -9.285 249 HG12 VAL 882 HG12 VAL 882 -16.164 6.155 -10.250 250 HG13 VAL 882 HG13 VAL 882 -16.434 6.927 -8.680 251 HG21 VAL 882 HG21 VAL 882 -14.854 3.991 -10.335 252 HG22 VAL 882 HG22 VAL 882 -13.656 4.583 -9.165 253 HG23 VAL 882 HG23 VAL 882 -14.548 3.084 -8.854 254 H GLY 883 HN GLY 883 -16.186 7.072 -5.892 255 HA2 GLY 883 HA1 GLY 883 -13.658 8.577 -6.036 256 HA3 GLY 883 HA2 GLY 883 -15.179 9.096 -5.304 257 H SER 884 HN SER 884 -15.120 6.395 -3.753 258 HA SER 884 HA SER 884 -13.551 7.354 -1.425 259 HB2 SER 884 HB1 SER 884 -15.892 6.658 -1.120 260 HB3 SER 884 HB2 SER 884 -15.500 5.041 -1.734 261 HG SER 884 HG1 SER 884 -15.487 5.196 0.586 262 H ILE 885 HN ILE 885 -13.771 4.538 -3.597 263 HA ILE 885 HA ILE 885 -11.628 3.024 -2.405 264 HB ILE 885 HB ILE 885 -13.333 2.843 -4.868 265 HG12 ILE 885 HG11 ILE 885 -13.872 0.645 -4.046 266 HG13 ILE 885 HG12 ILE 885 -12.608 0.693 -2.815 267 HG21 ILE 885 HG21 ILE 885 -10.837 1.142 -4.509 268 HG22 ILE 885 HG22 ILE 885 -12.168 0.822 -5.640 269 HG23 ILE 885 HG23 ILE 885 -11.190 2.267 -5.851 270 HD11 ILE 885 HD1 ILE 885 -14.947 1.034 -1.951 271 HD12 ILE 885 HD2 ILE 885 -13.836 2.348 -1.533 272 HD13 ILE 885 HD3 ILE 885 -15.013 2.549 -2.853 273 H ASP 886 HN ASP 886 -9.529 2.980 -2.753 274 HA ASP 886 HA ASP 886 -8.247 4.231 -5.103 275 HB2 ASP 886 HB1 ASP 886 -8.535 5.893 -3.098 276 HB3 ASP 886 HB2 ASP 886 -7.353 4.901 -2.276 277 H GLU 887 HN GLU 887 -5.709 3.904 -4.763 278 HA GLU 887 HA GLU 887 -5.149 1.085 -4.326 279 HB2 GLU 887 HB1 GLU 887 -3.288 3.475 -4.544 280 HB3 GLU 887 HB2 GLU 887 -2.759 1.797 -4.625 281 HG2 GLU 887 HG1 GLU 887 -4.681 3.058 -6.622 282 HG3 GLU 887 HG2 GLU 887 -2.939 2.985 -6.830 283 H SER 888 HN SER 888 -5.546 3.602 -2.121 284 HA SER 888 HA SER 888 -3.990 2.264 0.027 285 HB2 SER 888 HB1 SER 888 -4.707 4.091 1.416 286 HB3 SER 888 HB2 SER 888 -4.078 4.708 -0.131 287 HG SER 888 HG1 SER 888 -6.051 5.731 0.496 288 H SER 889 HN SER 889 -7.083 1.938 -1.415 289 HA SER 889 HA SER 889 -8.462 0.829 0.948 290 HB2 SER 889 HB1 SER 889 -9.372 0.942 -1.954 291 HB3 SER 889 HB2 SER 889 -10.373 0.625 -0.535 292 HG SER 889 HG1 SER 889 -9.966 2.754 0.168 293 H ARG 890 HN ARG 890 -9.634 -1.275 0.630 294 HA ARG 890 HA ARG 890 -8.319 -3.261 -1.165 295 HB2 ARG 890 HB1 ARG 890 -8.840 -3.685 1.803 296 HB3 ARG 890 HB2 ARG 890 -8.456 -4.967 0.644 297 HG2 ARG 890 HG1 ARG 890 -6.290 -3.839 0.126 298 HG3 ARG 890 HG2 ARG 890 -6.650 -2.620 1.368 299 HD2 ARG 890 HD1 ARG 890 -6.777 -4.400 3.082 300 HD3 ARG 890 HD2 ARG 890 -6.395 -5.615 1.844 301 HE ARG 890 HE ARG 890 -4.367 -3.620 1.792 302 HH11 ARG 890 HH11 ARG 890 -5.414 -6.169 3.953 303 HH12 ARG 890 HH12 ARG 890 -3.824 -6.368 4.639 304 HH21 ARG 890 HH21 ARG 890 -2.363 -3.923 2.709 305 HH22 ARG 890 HH22 ARG 890 -2.147 -5.124 3.948 306 H TRP 891 HN TRP 891 -10.127 -2.859 -2.533 307 HA TRP 891 HA TRP 891 -12.844 -3.455 -1.504 308 HB2 TRP 891 HB1 TRP 891 -12.407 -1.536 -3.037 309 HB3 TRP 891 HB2 TRP 891 -12.058 -2.700 -4.316 310 HD1 TRP 891 HD1 TRP 891 -14.767 -0.947 -2.526 311 HE1 TRP 891 HE1 TRP 891 -17.069 -1.469 -3.499 312 HE3 TRP 891 HE3 TRP 891 -13.509 -5.019 -5.347 313 HZ2 TRP 891 HZ2 TRP 891 -18.276 -3.624 -5.017 314 HZ3 TRP 891 HZ3 TRP 891 -15.292 -6.376 -6.440 315 HH2 TRP 891 HH2 TRP 891 -17.663 -5.697 -6.237 316 H ILE 892 HN ILE 892 -13.796 -5.461 -1.760 317 HA ILE 892 HA ILE 892 -12.804 -7.292 -3.899 318 HB ILE 892 HB ILE 892 -12.736 -9.149 -2.282 319 HG12 ILE 892 HG11 ILE 892 -12.853 -7.125 -0.040 320 HG13 ILE 892 HG12 ILE 892 -14.308 -7.955 -0.637 321 HG21 ILE 892 HG21 ILE 892 -10.633 -7.918 -2.845 322 HG22 ILE 892 HG22 ILE 892 -10.852 -6.920 -1.395 323 HG23 ILE 892 HG23 ILE 892 -10.596 -8.660 -1.239 324 HD11 ILE 892 HD1 ILE 892 -13.430 -8.998 1.323 325 HD12 ILE 892 HD2 ILE 892 -13.456 -10.083 -0.094 326 HD13 ILE 892 HD3 ILE 892 -11.910 -9.378 0.486 327 H CYS 893 HN CYS 893 -14.239 -9.230 -4.226 328 HA CYS 893 HA CYS 893 -16.891 -8.654 -4.608 329 HB2 CYS 893 HB1 CYS 893 -15.853 -11.401 -3.842 330 HB3 CYS 893 HB2 CYS 893 -17.295 -10.995 -4.788 331 H MET 894 HN MET 894 -15.528 -9.941 -1.494 332 HA MET 894 HA MET 894 -18.054 -10.623 -0.351 333 HB2 MET 894 HB1 MET 894 -15.783 -11.380 0.427 334 HB3 MET 894 HB2 MET 894 -15.543 -9.763 1.106 335 HG2 MET 894 HG1 MET 894 -16.174 -11.268 2.852 336 HG3 MET 894 HG2 MET 894 -17.456 -10.091 2.621 337 HE1 MET 894 HE1 MET 894 -19.106 -11.517 4.075 338 HE2 MET 894 HE2 MET 894 -19.403 -13.253 3.834 339 HE3 MET 894 HE3 MET 894 -17.801 -12.692 4.363 340 H ASN 895 HN ASN 895 -16.566 -7.488 -0.743 341 HA ASN 895 HA ASN 895 -18.517 -6.205 1.107 342 HB2 ASN 895 HB1 ASN 895 -17.074 -4.310 1.066 343 HB3 ASN 895 HB2 ASN 895 -16.158 -5.778 1.474 344 HD21 ASN 895 HD21 ASN 895 -16.994 -4.206 -1.665 345 HD22 ASN 895 HD22 ASN 895 -15.333 -4.277 -2.201 346 H ASN 896 HN ASN 896 -18.544 -7.088 -1.931 347 HA ASN 896 HA ASN 896 -19.331 -4.872 -3.509 348 HB2 ASN 896 HB1 ASN 896 -18.824 -7.124 -4.438 349 HB3 ASN 896 HB2 ASN 896 -20.325 -7.734 -3.725 350 HD21 ASN 896 HD21 ASN 896 -21.714 -8.174 -5.423 351 HD22 ASN 896 HD22 ASN 896 -21.988 -7.039 -6.719 352 H SER 897 HN SER 897 -21.148 -3.822 -3.971 353 HA SER 897 HA SER 897 -23.268 -3.439 -2.166 354 HB2 SER 897 HB1 SER 897 -23.036 -3.000 -5.169 355 HB3 SER 897 HB2 SER 897 -24.366 -2.379 -4.197 356 HG SER 897 HG1 SER 897 -22.877 -1.117 -3.035 357 H ASP 898 HN ASP 898 -23.216 -5.415 -5.097 358 HA ASP 898 HA ASP 898 -26.024 -6.260 -4.746 359 HB2 ASP 898 HB1 ASP 898 -24.175 -7.148 -6.954 360 HB3 ASP 898 HB2 ASP 898 -25.929 -7.096 -6.949 361 H LYS 899 HN LYS 899 -26.343 -7.739 -3.280 362 HA LYS 899 HA LYS 899 -24.607 -9.738 -2.348 363 HB2 LYS 899 HB1 LYS 899 -27.657 -9.695 -2.328 364 HB3 LYS 899 HB2 LYS 899 -26.643 -10.744 -1.340 365 HG2 LYS 899 HG1 LYS 899 -26.278 -7.738 -1.177 366 HG3 LYS 899 HG2 LYS 899 -27.606 -8.514 -0.324 367 HD2 LYS 899 HD1 LYS 899 -24.770 -9.522 -0.042 368 HD3 LYS 899 HD2 LYS 899 -25.414 -8.199 0.965 369 HE2 LYS 899 HE1 LYS 899 -27.254 -9.668 1.725 370 HE3 LYS 899 HE2 LYS 899 -26.637 -10.983 0.723 371 HZ1 LYS 899 HZ1 LYS 899 -25.170 -9.740 2.994 372 HZ2 LYS 899 HZ2 LYS 899 -25.894 -11.201 3.029 373 HZ3 LYS 899 HZ3 LYS 899 -24.596 -10.960 2.070 374 H ARG 900 HN ARG 900 -26.541 -9.819 -5.192 375 HA ARG 900 HA ARG 900 -26.512 -12.677 -5.765 376 HB2 ARG 900 HB1 ARG 900 -26.797 -10.155 -7.459 377 HB3 ARG 900 HB2 ARG 900 -26.868 -11.763 -8.152 378 HG2 ARG 900 HG1 ARG 900 -28.767 -10.698 -6.009 379 HG3 ARG 900 HG2 ARG 900 -29.098 -10.750 -7.742 380 HD2 ARG 900 HD1 ARG 900 -28.837 -13.231 -7.708 381 HD3 ARG 900 HD2 ARG 900 -28.630 -13.184 -5.959 382 HE ARG 900 HE ARG 900 -31.110 -12.795 -7.497 383 HH11 ARG 900 HH11 ARG 900 -29.697 -12.451 -4.305 384 HH12 ARG 900 HH12 ARG 900 -31.256 -12.401 -3.529 385 HH21 ARG 900 HH21 ARG 900 -33.052 -12.727 -6.440 386 HH22 ARG 900 HH22 ARG 900 -33.099 -12.555 -4.711 387 H PHE 901 HN PHE 901 -24.082 -10.228 -6.058 388 HA PHE 901 HA PHE 901 -22.248 -12.165 -7.388 389 HB2 PHE 901 HB1 PHE 901 -22.287 -9.168 -7.870 390 HB3 PHE 901 HB2 PHE 901 -21.301 -10.355 -8.703 391 HD1 PHE 901 HD1 PHE 901 -22.104 -11.428 -10.698 392 HD2 PHE 901 HD2 PHE 901 -24.775 -9.062 -8.294 393 HE1 PHE 901 HE1 PHE 901 -23.821 -11.576 -12.474 394 HE2 PHE 901 HE2 PHE 901 -26.493 -9.197 -10.079 395 HZ PHE 901 HZ PHE 901 -26.024 -10.464 -12.166 396 H ALA 902 HN ALA 902 -22.648 -11.137 -4.517 397 HA ALA 902 HA ALA 902 -20.118 -9.804 -3.962 398 HB1 ALA 902 HB1 ALA 902 -22.475 -10.409 -2.118 399 HB2 ALA 902 HB2 ALA 902 -21.119 -9.322 -1.760 400 HB3 ALA 902 HB3 ALA 902 -22.263 -8.895 -3.035 401 H ASP 903 HN ASP 903 -19.627 -12.317 -4.779 402 HA ASP 903 HA ASP 903 -18.049 -13.279 -2.483 403 HB2 ASP 903 HB1 ASP 903 -19.772 -15.120 -4.135 404 HB3 ASP 903 HB2 ASP 903 -18.515 -15.652 -3.034 405 H CYS 904 HN CYS 904 -16.071 -14.085 -3.040 406 HA CYS 904 HA CYS 904 -14.953 -13.590 -5.587 407 HB2 CYS 904 HB1 CYS 904 -14.123 -15.317 -3.217 408 HB3 CYS 904 HB2 CYS 904 -13.096 -14.990 -4.617 409 H SER 905 HN SER 905 -16.968 -16.179 -4.538 410 HA SER 905 HA SER 905 -16.206 -18.075 -6.670 411 HB2 SER 905 HB1 SER 905 -18.456 -18.202 -4.634 412 HB3 SER 905 HB2 SER 905 -17.924 -19.509 -5.706 413 HG SER 905 HG1 SER 905 -15.950 -19.570 -4.612 414 H LYS 906 HN LYS 906 -18.428 -15.433 -6.279 415 HA LYS 906 HA LYS 906 -20.487 -16.419 -8.134 416 HB2 LYS 906 HB1 LYS 906 -19.965 -13.884 -6.578 417 HB3 LYS 906 HB2 LYS 906 -21.102 -13.844 -7.905 418 HG2 LYS 906 HG1 LYS 906 -21.354 -15.583 -5.431 419 HG3 LYS 906 HG2 LYS 906 -22.209 -14.080 -5.797 420 HD2 LYS 906 HD1 LYS 906 -23.838 -15.530 -6.390 421 HD3 LYS 906 HD2 LYS 906 -23.009 -15.480 -7.949 422 HE2 LYS 906 HE1 LYS 906 -21.776 -17.587 -7.287 423 HE3 LYS 906 HE2 LYS 906 -22.618 -17.563 -5.738 424 HZ1 LYS 906 HZ1 LYS 906 -23.712 -19.044 -7.316 425 HZ2 LYS 906 HZ2 LYS 906 -24.719 -17.818 -6.941 426 HZ3 LYS 906 HZ3 LYS 906 -23.950 -17.833 -8.383 427 H SER 907 HN SER 907 -21.219 -14.710 -9.779 428 HA SER 907 HA SER 907 -19.064 -14.627 -11.814 429 HB2 SER 907 HB1 SER 907 -21.185 -15.887 -12.197 430 HB3 SER 907 HB2 SER 907 -22.060 -14.344 -12.185 431 HG SER 907 HG1 SER 907 -21.422 -15.132 -14.306 432 H GLN 908 HN GLN 908 -20.345 -12.729 -13.480 433 HA GLN 908 HA GLN 908 -20.529 -10.123 -12.158 434 HB2 GLN 908 HB1 GLN 908 -18.680 -9.096 -13.299 435 HB3 GLN 908 HB2 GLN 908 -18.072 -10.505 -12.434 436 HG2 GLN 908 HG1 GLN 908 -18.527 -11.712 -14.804 437 HG3 GLN 908 HG2 GLN 908 -18.466 -10.075 -15.373 438 HE21 GLN 908 HE21 GLN 908 -16.374 -9.010 -15.427 439 HE22 GLN 908 HE22 GLN 908 -14.891 -9.866 -15.014 440 H GLU 909 HN GLU 909 -21.067 -8.370 -13.885 441 HA GLU 909 HA GLU 909 -23.199 -9.332 -15.558 442 HB2 GLU 909 HB1 GLU 909 -21.735 -6.723 -15.934 443 HB3 GLU 909 HB2 GLU 909 -23.372 -7.091 -16.416 444 HG2 GLU 909 HG1 GLU 909 -22.309 -6.674 -13.603 445 HG3 GLU 909 HG2 GLU 909 -23.341 -5.589 -14.515 446 H MET 910 HN MET 910 -19.796 -8.618 -16.287 447 HA MET 910 HA MET 910 -19.944 -10.032 -18.870 448 HB2 MET 910 HB1 MET 910 -19.080 -7.112 -18.689 449 HB3 MET 910 HB2 MET 910 -18.633 -8.197 -20.005 450 HG2 MET 910 HG1 MET 910 -21.501 -7.493 -19.303 451 HG3 MET 910 HG2 MET 910 -20.531 -6.681 -20.523 452 HE1 MET 910 HE1 MET 910 -23.148 -8.694 -22.639 453 HE2 MET 910 HE2 MET 910 -23.411 -7.981 -21.032 454 HE3 MET 910 HE3 MET 910 -22.483 -7.090 -22.261 455 H SER 911 HN SER 911 -18.103 -11.170 -19.189 456 HA SER 911 HA SER 911 -16.090 -11.342 -17.141 457 HB2 SER 911 HB1 SER 911 -14.893 -12.769 -18.919 458 HB3 SER 911 HB2 SER 911 -16.385 -13.324 -18.201 459 HG SER 911 HG1 SER 911 -16.380 -13.546 -20.508 460 H ASN 912 HN ASN 912 -13.809 -11.196 -17.494 461 HA ASN 912 HA ASN 912 -13.284 -8.450 -17.759 462 HB2 ASN 912 HB1 ASN 912 -11.350 -10.782 -17.482 463 HB3 ASN 912 HB2 ASN 912 -10.855 -9.087 -17.480 464 HD21 ASN 912 HD21 ASN 912 -10.041 -9.332 -15.336 465 HD22 ASN 912 HD22 ASN 912 -11.185 -9.015 -14.036 466 H GLU 913 HN GLU 913 -13.005 -10.810 -20.281 467 HA GLU 913 HA GLU 913 -11.555 -9.046 -22.162 468 HB2 GLU 913 HB1 GLU 913 -11.095 -11.450 -22.001 469 HB3 GLU 913 HB2 GLU 913 -12.773 -11.831 -22.398 470 HG2 GLU 913 HG1 GLU 913 -12.500 -11.104 -24.664 471 HG3 GLU 913 HG2 GLU 913 -10.969 -10.299 -24.296 472 H GLU 914 HN GLU 914 -14.749 -9.236 -21.141 473 HA GLU 914 HA GLU 914 -15.899 -8.245 -23.721 474 HB2 GLU 914 HB1 GLU 914 -17.250 -9.600 -21.359 475 HB3 GLU 914 HB2 GLU 914 -18.080 -8.960 -22.766 476 HG2 GLU 914 HG1 GLU 914 -16.075 -11.255 -22.733 477 HG3 GLU 914 HG2 GLU 914 -17.820 -11.395 -22.879 478 H ILE 915 HN ILE 915 -15.671 -7.535 -20.187 479 HA ILE 915 HA ILE 915 -17.129 -5.031 -20.407 480 HB ILE 915 HB ILE 915 -16.992 -5.738 -18.231 481 HG12 ILE 915 HG11 ILE 915 -15.733 -4.074 -16.946 482 HG13 ILE 915 HG12 ILE 915 -14.758 -3.669 -18.359 483 HG21 ILE 915 HG21 ILE 915 -14.008 -6.239 -18.515 484 HG22 ILE 915 HG22 ILE 915 -14.869 -6.165 -16.957 485 HG23 ILE 915 HG23 ILE 915 -15.330 -7.373 -18.108 486 HD11 ILE 915 HD1 ILE 915 -16.695 -2.746 -19.490 487 HD12 ILE 915 HD2 ILE 915 -17.775 -3.371 -18.251 488 HD13 ILE 915 HD3 ILE 915 -16.598 -2.076 -17.872 489 H ASN 916 HN ASN 916 -13.579 -5.607 -20.420 490 HA ASN 916 HA ASN 916 -12.811 -2.965 -20.909 491 HB2 ASN 916 HB1 ASN 916 -10.685 -3.841 -21.709 492 HB3 ASN 916 HB2 ASN 916 -11.221 -4.733 -20.296 493 HD21 ASN 916 HD21 ASN 916 -9.281 -5.902 -21.618 494 HD22 ASN 916 HD22 ASN 916 -9.863 -7.272 -22.529 495 H GLU 917 HN GLU 917 -13.996 -5.218 -23.327 496 HA GLU 917 HA GLU 917 -13.547 -3.673 -25.692 497 HB2 GLU 917 HB1 GLU 917 -15.283 -5.923 -24.801 498 HB3 GLU 917 HB2 GLU 917 -15.790 -5.084 -26.245 499 HG2 GLU 917 HG1 GLU 917 -13.039 -6.334 -25.775 500 HG3 GLU 917 HG2 GLU 917 -14.350 -7.090 -26.676 501 H GLU 918 HN GLU 918 -16.137 -3.454 -23.254 502 HA GLU 918 HA GLU 918 -17.932 -1.819 -24.810 503 HB2 GLU 918 HB1 GLU 918 -18.438 -3.154 -22.676 504 HB3 GLU 918 HB2 GLU 918 -17.717 -1.809 -21.762 505 HG2 GLU 918 HG1 GLU 918 -19.436 -0.331 -22.320 506 HG3 GLU 918 HG2 GLU 918 -19.826 -1.172 -23.815 507 H LEU 919 HN LEU 919 -15.176 -1.078 -22.717 508 HA LEU 919 HA LEU 919 -15.519 1.836 -23.051 509 HB2 LEU 919 HB1 LEU 919 -13.226 0.291 -21.791 510 HB3 LEU 919 HB2 LEU 919 -13.503 2.020 -21.733 511 HG LEU 919 HG LEU 919 -15.880 1.074 -20.702 512 HD11 LEU 919 HD11 LEU 919 -15.202 -0.600 -18.955 513 HD12 LEU 919 HD12 LEU 919 -15.178 -1.223 -20.603 514 HD13 LEU 919 HD13 LEU 919 -13.651 -0.800 -19.808 515 HD21 LEU 919 HD21 LEU 919 -14.504 2.877 -19.799 516 HD22 LEU 919 HD22 LEU 919 -14.915 1.722 -18.505 517 HD23 LEU 919 HD23 LEU 919 -13.293 1.709 -19.271 518 H GLY 920 HN GLY 920 -13.415 -0.772 -24.181 519 HA2 GLY 920 HA1 GLY 920 -12.305 -0.928 -26.271 520 HA3 GLY 920 HA2 GLY 920 -12.432 0.819 -26.503 521 H ILE 921 HN ILE 921 -11.170 -1.162 -23.783 522 HA ILE 921 HA ILE 921 -8.631 0.420 -23.835 523 HB ILE 921 HB ILE 921 -8.628 0.380 -21.417 524 HG12 ILE 921 HG11 ILE 921 -11.373 -0.932 -21.581 525 HG13 ILE 921 HG12 ILE 921 -9.878 -1.720 -21.069 526 HG21 ILE 921 HG21 ILE 921 -11.226 1.540 -22.496 527 HG22 ILE 921 HG22 ILE 921 -10.324 2.083 -21.067 528 HG23 ILE 921 HG23 ILE 921 -9.622 2.271 -22.674 529 HD11 ILE 921 HD1 ILE 921 -11.254 0.563 -19.625 530 HD12 ILE 921 HD2 ILE 921 -11.125 -1.124 -19.109 531 HD13 ILE 921 HD3 ILE 921 -9.661 -0.115 -19.194 532 H GLY 922 HN GLY 922 -6.881 -0.480 -22.567 533 HA2 GLY 922 HA1 GLY 922 -6.357 -3.266 -23.505 534 HA3 GLY 922 HA2 GLY 922 -5.171 -1.974 -23.350 535 H GLN 923 HN GLN 923 -7.542 -3.597 -21.180 536 HA GLN 923 HA GLN 923 -5.863 -3.373 -18.845 537 HB2 GLN 923 HB1 GLN 923 -8.552 -3.951 -19.318 538 HB3 GLN 923 HB2 GLN 923 -7.930 -5.495 -18.789 539 HG2 GLN 923 HG1 GLN 923 -8.706 -4.474 -16.862 540 HG3 GLN 923 HG2 GLN 923 -6.969 -4.236 -16.743 541 HE21 GLN 923 HE21 GLN 923 -9.364 -2.636 -15.600 542 HE22 GLN 923 HE22 GLN 923 -8.999 -1.001 -16.133 543 H ASP 924 HN ASP 924 -5.325 -5.292 -17.491 544 HA ASP 924 HA ASP 924 -3.546 -7.187 -18.870 545 HB2 ASP 924 HB1 ASP 924 -2.996 -7.942 -16.641 546 HB3 ASP 924 HB2 ASP 924 -2.932 -6.180 -16.736 547 H GLU 925 HN GLU 925 -6.672 -7.154 -17.562 548 HA GLU 925 HA GLU 925 -8.528 -8.452 -17.664 549 HB2 GLU 925 HB1 GLU 925 -7.000 -10.416 -19.385 550 HB3 GLU 925 HB2 GLU 925 -8.736 -10.418 -19.066 551 HG2 GLU 925 HG1 GLU 925 -8.961 -8.209 -20.139 552 HG3 GLU 925 HG2 GLU 925 -7.233 -8.186 -20.497 553 H ALA 926 HN ALA 926 -5.698 -10.597 -17.193 554 HA ALA 926 HA ALA 926 -6.667 -11.385 -14.532 555 HB1 ALA 926 HB1 ALA 926 -6.697 -13.805 -15.027 556 HB2 ALA 926 HB2 ALA 926 -7.970 -12.926 -15.887 557 HB3 ALA 926 HB3 ALA 926 -6.523 -13.452 -16.765 558 H ASP 927 HN ASP 927 -4.457 -13.148 -16.689 559 HA ASP 927 HA ASP 927 -2.358 -13.882 -16.326 560 HB2 ASP 927 HB1 ASP 927 -2.111 -11.564 -17.278 561 HB3 ASP 927 HB2 ASP 927 -1.769 -10.982 -15.653 562 H ALA 928 HN ALA 928 -4.030 -14.166 -14.015 563 HA ALA 928 HA ALA 928 -2.543 -13.702 -11.589 564 HB1 ALA 928 HB1 ALA 928 -4.297 -15.106 -10.575 565 HB2 ALA 928 HB2 ALA 928 -4.987 -13.878 -11.655 566 HB3 ALA 928 HB3 ALA 928 -4.874 -15.572 -12.189 567 H1 ALA 1 HT1 ALA 1 -7.714 -1.303 -6.321 568 H2 ALA 1 HT2 ALA 1 -6.159 -0.913 -5.942 569 H3 ALA 1 HT3 ALA 1 -6.659 -2.497 -5.955 570 HA ALA 1 HA ALA 1 -5.283 -1.644 -7.905 571 HB1 ALA 1 HB1 ALA 1 -7.945 -3.041 -8.410 572 HB2 ALA 1 HB2 ALA 1 -6.572 -3.012 -9.534 573 HB3 ALA 1 HB3 ALA 1 -6.415 -3.842 -7.983 574 H ARG 2 HN ARG 2 -5.658 -0.789 -10.154 575 HA ARG 2 HA ARG 2 -7.242 1.634 -10.299 576 HB2 ARG 2 HB1 ARG 2 -6.619 1.758 -12.547 577 HB3 ARG 2 HB2 ARG 2 -5.210 1.133 -11.723 578 HG2 ARG 2 HG1 ARG 2 -5.371 -0.987 -12.710 579 HG3 ARG 2 HG2 ARG 2 -7.092 -0.899 -13.010 580 HD2 ARG 2 HD1 ARG 2 -5.004 0.770 -14.458 581 HD3 ARG 2 HD2 ARG 2 -5.759 -0.705 -15.088 582 HE ARG 2 HE ARG 2 -7.879 1.031 -14.424 583 HH11 ARG 2 HH11 ARG 2 -5.168 1.378 -16.605 584 HH12 ARG 2 HH12 ARG 2 -6.165 2.042 -17.869 585 HH21 ARG 2 HH21 ARG 2 -8.976 2.198 -15.886 586 HH22 ARG 2 HH22 ARG 2 -8.263 2.588 -17.434 587 H THR 3 HN THR 3 -8.927 1.934 -12.018 588 HA THR 3 HA THR 3 -10.310 -0.392 -13.006 589 HB THR 3 HB THR 3 -11.304 -0.245 -10.710 590 HG1 THR 3 HG1 THR 3 -12.573 -1.077 -12.336 591 HG21 THR 3 HG21 THR 3 -12.716 1.510 -9.996 592 HG22 THR 3 HG22 THR 3 -11.214 2.296 -10.487 593 HG23 THR 3 HG23 THR 3 -12.645 2.350 -11.549 594 H MLZ 4 HN MLZ 4 -12.803 1.163 -13.553 595 HA MLZ 4 HA MLZ 4 -11.979 3.171 -15.522 596 HB2 MLZ 4 HB1 MLZ 4 -12.332 1.833 -17.417 597 HB3 MLZ 4 HB2 MLZ 4 -11.328 0.836 -16.421 598 HG2 MLZ 4 HG1 MLZ 4 -14.366 0.516 -16.539 599 HG3 MLZ 4 HG2 MLZ 4 -13.258 -0.268 -17.650 600 HD2 MLZ 4 HD1 MLZ 4 -12.976 -0.716 -14.695 601 HD3 MLZ 4 HD2 MLZ 4 -14.138 -1.619 -15.646 602 HE2 MLZ 4 HE1 MLZ 4 -11.286 -1.477 -16.625 603 HE3 MLZ 4 HE2 MLZ 4 -11.657 -2.503 -15.221 604 HZ MLZ 4 HZ1 MLZ 4 -13.171 -2.721 -17.774 605 HCM1 MLZ 4 HC1 MLZ 4 -11.835 -4.712 -18.216 606 HCM2 MLZ 4 HC2 MLZ 4 -10.829 -3.243 -18.193 607 HCM3 MLZ 4 HC3 MLZ 4 -10.875 -4.327 -16.790 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.228 -3.747 -16.500 609 H GLN 5 HN GLN 5 -13.940 3.781 -16.960 610 HA GLN 5 HA GLN 5 -16.558 3.411 -15.625 611 HB2 GLN 5 HB1 GLN 5 -15.670 5.461 -14.724 612 HB3 GLN 5 HB2 GLN 5 -15.363 6.121 -16.327 613 HG2 GLN 5 HG1 GLN 5 -18.187 5.267 -15.828 614 HG3 GLN 5 HG2 GLN 5 -17.612 6.549 -14.780 615 HE21 GLN 5 HE21 GLN 5 -18.221 8.577 -15.547 616 HE22 GLN 5 HE22 GLN 5 -18.285 8.963 -17.263 617 H THR 6 HN THR 6 -17.819 2.522 -17.067 618 HA THR 6 HA THR 6 -17.457 2.675 -19.936 619 HB THR 6 HB THR 6 -19.854 1.620 -19.845 620 HG1 THR 6 HG1 THR 6 -20.274 2.066 -17.675 621 HG21 THR 6 HG21 THR 6 -17.397 0.216 -18.750 622 HG22 THR 6 HG22 THR 6 -18.896 -0.604 -19.260 623 HG23 THR 6 HG23 THR 6 -17.945 0.294 -20.442 624 H ALA 7 HN ALA 7 -18.206 4.058 -21.334 625 HA ALA 7 HA ALA 7 -20.070 6.212 -20.546 626 HB1 ALA 7 HB1 ALA 7 -18.343 5.851 -23.030 627 HB2 ALA 7 HB2 ALA 7 -19.238 7.315 -22.566 628 HB3 ALA 7 HB3 ALA 7 -17.886 6.756 -21.568 629 H ARG 8 HN ARG 8 -20.919 3.334 -21.199 630 HA ARG 8 HA ARG 8 -23.139 3.843 -23.047 631 HB2 ARG 8 HB1 ARG 8 -21.243 3.256 -24.506 632 HB3 ARG 8 HB2 ARG 8 -20.975 1.759 -23.626 633 HG2 ARG 8 HG1 ARG 8 -23.664 2.335 -24.938 634 HG3 ARG 8 HG2 ARG 8 -22.282 1.799 -25.897 635 HD2 ARG 8 HD1 ARG 8 -22.049 -0.205 -24.444 636 HD3 ARG 8 HD2 ARG 8 -23.546 0.248 -23.604 637 HE ARG 8 HE ARG 8 -24.267 0.257 -26.263 638 HH11 ARG 8 HH11 ARG 8 -22.891 -2.242 -24.181 639 HH12 ARG 8 HH12 ARG 8 -23.568 -3.515 -25.164 640 HH21 ARG 8 HH21 ARG 8 -25.050 -1.433 -27.457 641 HH22 ARG 8 HH22 ARG 8 -24.747 -3.071 -26.957 642 H TYR 9 HN TYR 9 -24.743 3.149 -22.000 643 HA TYR 9 HA TYR 9 -26.178 2.156 -20.539 644 HB2 TYR 9 HB1 TYR 9 -24.758 -0.396 -21.332 645 HB3 TYR 9 HB2 TYR 9 -26.332 -0.279 -20.565 646 HD1 TYR 9 HD1 TYR 9 -26.909 2.299 -22.671 647 HD2 TYR 9 HD2 TYR 9 -25.989 -1.915 -22.876 648 HE1 TYR 9 HE1 TYR 9 -28.013 2.162 -24.889 649 HE2 TYR 9 HE2 TYR 9 -27.137 -2.053 -25.079 650 HH TYR 9 HH TYR 9 -28.315 -0.922 -26.688 Start of MODEL 8 1 H1 GLY 850 HT1 GLY 850 0.611 -7.688 -6.813 2 H2 GLY 850 HT2 GLY 850 1.223 -7.198 -5.375 3 H3 GLY 850 HT3 GLY 850 0.365 -6.152 -6.299 4 HA2 GLY 850 HA1 GLY 850 -0.719 -8.577 -5.010 5 HA3 GLY 850 HA2 GLY 850 -0.971 -6.917 -4.441 6 H SER 851 HN SER 851 -2.457 -9.335 -6.007 7 HA SER 851 HA SER 851 -4.147 -9.668 -7.440 8 HB2 SER 851 HB1 SER 851 -5.353 -7.980 -6.230 9 HB3 SER 851 HB2 SER 851 -4.633 -6.703 -7.211 10 HG SER 851 HG1 SER 851 -6.530 -8.667 -7.984 11 H ARG 852 HN ARG 852 -4.965 -9.266 -9.690 12 HA ARG 852 HA ARG 852 -2.558 -9.339 -11.402 13 HB2 ARG 852 HB1 ARG 852 -5.373 -10.247 -12.121 14 HB3 ARG 852 HB2 ARG 852 -3.890 -10.529 -13.007 15 HG2 ARG 852 HG1 ARG 852 -4.143 -12.536 -11.990 16 HG3 ARG 852 HG2 ARG 852 -3.073 -11.734 -10.831 17 HD2 ARG 852 HD1 ARG 852 -5.178 -11.147 -9.504 18 HD3 ARG 852 HD2 ARG 852 -6.094 -12.151 -10.631 19 HE ARG 852 HE ARG 852 -4.205 -13.907 -9.805 20 HH11 ARG 852 HH11 ARG 852 -6.256 -11.787 -7.925 21 HH12 ARG 852 HH12 ARG 852 -6.236 -12.806 -6.522 22 HH21 ARG 852 HH21 ARG 852 -4.200 -15.204 -7.974 23 HH22 ARG 852 HH22 ARG 852 -5.075 -14.696 -6.557 24 H ARG 853 HN ARG 853 -3.796 -6.776 -10.559 25 HA ARG 853 HA ARG 853 -4.952 -5.393 -12.784 26 HB2 ARG 853 HB1 ARG 853 -3.929 -3.328 -11.531 27 HB3 ARG 853 HB2 ARG 853 -5.282 -4.220 -10.860 28 HG2 ARG 853 HG1 ARG 853 -3.835 -5.360 -9.270 29 HG3 ARG 853 HG2 ARG 853 -2.385 -4.637 -10.004 30 HD2 ARG 853 HD1 ARG 853 -2.984 -2.451 -9.259 31 HD3 ARG 853 HD2 ARG 853 -4.644 -2.952 -8.879 32 HE ARG 853 HE ARG 853 -2.877 -4.512 -7.286 33 HH11 ARG 853 HH11 ARG 853 -3.796 -1.130 -7.470 34 HH12 ARG 853 HH12 ARG 853 -3.782 -0.920 -5.738 35 HH21 ARG 853 HH21 ARG 853 -2.802 -4.170 -5.107 36 HH22 ARG 853 HH22 ARG 853 -3.168 -2.598 -4.446 37 H ALA 854 HN ALA 854 -4.173 -4.014 -14.270 38 HA ALA 854 HA ALA 854 -1.300 -3.786 -14.859 39 HB1 ALA 854 HB1 ALA 854 -3.295 -5.109 -16.759 40 HB2 ALA 854 HB2 ALA 854 -1.600 -4.731 -17.130 41 HB3 ALA 854 HB3 ALA 854 -1.984 -5.943 -15.895 42 H SER 855 HN SER 855 -0.934 -2.339 -16.707 43 HA SER 855 HA SER 855 -1.041 -0.237 -17.560 44 HB2 SER 855 HB1 SER 855 -2.636 0.035 -19.287 45 HB3 SER 855 HB2 SER 855 -2.134 -1.650 -19.202 46 HG SER 855 HG1 SER 855 -4.377 -1.468 -19.485 47 H VAL 856 HN VAL 856 -3.761 1.158 -18.027 48 HA VAL 856 HA VAL 856 -4.288 2.302 -15.360 49 HB VAL 856 HB VAL 856 -3.988 4.623 -16.141 50 HG11 VAL 856 HG11 VAL 856 -1.395 3.060 -16.228 51 HG12 VAL 856 HG12 VAL 856 -1.618 4.775 -15.822 52 HG13 VAL 856 HG13 VAL 856 -2.291 3.527 -14.759 53 HG21 VAL 856 HG21 VAL 856 -2.503 3.444 -18.519 54 HG22 VAL 856 HG22 VAL 856 -4.063 4.299 -18.575 55 HG23 VAL 856 HG23 VAL 856 -2.603 5.160 -18.073 56 H GLY 857 HN GLY 857 -6.031 3.870 -15.377 57 HA2 GLY 857 HA1 GLY 857 -8.036 3.540 -17.572 58 HA3 GLY 857 HA2 GLY 857 -8.478 3.464 -15.866 59 H SER 858 HN SER 858 -9.709 5.232 -15.755 60 HA SER 858 HA SER 858 -8.530 7.883 -15.623 61 HB2 SER 858 HB1 SER 858 -9.932 8.929 -17.283 62 HB3 SER 858 HB2 SER 858 -8.989 7.647 -18.056 63 HG SER 858 HG1 SER 858 -10.791 6.354 -18.132 64 H GLU 859 HN GLU 859 -10.199 9.536 -14.968 65 HA GLU 859 HA GLU 859 -12.790 8.519 -14.004 66 HB2 GLU 859 HB1 GLU 859 -10.909 10.051 -12.167 67 HB3 GLU 859 HB2 GLU 859 -12.621 9.711 -11.877 68 HG2 GLU 859 HG1 GLU 859 -12.150 7.299 -11.769 69 HG3 GLU 859 HG2 GLU 859 -10.446 7.595 -12.146 70 H PHE 860 HN PHE 860 -14.281 9.833 -14.738 71 HA PHE 860 HA PHE 860 -13.973 12.784 -14.693 72 HB2 PHE 860 HB1 PHE 860 -14.877 11.240 -17.157 73 HB3 PHE 860 HB2 PHE 860 -14.861 12.981 -16.970 74 HD1 PHE 860 HD1 PHE 860 -12.995 10.101 -18.046 75 HD2 PHE 860 HD2 PHE 860 -12.579 14.158 -16.639 76 HE1 PHE 860 HE1 PHE 860 -10.744 10.232 -19.084 77 HE2 PHE 860 HE2 PHE 860 -10.311 14.273 -17.650 78 HZ PHE 860 HZ PHE 860 -9.391 12.311 -18.875 79 H THR 861 HN THR 861 -16.249 10.145 -15.646 80 HA THR 861 HA THR 861 -18.514 11.437 -14.233 81 HB THR 861 HB THR 861 -19.811 11.314 -16.482 82 HG1 THR 861 HG1 THR 861 -18.280 10.363 -17.773 83 HG21 THR 861 HG21 THR 861 -19.337 13.571 -17.050 84 HG22 THR 861 HG22 THR 861 -19.308 13.383 -15.286 85 HG23 THR 861 HG23 THR 861 -17.779 13.532 -16.198 86 H GLU 862 HN GLU 862 -20.472 10.370 -14.373 87 HA GLU 862 HA GLU 862 -21.929 8.690 -14.165 88 HB2 GLU 862 HB1 GLU 862 -20.378 7.331 -16.382 89 HB3 GLU 862 HB2 GLU 862 -21.979 6.877 -15.806 90 HG2 GLU 862 HG1 GLU 862 -22.906 9.030 -16.492 91 HG3 GLU 862 HG2 GLU 862 -21.312 9.613 -16.962 92 H SER 863 HN SER 863 -22.509 6.675 -13.313 93 HA SER 863 HA SER 863 -20.907 5.380 -11.386 94 HB2 SER 863 HB1 SER 863 -23.235 4.311 -13.012 95 HB3 SER 863 HB2 SER 863 -22.581 3.588 -11.527 96 HG SER 863 HG1 SER 863 -24.424 5.049 -11.224 97 H ALA 864 HN ALA 864 -19.600 3.548 -11.412 98 HA ALA 864 HA ALA 864 -18.499 2.855 -14.112 99 HB1 ALA 864 HB1 ALA 864 -16.837 4.088 -11.890 100 HB2 ALA 864 HB2 ALA 864 -16.290 3.631 -13.475 101 HB3 ALA 864 HB3 ALA 864 -17.434 4.978 -13.310 102 H TRP 865 HN TRP 865 -16.317 1.417 -13.581 103 HA TRP 865 HA TRP 865 -17.428 -0.817 -11.944 104 HB2 TRP 865 HB1 TRP 865 -15.078 -0.684 -13.838 105 HB3 TRP 865 HB2 TRP 865 -15.701 -2.133 -13.071 106 HD1 TRP 865 HD1 TRP 865 -16.847 0.525 -15.623 107 HE1 TRP 865 HE1 TRP 865 -18.701 -0.408 -17.084 108 HE3 TRP 865 HE3 TRP 865 -17.321 -4.007 -13.358 109 HZ2 TRP 865 HZ2 TRP 865 -20.103 -2.992 -17.346 110 HZ3 TRP 865 HZ3 TRP 865 -18.914 -5.712 -14.224 111 HH2 TRP 865 HH2 TRP 865 -20.291 -5.220 -16.206 112 H VAL 866 HN VAL 866 -15.904 -2.163 -10.784 113 HA VAL 866 HA VAL 866 -13.446 -0.959 -9.756 114 HB VAL 866 HB VAL 866 -15.108 -0.261 -8.103 115 HG11 VAL 866 HG11 VAL 866 -16.695 -2.188 -8.362 116 HG12 VAL 866 HG12 VAL 866 -15.532 -3.223 -7.529 117 HG13 VAL 866 HG13 VAL 866 -16.263 -1.847 -6.682 118 HG21 VAL 866 HG21 VAL 866 -12.784 -0.741 -7.397 119 HG22 VAL 866 HG22 VAL 866 -13.992 -0.970 -6.117 120 HG23 VAL 866 HG23 VAL 866 -13.298 -2.379 -6.921 121 H ARG 867 HN ARG 867 -11.919 -2.480 -9.253 122 HA ARG 867 HA ARG 867 -12.373 -5.287 -10.097 123 HB2 ARG 867 HB1 ARG 867 -10.253 -3.565 -10.419 124 HB3 ARG 867 HB2 ARG 867 -9.816 -4.339 -8.917 125 HG2 ARG 867 HG1 ARG 867 -9.940 -6.564 -10.035 126 HG3 ARG 867 HG2 ARG 867 -10.392 -5.782 -11.553 127 HD2 ARG 867 HD1 ARG 867 -8.086 -6.198 -11.737 128 HD3 ARG 867 HD2 ARG 867 -8.211 -4.471 -11.435 129 HE ARG 867 HE ARG 867 -7.175 -6.570 -9.597 130 HH11 ARG 867 HH11 ARG 867 -7.884 -3.086 -9.882 131 HH12 ARG 867 HH12 ARG 867 -7.307 -2.839 -8.243 132 HH21 ARG 867 HH21 ARG 867 -6.486 -6.067 -7.669 133 HH22 ARG 867 HH22 ARG 867 -6.726 -4.469 -6.976 134 H CYS 868 HN CYS 868 -12.241 -7.061 -8.648 135 HA CYS 868 HA CYS 868 -12.111 -6.583 -5.766 136 HB2 CYS 868 HB1 CYS 868 -13.395 -8.452 -6.594 137 HB3 CYS 868 HB2 CYS 868 -11.975 -9.114 -7.409 138 H ASP 869 HN ASP 869 -10.347 -5.995 -4.767 139 HA ASP 869 HA ASP 869 -7.639 -6.294 -5.713 140 HB2 ASP 869 HB1 ASP 869 -8.857 -5.542 -3.041 141 HB3 ASP 869 HB2 ASP 869 -7.133 -5.533 -3.336 142 H ASP 870 HN ASP 870 -9.607 -8.732 -4.508 143 HA ASP 870 HA ASP 870 -7.233 -10.242 -3.521 144 HB2 ASP 870 HB1 ASP 870 -9.133 -10.007 -1.918 145 HB3 ASP 870 HB2 ASP 870 -10.159 -10.898 -3.039 146 H CYS 871 HN CYS 871 -9.873 -10.215 -5.869 147 HA CYS 871 HA CYS 871 -8.714 -12.531 -7.332 148 HB2 CYS 871 HB1 CYS 871 -11.384 -11.097 -7.715 149 HB3 CYS 871 HB2 CYS 871 -10.797 -12.503 -8.626 150 H PHE 872 HN PHE 872 -10.469 -10.435 -9.067 151 HA PHE 872 HA PHE 872 -9.024 -8.397 -10.161 152 HB2 PHE 872 HB1 PHE 872 -7.325 -9.626 -10.974 153 HB3 PHE 872 HB2 PHE 872 -8.323 -11.011 -11.448 154 HD1 PHE 872 HD1 PHE 872 -9.654 -10.922 -13.571 155 HD2 PHE 872 HD2 PHE 872 -6.796 -7.874 -12.522 156 HE1 PHE 872 HE1 PHE 872 -9.579 -10.174 -15.941 157 HE2 PHE 872 HE2 PHE 872 -6.730 -7.118 -14.881 158 HZ PHE 872 HZ PHE 872 -8.123 -8.269 -16.600 159 H LYS 873 HN LYS 873 -11.522 -10.801 -10.377 160 HA LYS 873 HA LYS 873 -13.363 -10.200 -12.219 161 HB2 LYS 873 HB1 LYS 873 -13.500 -11.540 -10.054 162 HB3 LYS 873 HB2 LYS 873 -14.142 -10.046 -9.321 163 HG2 LYS 873 HG1 LYS 873 -16.076 -10.082 -10.723 164 HG3 LYS 873 HG2 LYS 873 -15.270 -11.118 -11.914 165 HD2 LYS 873 HD1 LYS 873 -16.781 -12.548 -10.872 166 HD3 LYS 873 HD2 LYS 873 -15.183 -12.935 -10.240 167 HE2 LYS 873 HE1 LYS 873 -15.928 -11.118 -8.368 168 HE3 LYS 873 HE2 LYS 873 -17.545 -11.582 -8.895 169 HZ1 LYS 873 HZ1 LYS 873 -16.863 -12.974 -7.058 170 HZ2 LYS 873 HZ2 LYS 873 -16.888 -13.918 -8.410 171 HZ3 LYS 873 HZ3 LYS 873 -15.461 -13.386 -7.797 172 H TRP 874 HN TRP 874 -14.955 -8.678 -12.637 173 HA TRP 874 HA TRP 874 -14.575 -5.973 -11.458 174 HB2 TRP 874 HB1 TRP 874 -15.662 -6.704 -14.197 175 HB3 TRP 874 HB2 TRP 874 -15.326 -5.087 -13.598 176 HD1 TRP 874 HD1 TRP 874 -13.581 -8.073 -15.130 177 HE1 TRP 874 HE1 TRP 874 -11.019 -7.654 -15.272 178 HE3 TRP 874 HE3 TRP 874 -13.256 -3.654 -12.570 179 HZ2 TRP 874 HZ2 TRP 874 -9.205 -5.652 -14.694 180 HZ3 TRP 874 HZ3 TRP 874 -11.010 -2.599 -12.266 181 HH2 TRP 874 HH2 TRP 874 -9.034 -3.438 -13.402 182 H ARG 875 HN ARG 875 -16.329 -4.650 -11.016 183 HA ARG 875 HA ARG 875 -19.102 -5.708 -11.186 184 HB2 ARG 875 HB1 ARG 875 -17.661 -4.888 -8.621 185 HB3 ARG 875 HB2 ARG 875 -19.404 -4.807 -8.760 186 HG2 ARG 875 HG1 ARG 875 -17.699 -7.322 -8.938 187 HG3 ARG 875 HG2 ARG 875 -18.764 -6.853 -7.625 188 HD2 ARG 875 HD1 ARG 875 -19.553 -7.754 -10.391 189 HD3 ARG 875 HD2 ARG 875 -19.886 -8.539 -8.847 190 HE ARG 875 HE ARG 875 -21.137 -6.065 -8.605 191 HH11 ARG 875 HH11 ARG 875 -21.492 -8.718 -10.870 192 HH12 ARG 875 HH12 ARG 875 -23.067 -8.124 -11.386 193 HH21 ARG 875 HH21 ARG 875 -23.302 -5.588 -9.239 194 HH22 ARG 875 HH22 ARG 875 -23.934 -6.482 -10.628 195 H ARG 876 HN ARG 876 -20.542 -4.148 -11.659 196 HA ARG 876 HA ARG 876 -19.671 -1.364 -12.019 197 HB2 ARG 876 HB1 ARG 876 -21.225 -2.432 -13.639 198 HB3 ARG 876 HB2 ARG 876 -22.392 -2.697 -12.339 199 HG2 ARG 876 HG1 ARG 876 -23.176 -0.775 -13.472 200 HG3 ARG 876 HG2 ARG 876 -22.460 -0.155 -12.000 201 HD2 ARG 876 HD1 ARG 876 -21.679 1.308 -13.635 202 HD3 ARG 876 HD2 ARG 876 -20.301 0.219 -13.441 203 HE ARG 876 HE ARG 876 -21.262 -1.064 -15.421 204 HH11 ARG 876 HH11 ARG 876 -21.525 2.471 -15.319 205 HH12 ARG 876 HH12 ARG 876 -22.212 2.473 -16.935 206 HH21 ARG 876 HH21 ARG 876 -22.095 -0.846 -17.487 207 HH22 ARG 876 HH22 ARG 876 -22.398 0.773 -18.089 208 H ILE 877 HN ILE 877 -19.874 0.212 -10.621 209 HA ILE 877 HA ILE 877 -21.693 0.027 -8.256 210 HB ILE 877 HB ILE 877 -19.937 0.868 -6.813 211 HG12 ILE 877 HG11 ILE 877 -18.090 0.803 -9.234 212 HG13 ILE 877 HG12 ILE 877 -18.751 2.233 -8.486 213 HG21 ILE 877 HG21 ILE 877 -18.812 -1.493 -8.351 214 HG22 ILE 877 HG22 ILE 877 -18.595 -1.118 -6.623 215 HG23 ILE 877 HG23 ILE 877 -20.178 -1.613 -7.220 216 HD11 ILE 877 HD1 ILE 877 -16.960 0.368 -6.921 217 HD12 ILE 877 HD2 ILE 877 -16.386 1.762 -7.849 218 HD13 ILE 877 HD3 ILE 877 -17.505 1.998 -6.509 219 HA PRO 878 HA PRO 878 -22.492 4.304 -9.309 220 HB2 PRO 878 HB1 PRO 878 -23.199 5.461 -6.918 221 HB3 PRO 878 HB2 PRO 878 -24.249 4.283 -7.768 222 HG2 PRO 878 HG1 PRO 878 -22.289 3.743 -5.510 223 HG3 PRO 878 HG2 PRO 878 -23.999 3.220 -5.634 224 HD2 PRO 878 HD1 PRO 878 -21.940 1.579 -6.313 225 HD3 PRO 878 HD2 PRO 878 -23.471 1.565 -7.234 226 H ALA 879 HN ALA 879 -21.428 6.200 -9.485 227 HA ALA 879 HA ALA 879 -18.694 6.428 -8.958 228 HB1 ALA 879 HB1 ALA 879 -20.025 7.657 -10.669 229 HB2 ALA 879 HB2 ALA 879 -20.747 8.646 -9.382 230 HB3 ALA 879 HB3 ALA 879 -19.001 8.744 -9.707 231 H SER 880 HN SER 880 -21.283 7.183 -6.697 232 HA SER 880 HA SER 880 -19.914 8.839 -4.829 233 HB2 SER 880 HB1 SER 880 -21.907 6.612 -4.242 234 HB3 SER 880 HB2 SER 880 -21.520 8.001 -3.206 235 HG SER 880 HG1 SER 880 -23.432 8.367 -4.403 236 H VAL 881 HN VAL 881 -19.577 5.408 -5.536 237 HA VAL 881 HA VAL 881 -17.714 5.000 -3.246 238 HB VAL 881 HB VAL 881 -18.960 3.008 -5.188 239 HG11 VAL 881 HG11 VAL 881 -17.368 2.437 -2.659 240 HG12 VAL 881 HG12 VAL 881 -18.188 1.234 -3.676 241 HG13 VAL 881 HG13 VAL 881 -16.810 2.119 -4.324 242 HG21 VAL 881 HG21 VAL 881 -20.279 2.245 -3.243 243 HG22 VAL 881 HG22 VAL 881 -19.586 3.555 -2.261 244 HG23 VAL 881 HG23 VAL 881 -20.635 3.923 -3.645 245 H VAL 882 HN VAL 882 -17.750 5.167 -6.785 246 HA VAL 882 HA VAL 882 -15.172 4.047 -7.100 247 HB VAL 882 HB VAL 882 -15.198 4.789 -9.308 248 HG11 VAL 882 HG11 VAL 882 -17.997 4.318 -8.457 249 HG12 VAL 882 HG12 VAL 882 -17.690 4.804 -10.104 250 HG13 VAL 882 HG13 VAL 882 -16.905 3.357 -9.465 251 HG21 VAL 882 HG21 VAL 882 -15.090 7.075 -9.281 252 HG22 VAL 882 HG22 VAL 882 -16.454 6.660 -10.306 253 HG23 VAL 882 HG23 VAL 882 -16.725 7.249 -8.655 254 H GLY 883 HN GLY 883 -16.092 7.218 -6.183 255 HA2 GLY 883 HA1 GLY 883 -13.413 8.439 -6.363 256 HA3 GLY 883 HA2 GLY 883 -14.867 9.155 -5.661 257 H SER 884 HN SER 884 -15.021 6.448 -4.054 258 HA SER 884 HA SER 884 -13.471 7.392 -1.708 259 HB2 SER 884 HB1 SER 884 -15.888 6.877 -1.509 260 HB3 SER 884 HB2 SER 884 -15.559 5.199 -1.977 261 HG SER 884 HG1 SER 884 -15.669 5.531 0.320 262 H ILE 885 HN ILE 885 -13.621 4.639 -3.969 263 HA ILE 885 HA ILE 885 -11.774 2.994 -2.426 264 HB ILE 885 HB ILE 885 -13.314 2.755 -4.977 265 HG12 ILE 885 HG11 ILE 885 -14.037 0.660 -4.032 266 HG13 ILE 885 HG12 ILE 885 -12.838 0.732 -2.733 267 HG21 ILE 885 HG21 ILE 885 -10.884 1.063 -4.336 268 HG22 ILE 885 HG22 ILE 885 -12.222 0.537 -5.399 269 HG23 ILE 885 HG23 ILE 885 -11.284 1.951 -5.849 270 HD11 ILE 885 HD1 ILE 885 -15.048 2.763 -3.048 271 HD12 ILE 885 HD2 ILE 885 -15.231 1.265 -2.110 272 HD13 ILE 885 HD3 ILE 885 -14.029 2.480 -1.618 273 H ASP 886 HN ASP 886 -9.767 3.360 -2.201 274 HA ASP 886 HA ASP 886 -8.194 5.154 -3.910 275 HB2 ASP 886 HB1 ASP 886 -7.555 3.707 -1.312 276 HB3 ASP 886 HB2 ASP 886 -6.483 4.853 -2.102 277 H GLU 887 HN GLU 887 -5.834 4.632 -4.357 278 HA GLU 887 HA GLU 887 -5.536 2.258 -5.985 279 HB2 GLU 887 HB1 GLU 887 -3.473 4.207 -4.892 280 HB3 GLU 887 HB2 GLU 887 -3.171 2.974 -6.128 281 HG2 GLU 887 HG1 GLU 887 -4.954 4.040 -7.552 282 HG3 GLU 887 HG2 GLU 887 -5.044 5.362 -6.385 283 H SER 888 HN SER 888 -4.627 3.016 -2.665 284 HA SER 888 HA SER 888 -3.342 0.394 -2.207 285 HB2 SER 888 HB1 SER 888 -2.721 1.385 -0.038 286 HB3 SER 888 HB2 SER 888 -2.230 2.399 -1.398 287 HG SER 888 HG1 SER 888 -4.330 2.809 0.460 288 H SER 889 HN SER 889 -6.431 1.011 -2.534 289 HA SER 889 HA SER 889 -7.628 0.353 0.009 290 HB2 SER 889 HB1 SER 889 -8.658 1.661 -1.878 291 HB3 SER 889 HB2 SER 889 -8.873 0.134 -2.747 292 HG SER 889 HG1 SER 889 -10.068 1.028 -0.321 293 H ARG 890 HN ARG 890 -9.401 -1.423 -0.146 294 HA ARG 890 HA ARG 890 -8.524 -3.995 -1.226 295 HB2 ARG 890 HB1 ARG 890 -8.712 -5.206 0.902 296 HB3 ARG 890 HB2 ARG 890 -7.345 -4.096 0.836 297 HG2 ARG 890 HG1 ARG 890 -8.556 -2.459 2.241 298 HG3 ARG 890 HG2 ARG 890 -9.971 -3.529 2.290 299 HD2 ARG 890 HD1 ARG 890 -8.612 -5.279 3.389 300 HD3 ARG 890 HD2 ARG 890 -7.194 -4.209 3.335 301 HE ARG 890 HE ARG 890 -9.313 -2.824 4.638 302 HH11 ARG 890 HH11 ARG 890 -7.207 -5.540 5.317 303 HH12 ARG 890 HH12 ARG 890 -7.310 -5.308 7.042 304 HH21 ARG 890 HH21 ARG 890 -9.401 -2.583 6.847 305 HH22 ARG 890 HH22 ARG 890 -8.523 -3.674 7.878 306 H TRP 891 HN TRP 891 -10.347 -2.761 -2.317 307 HA TRP 891 HA TRP 891 -13.071 -3.405 -1.347 308 HB2 TRP 891 HB1 TRP 891 -12.627 -1.445 -2.798 309 HB3 TRP 891 HB2 TRP 891 -12.251 -2.550 -4.122 310 HD1 TRP 891 HD1 TRP 891 -15.017 -0.855 -2.351 311 HE1 TRP 891 HE1 TRP 891 -17.290 -1.413 -3.360 312 HE3 TRP 891 HE3 TRP 891 -13.643 -4.873 -5.227 313 HZ2 TRP 891 HZ2 TRP 891 -18.446 -3.599 -4.893 314 HZ3 TRP 891 HZ3 TRP 891 -15.383 -6.261 -6.327 315 HH2 TRP 891 HH2 TRP 891 -17.774 -5.635 -6.140 316 H ILE 892 HN ILE 892 -13.950 -5.431 -1.620 317 HA ILE 892 HA ILE 892 -12.934 -7.226 -3.760 318 HB ILE 892 HB ILE 892 -12.709 -9.080 -2.208 319 HG12 ILE 892 HG11 ILE 892 -12.981 -7.199 0.140 320 HG13 ILE 892 HG12 ILE 892 -14.363 -8.091 -0.505 321 HG21 ILE 892 HG21 ILE 892 -10.606 -8.476 -1.147 322 HG22 ILE 892 HG22 ILE 892 -10.703 -7.670 -2.717 323 HG23 ILE 892 HG23 ILE 892 -10.992 -6.759 -1.227 324 HD11 ILE 892 HD1 ILE 892 -13.336 -9.262 1.388 325 HD12 ILE 892 HD2 ILE 892 -13.394 -10.208 -0.115 326 HD13 ILE 892 HD3 ILE 892 -11.855 -9.486 0.445 327 H CYS 893 HN CYS 893 -14.270 -9.172 -4.114 328 HA CYS 893 HA CYS 893 -16.930 -8.732 -4.504 329 HB2 CYS 893 HB1 CYS 893 -15.824 -11.444 -3.733 330 HB3 CYS 893 HB2 CYS 893 -17.227 -11.066 -4.744 331 H MET 894 HN MET 894 -15.563 -10.067 -1.400 332 HA MET 894 HA MET 894 -18.050 -10.841 -0.253 333 HB2 MET 894 HB1 MET 894 -15.820 -11.497 0.539 334 HB3 MET 894 HB2 MET 894 -15.510 -9.850 1.079 335 HG2 MET 894 HG1 MET 894 -17.807 -11.486 2.165 336 HG3 MET 894 HG2 MET 894 -16.172 -11.637 2.794 337 HE1 MET 894 HE1 MET 894 -14.844 -9.862 4.118 338 HE2 MET 894 HE2 MET 894 -15.039 -8.569 2.908 339 HE3 MET 894 HE3 MET 894 -15.474 -8.272 4.600 340 H ASN 895 HN ASN 895 -16.600 -7.659 -0.502 341 HA ASN 895 HA ASN 895 -18.493 -6.396 1.374 342 HB2 ASN 895 HB1 ASN 895 -16.785 -5.018 1.710 343 HB3 ASN 895 HB2 ASN 895 -15.810 -5.962 0.596 344 HD21 ASN 895 HD21 ASN 895 -16.260 -5.362 -1.855 345 HD22 ASN 895 HD22 ASN 895 -16.326 -3.622 -2.131 346 H ASN 896 HN ASN 896 -18.530 -7.201 -1.884 347 HA ASN 896 HA ASN 896 -19.397 -4.979 -3.276 348 HB2 ASN 896 HB1 ASN 896 -18.786 -7.123 -4.319 349 HB3 ASN 896 HB2 ASN 896 -20.249 -7.866 -3.661 350 HD21 ASN 896 HD21 ASN 896 -21.668 -8.277 -5.324 351 HD22 ASN 896 HD22 ASN 896 -21.981 -7.127 -6.597 352 H SER 897 HN SER 897 -21.153 -3.883 -3.667 353 HA SER 897 HA SER 897 -23.357 -3.595 -2.009 354 HB2 SER 897 HB1 SER 897 -23.059 -3.099 -4.999 355 HB3 SER 897 HB2 SER 897 -24.398 -2.485 -4.033 356 HG SER 897 HG1 SER 897 -22.918 -1.257 -2.827 357 H ASP 898 HN ASP 898 -23.250 -5.503 -4.988 358 HA ASP 898 HA ASP 898 -26.047 -6.402 -4.672 359 HB2 ASP 898 HB1 ASP 898 -24.169 -7.247 -6.871 360 HB3 ASP 898 HB2 ASP 898 -25.923 -7.232 -6.871 361 H LYS 899 HN LYS 899 -26.345 -7.872 -3.206 362 HA LYS 899 HA LYS 899 -24.594 -9.832 -2.236 363 HB2 LYS 899 HB1 LYS 899 -27.643 -9.842 -2.260 364 HB3 LYS 899 HB2 LYS 899 -26.627 -10.868 -1.253 365 HG2 LYS 899 HG1 LYS 899 -26.315 -7.856 -1.100 366 HG3 LYS 899 HG2 LYS 899 -27.642 -8.651 -0.261 367 HD2 LYS 899 HD1 LYS 899 -24.792 -9.608 0.065 368 HD3 LYS 899 HD2 LYS 899 -25.473 -8.291 1.055 369 HE2 LYS 899 HE1 LYS 899 -27.298 -9.788 1.798 370 HE3 LYS 899 HE2 LYS 899 -26.644 -11.097 0.811 371 HZ1 LYS 899 HZ1 LYS 899 -25.930 -11.289 3.129 372 HZ2 LYS 899 HZ2 LYS 899 -24.623 -11.031 2.187 373 HZ3 LYS 899 HZ3 LYS 899 -25.232 -9.817 3.096 374 H ARG 900 HN ARG 900 -26.490 -9.977 -5.108 375 HA ARG 900 HA ARG 900 -26.416 -12.844 -5.623 376 HB2 ARG 900 HB1 ARG 900 -26.710 -10.378 -7.399 377 HB3 ARG 900 HB2 ARG 900 -26.793 -12.015 -8.021 378 HG2 ARG 900 HG1 ARG 900 -28.678 -10.820 -5.933 379 HG3 ARG 900 HG2 ARG 900 -29.016 -10.988 -7.658 380 HD2 ARG 900 HD1 ARG 900 -28.787 -13.462 -7.452 381 HD3 ARG 900 HD2 ARG 900 -28.551 -13.274 -5.700 382 HE ARG 900 HE ARG 900 -30.946 -11.929 -6.400 383 HH11 ARG 900 HH11 ARG 900 -29.821 -15.245 -6.259 384 HH12 ARG 900 HH12 ARG 900 -31.423 -15.872 -5.979 385 HH21 ARG 900 HH21 ARG 900 -32.960 -12.795 -6.043 386 HH22 ARG 900 HH22 ARG 900 -33.149 -14.513 -5.862 387 H PHE 901 HN PHE 901 -24.039 -10.345 -5.984 388 HA PHE 901 HA PHE 901 -22.154 -12.284 -7.250 389 HB2 PHE 901 HB1 PHE 901 -22.216 -9.288 -7.733 390 HB3 PHE 901 HB2 PHE 901 -21.188 -10.463 -8.535 391 HD1 PHE 901 HD1 PHE 901 -24.720 -9.286 -8.194 392 HD2 PHE 901 HD2 PHE 901 -21.887 -11.464 -10.592 393 HE1 PHE 901 HE1 PHE 901 -26.389 -9.458 -10.022 394 HE2 PHE 901 HE2 PHE 901 -23.554 -11.648 -12.410 395 HZ PHE 901 HZ PHE 901 -25.815 -10.650 -12.126 396 H ALA 902 HN ALA 902 -22.653 -11.175 -4.408 397 HA ALA 902 HA ALA 902 -20.087 -9.971 -3.796 398 HB1 ALA 902 HB1 ALA 902 -22.493 -10.448 -1.979 399 HB2 ALA 902 HB2 ALA 902 -21.110 -9.393 -1.636 400 HB3 ALA 902 HB3 ALA 902 -22.229 -8.968 -2.938 401 H ASP 903 HN ASP 903 -19.601 -12.447 -4.554 402 HA ASP 903 HA ASP 903 -17.897 -13.084 -2.327 403 HB2 ASP 903 HB1 ASP 903 -20.049 -15.004 -2.984 404 HB3 ASP 903 HB2 ASP 903 -18.449 -15.710 -3.021 405 H CYS 904 HN CYS 904 -16.002 -14.040 -2.786 406 HA CYS 904 HA CYS 904 -14.882 -13.604 -5.331 407 HB2 CYS 904 HB1 CYS 904 -14.043 -15.238 -2.899 408 HB3 CYS 904 HB2 CYS 904 -12.999 -14.913 -4.283 409 H SER 905 HN SER 905 -17.024 -16.035 -4.443 410 HA SER 905 HA SER 905 -16.044 -18.062 -6.390 411 HB2 SER 905 HB1 SER 905 -18.376 -18.193 -4.449 412 HB3 SER 905 HB2 SER 905 -17.791 -19.500 -5.498 413 HG SER 905 HG1 SER 905 -16.955 -19.670 -3.362 414 H LYS 906 HN LYS 906 -18.310 -15.431 -6.133 415 HA LYS 906 HA LYS 906 -20.288 -16.471 -8.044 416 HB2 LYS 906 HB1 LYS 906 -19.823 -13.715 -6.863 417 HB3 LYS 906 HB2 LYS 906 -21.243 -14.205 -7.819 418 HG2 LYS 906 HG1 LYS 906 -20.506 -15.066 -5.061 419 HG3 LYS 906 HG2 LYS 906 -21.905 -14.118 -5.580 420 HD2 LYS 906 HD1 LYS 906 -21.338 -17.039 -6.181 421 HD3 LYS 906 HD2 LYS 906 -22.506 -16.427 -5.004 422 HE2 LYS 906 HE1 LYS 906 -23.768 -15.353 -6.877 423 HE3 LYS 906 HE2 LYS 906 -22.645 -16.066 -8.033 424 HZ1 LYS 906 HZ1 LYS 906 -24.635 -17.430 -7.781 425 HZ2 LYS 906 HZ2 LYS 906 -23.346 -18.272 -7.243 426 HZ3 LYS 906 HZ3 LYS 906 -24.390 -17.602 -6.179 427 H SER 907 HN SER 907 -20.990 -14.677 -9.706 428 HA SER 907 HA SER 907 -18.796 -14.595 -11.707 429 HB2 SER 907 HB1 SER 907 -20.911 -15.890 -12.118 430 HB3 SER 907 HB2 SER 907 -21.778 -14.346 -12.159 431 HG SER 907 HG1 SER 907 -19.845 -15.400 -13.945 432 H GLN 908 HN GLN 908 -20.127 -12.727 -13.401 433 HA GLN 908 HA GLN 908 -20.184 -10.103 -12.055 434 HB2 GLN 908 HB1 GLN 908 -18.447 -9.142 -13.441 435 HB3 GLN 908 HB2 GLN 908 -17.799 -10.519 -12.552 436 HG2 GLN 908 HG1 GLN 908 -18.416 -11.829 -14.812 437 HG3 GLN 908 HG2 GLN 908 -18.400 -10.237 -15.486 438 HE21 GLN 908 HE21 GLN 908 -16.294 -9.273 -15.924 439 HE22 GLN 908 HE22 GLN 908 -14.803 -10.118 -15.500 440 H GLU 909 HN GLU 909 -20.861 -8.321 -13.711 441 HA GLU 909 HA GLU 909 -23.167 -9.220 -15.203 442 HB2 GLU 909 HB1 GLU 909 -21.637 -6.616 -15.442 443 HB3 GLU 909 HB2 GLU 909 -23.252 -6.900 -16.056 444 HG2 GLU 909 HG1 GLU 909 -22.359 -6.693 -13.173 445 HG3 GLU 909 HG2 GLU 909 -23.319 -5.536 -14.071 446 H MET 910 HN MET 910 -19.811 -8.713 -16.151 447 HA MET 910 HA MET 910 -20.269 -9.562 -18.941 448 HB2 MET 910 HB1 MET 910 -19.059 -6.854 -18.239 449 HB3 MET 910 HB2 MET 910 -19.063 -7.605 -19.832 450 HG2 MET 910 HG1 MET 910 -21.531 -7.439 -19.900 451 HG3 MET 910 HG2 MET 910 -21.516 -6.674 -18.303 452 HE1 MET 910 HE1 MET 910 -22.916 -4.634 -19.142 453 HE2 MET 910 HE2 MET 910 -22.514 -3.679 -20.586 454 HE3 MET 910 HE3 MET 910 -23.002 -5.380 -20.754 455 H SER 911 HN SER 911 -18.493 -10.700 -19.635 456 HA SER 911 HA SER 911 -16.358 -11.333 -17.770 457 HB2 SER 911 HB1 SER 911 -16.204 -11.831 -20.733 458 HB3 SER 911 HB2 SER 911 -15.449 -12.743 -19.435 459 HG SER 911 HG1 SER 911 -17.451 -13.556 -18.817 460 H ASN 912 HN ASN 912 -13.977 -11.081 -18.329 461 HA ASN 912 HA ASN 912 -13.498 -8.247 -18.479 462 HB2 ASN 912 HB1 ASN 912 -12.009 -9.557 -17.112 463 HB3 ASN 912 HB2 ASN 912 -11.605 -10.644 -18.460 464 HD21 ASN 912 HD21 ASN 912 -11.422 -7.212 -17.465 465 HD22 ASN 912 HD22 ASN 912 -9.884 -6.939 -18.303 466 H GLU 913 HN GLU 913 -13.345 -10.708 -20.983 467 HA GLU 913 HA GLU 913 -12.178 -9.029 -23.047 468 HB2 GLU 913 HB1 GLU 913 -11.995 -11.409 -23.069 469 HB3 GLU 913 HB2 GLU 913 -13.718 -11.657 -23.010 470 HG2 GLU 913 HG1 GLU 913 -12.408 -10.230 -25.356 471 HG3 GLU 913 HG2 GLU 913 -12.330 -11.975 -25.217 472 H GLU 914 HN GLU 914 -15.247 -8.915 -21.581 473 HA GLU 914 HA GLU 914 -16.513 -7.472 -23.880 474 HB2 GLU 914 HB1 GLU 914 -17.728 -8.535 -21.311 475 HB3 GLU 914 HB2 GLU 914 -18.593 -7.671 -22.585 476 HG2 GLU 914 HG1 GLU 914 -18.039 -9.498 -24.177 477 HG3 GLU 914 HG2 GLU 914 -17.230 -10.383 -22.877 478 H ILE 915 HN ILE 915 -15.946 -7.178 -20.306 479 HA ILE 915 HA ILE 915 -16.537 -4.368 -20.433 480 HB ILE 915 HB ILE 915 -17.221 -5.636 -18.601 481 HG12 ILE 915 HG11 ILE 915 -16.918 -4.038 -16.907 482 HG13 ILE 915 HG12 ILE 915 -15.297 -3.634 -17.388 483 HG21 ILE 915 HG21 ILE 915 -14.291 -5.987 -17.878 484 HG22 ILE 915 HG22 ILE 915 -15.610 -6.160 -16.691 485 HG23 ILE 915 HG23 ILE 915 -15.546 -7.219 -18.081 486 HD11 ILE 915 HD1 ILE 915 -17.841 -2.874 -18.885 487 HD12 ILE 915 HD2 ILE 915 -16.694 -1.801 -18.028 488 HD13 ILE 915 HD3 ILE 915 -16.211 -2.570 -19.516 489 H ASN 916 HN ASN 916 -14.060 -5.667 -21.576 490 HA ASN 916 HA ASN 916 -12.406 -3.206 -21.109 491 HB2 ASN 916 HB1 ASN 916 -10.435 -4.249 -21.916 492 HB3 ASN 916 HB2 ASN 916 -11.141 -5.328 -20.751 493 HD21 ASN 916 HD21 ASN 916 -9.277 -6.498 -22.256 494 HD22 ASN 916 HD22 ASN 916 -10.003 -7.446 -23.553 495 H GLU 917 HN GLU 917 -13.951 -5.102 -23.659 496 HA GLU 917 HA GLU 917 -13.493 -3.299 -25.810 497 HB2 GLU 917 HB1 GLU 917 -15.257 -5.607 -25.207 498 HB3 GLU 917 HB2 GLU 917 -15.830 -4.551 -26.480 499 HG2 GLU 917 HG1 GLU 917 -13.021 -5.735 -26.429 500 HG3 GLU 917 HG2 GLU 917 -14.398 -6.513 -27.207 501 H GLU 918 HN GLU 918 -16.073 -3.307 -23.359 502 HA GLU 918 HA GLU 918 -17.806 -1.469 -24.625 503 HB2 GLU 918 HB1 GLU 918 -18.143 -2.856 -22.441 504 HB3 GLU 918 HB2 GLU 918 -17.348 -1.510 -21.625 505 HG2 GLU 918 HG1 GLU 918 -19.799 -1.345 -21.482 506 HG3 GLU 918 HG2 GLU 918 -19.111 0.033 -22.318 507 H LEU 919 HN LEU 919 -14.820 -0.824 -22.890 508 HA LEU 919 HA LEU 919 -15.217 2.113 -23.124 509 HB2 LEU 919 HB1 LEU 919 -12.912 0.705 -21.748 510 HB3 LEU 919 HB2 LEU 919 -13.370 2.392 -21.666 511 HG LEU 919 HG LEU 919 -15.687 1.184 -20.783 512 HD11 LEU 919 HD11 LEU 919 -15.058 -0.533 -19.175 513 HD12 LEU 919 HD12 LEU 919 -14.615 -1.052 -20.799 514 HD13 LEU 919 HD13 LEU 919 -13.359 -0.450 -19.704 515 HD21 LEU 919 HD21 LEU 919 -14.687 3.056 -19.707 516 HD22 LEU 919 HD22 LEU 919 -14.859 1.755 -18.491 517 HD23 LEU 919 HD23 LEU 919 -13.265 2.132 -19.234 518 H GLY 920 HN GLY 920 -13.257 -0.541 -24.333 519 HA2 GLY 920 HA1 GLY 920 -12.216 -0.561 -26.488 520 HA3 GLY 920 HA2 GLY 920 -12.046 1.195 -26.451 521 H ILE 921 HN ILE 921 -11.207 -1.189 -23.942 522 HA ILE 921 HA ILE 921 -8.322 -0.415 -24.062 523 HB ILE 921 HB ILE 921 -8.241 -0.551 -21.633 524 HG12 ILE 921 HG11 ILE 921 -11.270 -0.891 -21.706 525 HG13 ILE 921 HG12 ILE 921 -10.092 -2.121 -21.237 526 HG21 ILE 921 HG21 ILE 921 -8.637 1.596 -22.834 527 HG22 ILE 921 HG22 ILE 921 -10.377 1.426 -22.510 528 HG23 ILE 921 HG23 ILE 921 -9.224 1.593 -21.170 529 HD11 ILE 921 HD1 ILE 921 -10.999 -1.220 -19.231 530 HD12 ILE 921 HD2 ILE 921 -9.333 -0.618 -19.376 531 HD13 ILE 921 HD3 ILE 921 -10.709 0.449 -19.752 532 H GLY 922 HN GLY 922 -6.962 -2.010 -22.761 533 HA2 GLY 922 HA1 GLY 922 -7.492 -4.715 -23.913 534 HA3 GLY 922 HA2 GLY 922 -5.938 -4.043 -23.448 535 H GLN 923 HN GLN 923 -6.567 -3.243 -20.782 536 HA GLN 923 HA GLN 923 -6.120 -4.043 -18.756 537 HB2 GLN 923 HB1 GLN 923 -8.681 -4.994 -19.377 538 HB3 GLN 923 HB2 GLN 923 -7.871 -6.414 -18.739 539 HG2 GLN 923 HG1 GLN 923 -8.896 -5.345 -16.907 540 HG3 GLN 923 HG2 GLN 923 -7.181 -4.997 -16.727 541 HE21 GLN 923 HE21 GLN 923 -9.532 -3.465 -15.650 542 HE22 GLN 923 HE22 GLN 923 -9.287 -1.848 -16.297 543 H ASP 924 HN ASP 924 -5.986 -6.746 -17.671 544 HA ASP 924 HA ASP 924 -3.249 -7.241 -18.189 545 HB2 ASP 924 HB1 ASP 924 -4.549 -7.808 -16.134 546 HB3 ASP 924 HB2 ASP 924 -5.352 -9.103 -17.011 547 H GLU 925 HN GLU 925 -6.116 -8.753 -19.615 548 HA GLU 925 HA GLU 925 -4.753 -10.851 -21.083 549 HB2 GLU 925 HB1 GLU 925 -7.446 -9.470 -21.471 550 HB3 GLU 925 HB2 GLU 925 -6.845 -10.804 -22.466 551 HG2 GLU 925 HG1 GLU 925 -6.518 -12.142 -20.335 552 HG3 GLU 925 HG2 GLU 925 -7.331 -10.846 -19.457 553 H ALA 926 HN ALA 926 -5.361 -7.531 -21.735 554 HA ALA 926 HA ALA 926 -4.417 -5.943 -22.976 555 HB1 ALA 926 HB1 ALA 926 -2.431 -8.047 -23.857 556 HB2 ALA 926 HB2 ALA 926 -2.213 -6.285 -23.913 557 HB3 ALA 926 HB3 ALA 926 -2.323 -7.109 -22.341 558 H ASP 927 HN ASP 927 -4.641 -8.876 -24.846 559 HA ASP 927 HA ASP 927 -4.819 -7.569 -27.423 560 HB2 ASP 927 HB1 ASP 927 -3.773 -9.812 -26.900 561 HB3 ASP 927 HB2 ASP 927 -5.398 -10.476 -26.756 562 H ALA 928 HN ALA 928 -6.843 -6.583 -25.800 563 HA ALA 928 HA ALA 928 -9.050 -6.170 -25.493 564 HB1 ALA 928 HB1 ALA 928 -10.252 -5.627 -27.545 565 HB2 ALA 928 HB2 ALA 928 -8.570 -5.075 -27.620 566 HB3 ALA 928 HB3 ALA 928 -9.066 -6.535 -28.506 567 H1 ALA 1 HT1 ALA 1 -9.640 2.494 -7.273 568 H2 ALA 1 HT2 ALA 1 -8.167 3.192 -7.186 569 H3 ALA 1 HT3 ALA 1 -8.769 2.405 -5.874 570 HA ALA 1 HA ALA 1 -7.078 1.076 -6.943 571 HB1 ALA 1 HB1 ALA 1 -8.902 -0.084 -5.729 572 HB2 ALA 1 HB2 ALA 1 -9.890 -0.099 -7.206 573 HB3 ALA 1 HB3 ALA 1 -8.376 -1.020 -7.130 574 H ARG 2 HN ARG 2 -6.480 -0.243 -8.894 575 HA ARG 2 HA ARG 2 -6.894 1.140 -11.381 576 HB2 ARG 2 HB1 ARG 2 -4.901 -0.192 -11.042 577 HB3 ARG 2 HB2 ARG 2 -5.847 -1.653 -10.770 578 HG2 ARG 2 HG1 ARG 2 -4.809 -1.634 -12.986 579 HG3 ARG 2 HG2 ARG 2 -6.556 -1.722 -13.108 580 HD2 ARG 2 HD1 ARG 2 -5.520 1.062 -13.192 581 HD3 ARG 2 HD2 ARG 2 -4.825 0.047 -14.430 582 HE ARG 2 HE ARG 2 -7.705 0.783 -14.178 583 HH11 ARG 2 HH11 ARG 2 -5.362 -1.130 -16.026 584 HH12 ARG 2 HH12 ARG 2 -6.448 -1.199 -17.380 585 HH21 ARG 2 HH21 ARG 2 -8.852 0.817 -16.032 586 HH22 ARG 2 HH22 ARG 2 -8.238 -0.024 -17.448 587 H THR 3 HN THR 3 -8.822 1.371 -12.218 588 HA THR 3 HA THR 3 -10.254 -0.955 -13.231 589 HB THR 3 HB THR 3 -11.128 -0.611 -10.868 590 HG1 THR 3 HG1 THR 3 -12.554 -1.539 -12.239 591 HG21 THR 3 HG21 THR 3 -10.966 1.944 -10.883 592 HG22 THR 3 HG22 THR 3 -12.434 1.944 -11.883 593 HG23 THR 3 HG23 THR 3 -12.465 1.250 -10.257 594 H MLZ 4 HN MLZ 4 -12.691 0.556 -13.797 595 HA MLZ 4 HA MLZ 4 -11.813 2.345 -15.984 596 HB2 MLZ 4 HB1 MLZ 4 -12.621 0.854 -17.677 597 HB3 MLZ 4 HB2 MLZ 4 -11.533 -0.068 -16.707 598 HG2 MLZ 4 HG1 MLZ 4 -14.560 -0.170 -16.283 599 HG3 MLZ 4 HG2 MLZ 4 -13.762 -1.111 -17.524 600 HD2 MLZ 4 HD1 MLZ 4 -13.007 -1.389 -14.633 601 HD3 MLZ 4 HD2 MLZ 4 -14.226 -2.380 -15.421 602 HE2 MLZ 4 HE1 MLZ 4 -11.449 -2.099 -16.606 603 HE3 MLZ 4 HE2 MLZ 4 -11.744 -3.223 -15.266 604 HZ MLZ 4 HZ1 MLZ 4 -13.306 -3.292 -17.811 605 HCM1 MLZ 4 HC1 MLZ 4 -11.950 -5.118 -18.486 606 HCM2 MLZ 4 HC2 MLZ 4 -10.949 -3.687 -18.224 607 HCM3 MLZ 4 HC3 MLZ 4 -11.008 -4.958 -16.977 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.342 -4.400 -16.601 609 H GLN 5 HN GLN 5 -13.578 3.463 -17.067 610 HA GLN 5 HA GLN 5 -16.183 3.457 -15.619 611 HB2 GLN 5 HB1 GLN 5 -16.254 5.843 -15.533 612 HB3 GLN 5 HB2 GLN 5 -14.883 5.211 -14.639 613 HG2 GLN 5 HG1 GLN 5 -13.511 6.592 -15.704 614 HG3 GLN 5 HG2 GLN 5 -13.880 5.849 -17.248 615 HE21 GLN 5 HE21 GLN 5 -15.737 6.787 -18.482 616 HE22 GLN 5 HE22 GLN 5 -16.142 8.489 -18.213 617 H THR 6 HN THR 6 -17.393 2.473 -17.095 618 HA THR 6 HA THR 6 -17.331 2.945 -19.914 619 HB THR 6 HB THR 6 -19.707 1.857 -19.687 620 HG1 THR 6 HG1 THR 6 -19.837 2.227 -17.424 621 HG21 THR 6 HG21 THR 6 -17.779 0.601 -20.476 622 HG22 THR 6 HG22 THR 6 -17.192 0.393 -18.807 623 HG23 THR 6 HG23 THR 6 -18.709 -0.378 -19.336 624 H ALA 7 HN ALA 7 -18.259 4.432 -21.139 625 HA ALA 7 HA ALA 7 -19.877 6.604 -20.040 626 HB1 ALA 7 HB1 ALA 7 -18.060 6.985 -21.664 627 HB2 ALA 7 HB2 ALA 7 -18.940 6.010 -22.869 628 HB3 ALA 7 HB3 ALA 7 -19.626 7.542 -22.283 629 H ARG 8 HN ARG 8 -21.221 4.304 -19.648 630 HA ARG 8 HA ARG 8 -23.706 4.464 -21.153 631 HB2 ARG 8 HB1 ARG 8 -21.904 2.821 -22.385 632 HB3 ARG 8 HB2 ARG 8 -22.419 1.708 -21.144 633 HG2 ARG 8 HG1 ARG 8 -23.974 1.179 -22.744 634 HG3 ARG 8 HG2 ARG 8 -24.877 2.476 -21.967 635 HD2 ARG 8 HD1 ARG 8 -23.266 2.555 -24.546 636 HD3 ARG 8 HD2 ARG 8 -25.001 2.795 -24.351 637 HE ARG 8 HE ARG 8 -22.926 4.697 -23.270 638 HH11 ARG 8 HH11 ARG 8 -25.902 4.385 -25.114 639 HH12 ARG 8 HH12 ARG 8 -26.085 6.115 -25.219 640 HH21 ARG 8 HH21 ARG 8 -23.216 6.764 -23.400 641 HH22 ARG 8 HH22 ARG 8 -24.571 7.460 -24.270 642 H TYR 9 HN TYR 9 -25.100 4.488 -19.539 643 HA TYR 9 HA TYR 9 -25.159 2.372 -17.492 644 HB2 TYR 9 HB1 TYR 9 -23.673 4.142 -16.551 645 HB3 TYR 9 HB2 TYR 9 -24.961 5.312 -16.740 646 HD1 TYR 9 HD1 TYR 9 -26.150 5.826 -14.786 647 HD2 TYR 9 HD2 TYR 9 -24.472 1.877 -15.231 648 HE1 TYR 9 HE1 TYR 9 -26.924 5.231 -12.490 649 HE2 TYR 9 HE2 TYR 9 -25.237 1.288 -12.938 650 HH TYR 9 HH TYR 9 -26.368 1.989 -11.071 Start of MODEL 9 1 H1 GLY 850 HT1 GLY 850 6.272 -3.553 -7.446 2 H2 GLY 850 HT2 GLY 850 5.396 -2.176 -7.309 3 H3 GLY 850 HT3 GLY 850 6.841 -2.153 -8.083 4 HA2 GLY 850 HA1 GLY 850 5.066 -2.071 -9.695 5 HA3 GLY 850 HA2 GLY 850 6.002 -3.569 -9.836 6 H SER 851 HN SER 851 3.984 -4.264 -10.956 7 HA SER 851 HA SER 851 2.267 -5.799 -9.137 8 HB2 SER 851 HB1 SER 851 1.112 -3.569 -9.348 9 HB3 SER 851 HB2 SER 851 1.016 -3.836 -11.096 10 HG SER 851 HG1 SER 851 -0.272 -5.201 -8.980 11 H ARG 852 HN ARG 852 0.770 -7.228 -10.409 12 HA ARG 852 HA ARG 852 1.854 -8.116 -13.068 13 HB2 ARG 852 HB1 ARG 852 -0.169 -9.466 -11.242 14 HB3 ARG 852 HB2 ARG 852 0.540 -10.143 -12.703 15 HG2 ARG 852 HG1 ARG 852 2.042 -9.540 -10.108 16 HG3 ARG 852 HG2 ARG 852 1.486 -11.109 -10.659 17 HD2 ARG 852 HD1 ARG 852 3.810 -11.003 -11.091 18 HD3 ARG 852 HD2 ARG 852 2.973 -10.933 -12.655 19 HE ARG 852 HE ARG 852 3.445 -8.274 -11.787 20 HH11 ARG 852 HH11 ARG 852 5.442 -10.939 -12.867 21 HH12 ARG 852 HH12 ARG 852 6.605 -9.870 -13.604 22 HH21 ARG 852 HH21 ARG 852 4.852 -7.002 -12.780 23 HH22 ARG 852 HH22 ARG 852 6.294 -7.659 -13.526 24 H ARG 853 HN ARG 853 -0.725 -6.296 -11.730 25 HA ARG 853 HA ARG 853 -2.256 -6.450 -14.294 26 HB2 ARG 853 HB1 ARG 853 -4.121 -5.391 -13.108 27 HB3 ARG 853 HB2 ARG 853 -3.646 -6.941 -12.457 28 HG2 ARG 853 HG1 ARG 853 -4.273 -5.499 -10.662 29 HG3 ARG 853 HG2 ARG 853 -2.551 -5.844 -10.529 30 HD2 ARG 853 HD1 ARG 853 -2.033 -3.636 -11.511 31 HD3 ARG 853 HD2 ARG 853 -3.769 -3.338 -11.753 32 HE ARG 853 HE ARG 853 -3.251 -3.834 -8.983 33 HH11 ARG 853 HH11 ARG 853 -2.623 -1.364 -11.419 34 HH12 ARG 853 HH12 ARG 853 -2.459 -0.115 -10.167 35 HH21 ARG 853 HH21 ARG 853 -2.994 -2.078 -7.506 36 HH22 ARG 853 HH22 ARG 853 -2.655 -0.488 -8.192 37 H ALA 854 HN ALA 854 -3.182 -4.360 -15.067 38 HA ALA 854 HA ALA 854 -1.024 -2.539 -15.681 39 HB1 ALA 854 HB1 ALA 854 -2.761 -3.196 -17.291 40 HB2 ALA 854 HB2 ALA 854 -4.013 -2.449 -16.280 41 HB3 ALA 854 HB3 ALA 854 -2.769 -1.441 -17.061 42 H SER 855 HN SER 855 -1.428 -0.073 -15.610 43 HA SER 855 HA SER 855 -2.956 0.903 -13.285 44 HB2 SER 855 HB1 SER 855 -1.118 2.248 -12.425 45 HB3 SER 855 HB2 SER 855 -0.862 0.526 -12.237 46 HG SER 855 HG1 SER 855 0.607 0.569 -13.951 47 H VAL 856 HN VAL 856 -3.117 3.155 -13.157 48 HA VAL 856 HA VAL 856 -2.756 4.836 -15.541 49 HB VAL 856 HB VAL 856 -5.158 5.456 -15.673 50 HG11 VAL 856 HG11 VAL 856 -4.712 2.546 -16.358 51 HG12 VAL 856 HG12 VAL 856 -5.893 3.665 -17.071 52 HG13 VAL 856 HG13 VAL 856 -4.160 3.941 -17.316 53 HG21 VAL 856 HG21 VAL 856 -6.907 3.997 -14.824 54 HG22 VAL 856 HG22 VAL 856 -5.705 2.955 -14.034 55 HG23 VAL 856 HG23 VAL 856 -5.945 4.629 -13.484 56 H GLY 857 HN GLY 857 -3.588 7.033 -15.191 57 HA2 GLY 857 HA1 GLY 857 -3.619 7.887 -12.321 58 HA3 GLY 857 HA2 GLY 857 -2.786 8.813 -13.584 59 H SER 858 HN SER 858 -5.885 7.222 -13.911 60 HA SER 858 HA SER 858 -7.196 9.496 -15.036 61 HB2 SER 858 HB1 SER 858 -8.392 6.867 -14.084 62 HB3 SER 858 HB2 SER 858 -9.143 8.034 -15.189 63 HG SER 858 HG1 SER 858 -8.162 6.387 -16.381 64 H GLU 859 HN GLU 859 -8.978 10.596 -14.392 65 HA GLU 859 HA GLU 859 -9.429 11.269 -11.617 66 HB2 GLU 859 HB1 GLU 859 -11.083 11.868 -14.116 67 HB3 GLU 859 HB2 GLU 859 -11.336 12.557 -12.525 68 HG2 GLU 859 HG1 GLU 859 -10.214 14.208 -13.725 69 HG3 GLU 859 HG2 GLU 859 -9.048 13.549 -12.586 70 H PHE 860 HN PHE 860 -11.471 11.084 -10.525 71 HA PHE 860 HA PHE 860 -12.434 8.396 -10.336 72 HB2 PHE 860 HB1 PHE 860 -13.588 10.970 -9.194 73 HB3 PHE 860 HB2 PHE 860 -14.024 9.349 -8.690 74 HD1 PHE 860 HD1 PHE 860 -11.917 7.792 -8.006 75 HD2 PHE 860 HD2 PHE 860 -11.995 12.105 -7.871 76 HE1 PHE 860 HE1 PHE 860 -10.104 7.772 -6.315 77 HE2 PHE 860 HE2 PHE 860 -10.169 12.080 -6.189 78 HZ PHE 860 HZ PHE 860 -9.222 9.915 -5.406 79 H THR 861 HN THR 861 -14.063 11.327 -11.582 80 HA THR 861 HA THR 861 -15.757 11.671 -13.057 81 HB THR 861 HB THR 861 -14.808 9.077 -14.169 82 HG1 THR 861 HG1 THR 861 -13.398 10.374 -15.292 83 HG21 THR 861 HG21 THR 861 -16.740 9.629 -15.503 84 HG22 THR 861 HG22 THR 861 -16.292 11.359 -15.530 85 HG23 THR 861 HG23 THR 861 -15.333 10.150 -16.408 86 H GLU 862 HN GLU 862 -17.819 10.579 -14.203 87 HA GLU 862 HA GLU 862 -19.689 9.901 -12.136 88 HB2 GLU 862 HB1 GLU 862 -20.012 11.138 -14.369 89 HB3 GLU 862 HB2 GLU 862 -20.127 9.529 -15.104 90 HG2 GLU 862 HG1 GLU 862 -22.100 9.023 -13.785 91 HG3 GLU 862 HG2 GLU 862 -21.830 10.417 -12.743 92 H SER 863 HN SER 863 -21.227 7.990 -12.441 93 HA SER 863 HA SER 863 -20.265 5.880 -11.175 94 HB2 SER 863 HB1 SER 863 -22.515 5.775 -13.178 95 HB3 SER 863 HB2 SER 863 -22.220 4.609 -11.863 96 HG SER 863 HG1 SER 863 -23.691 6.405 -11.331 97 H ALA 864 HN ALA 864 -19.406 3.907 -11.375 98 HA ALA 864 HA ALA 864 -17.978 3.395 -13.960 99 HB1 ALA 864 HB1 ALA 864 -16.896 5.185 -12.380 100 HB2 ALA 864 HB2 ALA 864 -16.518 3.791 -11.338 101 HB3 ALA 864 HB3 ALA 864 -15.875 3.852 -12.948 102 H TRP 865 HN TRP 865 -16.108 1.643 -13.331 103 HA TRP 865 HA TRP 865 -17.519 -0.641 -11.959 104 HB2 TRP 865 HB1 TRP 865 -15.176 -0.562 -13.844 105 HB3 TRP 865 HB2 TRP 865 -15.794 -2.015 -13.074 106 HD1 TRP 865 HD1 TRP 865 -16.847 0.627 -15.654 107 HE1 TRP 865 HE1 TRP 865 -18.639 -0.338 -17.204 108 HE3 TRP 865 HE3 TRP 865 -17.480 -3.880 -13.363 109 HZ2 TRP 865 HZ2 TRP 865 -20.171 -2.818 -17.406 110 HZ3 TRP 865 HZ3 TRP 865 -19.074 -5.571 -14.282 111 HH2 TRP 865 HH2 TRP 865 -20.424 -5.029 -16.264 112 H VAL 866 HN VAL 866 -16.028 -2.094 -10.790 113 HA VAL 866 HA VAL 866 -13.539 -0.936 -9.729 114 HB VAL 866 HB VAL 866 -15.144 -0.288 -8.067 115 HG11 VAL 866 HG11 VAL 866 -16.849 -2.090 -8.413 116 HG12 VAL 866 HG12 VAL 866 -15.757 -3.243 -7.627 117 HG13 VAL 866 HG13 VAL 866 -16.404 -1.858 -6.724 118 HG21 VAL 866 HG21 VAL 866 -12.825 -1.003 -7.414 119 HG22 VAL 866 HG22 VAL 866 -14.042 -1.101 -6.131 120 HG23 VAL 866 HG23 VAL 866 -13.506 -2.578 -6.946 121 H ARG 867 HN ARG 867 -11.970 -2.455 -9.325 122 HA ARG 867 HA ARG 867 -12.494 -5.272 -10.142 123 HB2 ARG 867 HB1 ARG 867 -10.318 -3.604 -10.714 124 HB3 ARG 867 HB2 ARG 867 -9.736 -4.527 -9.338 125 HG2 ARG 867 HG1 ARG 867 -10.385 -6.647 -10.539 126 HG3 ARG 867 HG2 ARG 867 -10.797 -5.676 -11.941 127 HD2 ARG 867 HD1 ARG 867 -8.693 -6.093 -12.568 128 HD3 ARG 867 HD2 ARG 867 -8.321 -4.690 -11.567 129 HE ARG 867 HE ARG 867 -8.148 -6.759 -9.746 130 HH11 ARG 867 HH11 ARG 867 -6.975 -7.148 -13.040 131 HH12 ARG 867 HH12 ARG 867 -5.636 -8.079 -12.436 132 HH21 ARG 867 HH21 ARG 867 -6.548 -8.233 -9.281 133 HH22 ARG 867 HH22 ARG 867 -5.458 -8.685 -10.575 134 H CYS 868 HN CYS 868 -12.247 -6.965 -8.707 135 HA CYS 868 HA CYS 868 -12.019 -6.512 -5.869 136 HB2 CYS 868 HB1 CYS 868 -13.169 -8.408 -6.924 137 HB3 CYS 868 HB2 CYS 868 -11.630 -8.999 -7.560 138 H ASP 869 HN ASP 869 -10.289 -6.042 -4.746 139 HA ASP 869 HA ASP 869 -7.533 -6.195 -5.713 140 HB2 ASP 869 HB1 ASP 869 -8.845 -5.419 -3.082 141 HB3 ASP 869 HB2 ASP 869 -7.109 -5.467 -3.282 142 H ASP 870 HN ASP 870 -9.531 -8.664 -4.685 143 HA ASP 870 HA ASP 870 -7.272 -10.141 -3.402 144 HB2 ASP 870 HB1 ASP 870 -9.225 -9.720 -1.919 145 HB3 ASP 870 HB2 ASP 870 -10.238 -10.660 -3.016 146 H CYS 871 HN CYS 871 -9.818 -10.243 -5.868 147 HA CYS 871 HA CYS 871 -8.114 -12.200 -7.272 148 HB2 CYS 871 HB1 CYS 871 -9.851 -13.332 -8.278 149 HB3 CYS 871 HB2 CYS 871 -10.172 -13.327 -6.561 150 H PHE 872 HN PHE 872 -10.618 -10.968 -9.003 151 HA PHE 872 HA PHE 872 -9.428 -8.642 -10.278 152 HB2 PHE 872 HB1 PHE 872 -8.972 -9.872 -12.468 153 HB3 PHE 872 HB2 PHE 872 -7.823 -10.025 -11.161 154 HD1 PHE 872 HD1 PHE 872 -10.769 -11.807 -12.722 155 HD2 PHE 872 HD2 PHE 872 -7.107 -12.180 -10.470 156 HE1 PHE 872 HE1 PHE 872 -10.968 -14.277 -12.801 157 HE2 PHE 872 HE2 PHE 872 -7.309 -14.653 -10.558 158 HZ PHE 872 HZ PHE 872 -9.241 -15.706 -11.721 159 H LYS 873 HN LYS 873 -12.050 -10.681 -9.906 160 HA LYS 873 HA LYS 873 -13.799 -10.187 -12.078 161 HB2 LYS 873 HB1 LYS 873 -14.049 -11.621 -9.953 162 HB3 LYS 873 HB2 LYS 873 -14.588 -10.115 -9.190 163 HG2 LYS 873 HG1 LYS 873 -15.963 -10.687 -11.728 164 HG3 LYS 873 HG2 LYS 873 -16.152 -11.963 -10.513 165 HD2 LYS 873 HD1 LYS 873 -16.592 -9.066 -9.848 166 HD3 LYS 873 HD2 LYS 873 -17.908 -10.043 -10.511 167 HE2 LYS 873 HE1 LYS 873 -16.271 -10.918 -8.137 168 HE3 LYS 873 HE2 LYS 873 -17.739 -9.941 -7.925 169 HZ1 LYS 873 HZ1 LYS 873 -18.168 -12.292 -7.663 170 HZ2 LYS 873 HZ2 LYS 873 -18.950 -11.771 -9.037 171 HZ3 LYS 873 HZ3 LYS 873 -17.583 -12.655 -9.139 172 H TRP 874 HN TRP 874 -15.324 -8.647 -12.507 173 HA TRP 874 HA TRP 874 -14.824 -5.965 -11.331 174 HB2 TRP 874 HB1 TRP 874 -15.904 -6.639 -14.093 175 HB3 TRP 874 HB2 TRP 874 -15.579 -5.034 -13.473 176 HD1 TRP 874 HD1 TRP 874 -13.873 -7.875 -15.204 177 HE1 TRP 874 HE1 TRP 874 -11.418 -7.237 -15.736 178 HE3 TRP 874 HE3 TRP 874 -13.554 -3.559 -12.510 179 HZ2 TRP 874 HZ2 TRP 874 -9.586 -5.157 -15.066 180 HZ3 TRP 874 HZ3 TRP 874 -11.420 -2.305 -12.440 181 HH2 TRP 874 HH2 TRP 874 -9.453 -3.034 -13.729 182 H ARG 875 HN ARG 875 -16.553 -4.525 -10.969 183 HA ARG 875 HA ARG 875 -19.357 -5.482 -11.199 184 HB2 ARG 875 HB1 ARG 875 -18.013 -4.606 -8.595 185 HB3 ARG 875 HB2 ARG 875 -19.751 -4.600 -8.819 186 HG2 ARG 875 HG1 ARG 875 -17.939 -7.044 -8.861 187 HG3 ARG 875 HG2 ARG 875 -19.053 -6.581 -7.591 188 HD2 ARG 875 HD1 ARG 875 -19.737 -7.571 -10.357 189 HD3 ARG 875 HD2 ARG 875 -20.051 -8.360 -8.813 190 HE ARG 875 HE ARG 875 -21.501 -6.064 -8.521 191 HH11 ARG 875 HH11 ARG 875 -21.422 -8.316 -11.204 192 HH12 ARG 875 HH12 ARG 875 -23.059 -7.850 -11.698 193 HH21 ARG 875 HH21 ARG 875 -23.666 -5.716 -9.205 194 HH22 ARG 875 HH22 ARG 875 -24.154 -6.473 -10.730 195 H ARG 876 HN ARG 876 -20.720 -3.850 -11.736 196 HA ARG 876 HA ARG 876 -19.686 -1.116 -12.069 197 HB2 ARG 876 HB1 ARG 876 -21.127 -2.175 -13.784 198 HB3 ARG 876 HB2 ARG 876 -22.429 -2.321 -12.604 199 HG2 ARG 876 HG1 ARG 876 -22.909 -0.451 -14.002 200 HG3 ARG 876 HG2 ARG 876 -22.506 0.170 -12.412 201 HD2 ARG 876 HD1 ARG 876 -21.005 1.549 -13.364 202 HD3 ARG 876 HD2 ARG 876 -20.036 0.147 -13.804 203 HE ARG 876 HE ARG 876 -20.577 0.490 -15.990 204 HH11 ARG 876 HH11 ARG 876 -23.078 2.150 -14.169 205 HH12 ARG 876 HH12 ARG 876 -23.805 2.798 -15.615 206 HH21 ARG 876 HH21 ARG 876 -21.567 1.304 -17.749 207 HH22 ARG 876 HH22 ARG 876 -23.015 2.268 -17.591 208 H ILE 877 HN ILE 877 -19.907 0.497 -10.720 209 HA ILE 877 HA ILE 877 -21.836 0.422 -8.446 210 HB ILE 877 HB ILE 877 -20.121 1.143 -6.911 211 HG12 ILE 877 HG11 ILE 877 -18.180 1.065 -9.256 212 HG13 ILE 877 HG12 ILE 877 -18.773 2.492 -8.420 213 HG21 ILE 877 HG21 ILE 877 -18.878 -0.888 -6.660 214 HG22 ILE 877 HG22 ILE 877 -20.427 -1.329 -7.382 215 HG23 ILE 877 HG23 ILE 877 -18.971 -1.231 -8.404 216 HD11 ILE 877 HD1 ILE 877 -16.491 1.924 -7.715 217 HD12 ILE 877 HD2 ILE 877 -17.647 1.910 -6.378 218 HD13 ILE 877 HD3 ILE 877 -17.070 0.387 -7.065 219 HA PRO 878 HA PRO 878 -22.369 4.755 -9.508 220 HB2 PRO 878 HB1 PRO 878 -23.263 5.855 -7.148 221 HB3 PRO 878 HB2 PRO 878 -24.277 4.744 -8.133 222 HG2 PRO 878 HG1 PRO 878 -22.563 4.083 -5.713 223 HG3 PRO 878 HG2 PRO 878 -24.262 3.606 -6.025 224 HD2 PRO 878 HD1 PRO 878 -22.167 1.940 -6.539 225 HD3 PRO 878 HD2 PRO 878 -23.612 1.970 -7.592 226 H ALA 879 HN ALA 879 -21.281 6.632 -9.489 227 HA ALA 879 HA ALA 879 -18.660 6.893 -8.753 228 HB1 ALA 879 HB1 ALA 879 -18.993 9.332 -9.071 229 HB2 ALA 879 HB2 ALA 879 -19.828 8.376 -10.297 230 HB3 ALA 879 HB3 ALA 879 -20.753 9.103 -8.966 231 H SER 880 HN SER 880 -21.378 7.484 -6.559 232 HA SER 880 HA SER 880 -20.145 8.933 -4.469 233 HB2 SER 880 HB1 SER 880 -22.175 6.678 -4.205 234 HB3 SER 880 HB2 SER 880 -21.874 7.986 -3.044 235 HG SER 880 HG1 SER 880 -23.686 8.450 -4.357 236 H VAL 881 HN VAL 881 -19.772 5.551 -5.392 237 HA VAL 881 HA VAL 881 -17.979 5.040 -3.062 238 HB VAL 881 HB VAL 881 -19.115 3.106 -5.119 239 HG11 VAL 881 HG11 VAL 881 -18.343 1.322 -3.580 240 HG12 VAL 881 HG12 VAL 881 -16.986 2.254 -4.207 241 HG13 VAL 881 HG13 VAL 881 -17.567 2.545 -2.551 242 HG21 VAL 881 HG21 VAL 881 -19.894 3.560 -2.209 243 HG22 VAL 881 HG22 VAL 881 -20.893 3.915 -3.637 244 HG23 VAL 881 HG23 VAL 881 -20.493 2.245 -3.245 245 H VAL 882 HN VAL 882 -17.922 5.332 -6.597 246 HA VAL 882 HA VAL 882 -15.313 4.310 -6.948 247 HB VAL 882 HB VAL 882 -15.287 5.125 -9.056 248 HG11 VAL 882 HG11 VAL 882 -18.162 4.781 -8.359 249 HG12 VAL 882 HG12 VAL 882 -17.664 5.129 -9.999 250 HG13 VAL 882 HG13 VAL 882 -17.034 3.697 -9.164 251 HG21 VAL 882 HG21 VAL 882 -16.717 7.617 -8.320 252 HG22 VAL 882 HG22 VAL 882 -15.119 7.365 -9.012 253 HG23 VAL 882 HG23 VAL 882 -16.535 7.070 -10.001 254 H GLY 883 HN GLY 883 -16.323 7.401 -5.834 255 HA2 GLY 883 HA1 GLY 883 -13.768 8.797 -5.993 256 HA3 GLY 883 HA2 GLY 883 -15.199 9.306 -5.097 257 H SER 884 HN SER 884 -15.069 6.525 -3.697 258 HA SER 884 HA SER 884 -13.190 7.287 -1.518 259 HB2 SER 884 HB1 SER 884 -15.517 6.699 -0.959 260 HB3 SER 884 HB2 SER 884 -15.297 5.101 -1.696 261 HG SER 884 HG1 SER 884 -14.994 5.124 0.609 262 H ILE 885 HN ILE 885 -13.809 4.677 -3.853 263 HA ILE 885 HA ILE 885 -11.633 2.969 -3.002 264 HB ILE 885 HB ILE 885 -13.662 3.022 -5.218 265 HG12 ILE 885 HG11 ILE 885 -14.241 0.816 -4.375 266 HG13 ILE 885 HG12 ILE 885 -12.859 0.791 -3.282 267 HG21 ILE 885 HG21 ILE 885 -11.334 1.065 -5.212 268 HG22 ILE 885 HG22 ILE 885 -12.790 1.000 -6.229 269 HG23 ILE 885 HG23 ILE 885 -11.653 2.321 -6.445 270 HD11 ILE 885 HD1 ILE 885 -15.087 2.825 -3.031 271 HD12 ILE 885 HD2 ILE 885 -15.144 1.250 -2.246 272 HD13 ILE 885 HD3 ILE 885 -13.854 2.396 -1.826 273 H ASP 886 HN ASP 886 -9.679 2.595 -3.947 274 HA ASP 886 HA ASP 886 -8.559 4.154 -6.129 275 HB2 ASP 886 HB1 ASP 886 -8.604 5.635 -3.928 276 HB3 ASP 886 HB2 ASP 886 -7.332 4.575 -3.380 277 H GLU 887 HN GLU 887 -6.029 3.757 -6.074 278 HA GLU 887 HA GLU 887 -5.423 0.934 -5.916 279 HB2 GLU 887 HB1 GLU 887 -3.573 3.356 -6.029 280 HB3 GLU 887 HB2 GLU 887 -3.080 1.670 -6.219 281 HG2 GLU 887 HG1 GLU 887 -4.802 1.555 -8.147 282 HG3 GLU 887 HG2 GLU 887 -4.809 3.320 -8.090 283 H SER 888 HN SER 888 -5.409 3.453 -3.475 284 HA SER 888 HA SER 888 -3.759 1.921 -1.564 285 HB2 SER 888 HB1 SER 888 -4.251 3.769 -0.042 286 HB3 SER 888 HB2 SER 888 -3.645 4.367 -1.597 287 HG SER 888 HG1 SER 888 -5.487 5.540 -0.871 288 H SER 889 HN SER 889 -7.014 1.817 -2.583 289 HA SER 889 HA SER 889 -8.199 1.042 -0.004 290 HB2 SER 889 HB1 SER 889 -9.404 2.370 -1.773 291 HB3 SER 889 HB2 SER 889 -9.398 0.912 -2.784 292 HG SER 889 HG1 SER 889 -10.750 1.405 -0.346 293 H ARG 890 HN ARG 890 -9.620 -0.967 -0.111 294 HA ARG 890 HA ARG 890 -8.423 -3.324 -1.460 295 HB2 ARG 890 HB1 ARG 890 -8.887 -3.193 1.543 296 HB3 ARG 890 HB2 ARG 890 -8.551 -4.664 0.618 297 HG2 ARG 890 HG1 ARG 890 -6.373 -3.685 -0.124 298 HG3 ARG 890 HG2 ARG 890 -6.656 -2.291 0.929 299 HD2 ARG 890 HD1 ARG 890 -6.495 -5.190 1.851 300 HD3 ARG 890 HD2 ARG 890 -5.165 -4.020 1.926 301 HE ARG 890 HE ARG 890 -7.308 -2.813 3.274 302 HH11 ARG 890 HH11 ARG 890 -5.338 -5.664 3.781 303 HH12 ARG 890 HH12 ARG 890 -5.560 -5.623 5.509 304 HH21 ARG 890 HH21 ARG 890 -7.558 -2.823 5.483 305 HH22 ARG 890 HH22 ARG 890 -6.782 -4.050 6.440 306 H TRP 891 HN TRP 891 -10.356 -2.556 -2.673 307 HA TRP 891 HA TRP 891 -13.023 -3.199 -1.580 308 HB2 TRP 891 HB1 TRP 891 -12.606 -1.386 -3.249 309 HB3 TRP 891 HB2 TRP 891 -12.305 -2.636 -4.453 310 HD1 TRP 891 HD1 TRP 891 -14.969 -0.754 -2.704 311 HE1 TRP 891 HE1 TRP 891 -17.292 -1.372 -3.536 312 HE3 TRP 891 HE3 TRP 891 -13.749 -4.986 -5.316 313 HZ2 TRP 891 HZ2 TRP 891 -18.531 -3.659 -4.843 314 HZ3 TRP 891 HZ3 TRP 891 -15.556 -6.420 -6.270 315 HH2 TRP 891 HH2 TRP 891 -17.922 -5.773 -5.996 316 H ILE 892 HN ILE 892 -13.897 -5.261 -1.679 317 HA ILE 892 HA ILE 892 -12.854 -7.194 -3.687 318 HB ILE 892 HB ILE 892 -12.649 -8.942 -2.045 319 HG12 ILE 892 HG11 ILE 892 -13.076 -6.939 0.189 320 HG13 ILE 892 HG12 ILE 892 -14.383 -7.938 -0.450 321 HG21 ILE 892 HG21 ILE 892 -10.602 -8.246 -0.913 322 HG22 ILE 892 HG22 ILE 892 -10.644 -7.554 -2.542 323 HG23 ILE 892 HG23 ILE 892 -11.003 -6.543 -1.130 324 HD11 ILE 892 HD1 ILE 892 -13.450 -8.949 1.540 325 HD12 ILE 892 HD2 ILE 892 -13.313 -9.981 0.098 326 HD13 ILE 892 HD3 ILE 892 -11.877 -9.125 0.740 327 H CYS 893 HN CYS 893 -14.171 -9.082 -4.018 328 HA CYS 893 HA CYS 893 -16.850 -8.697 -4.404 329 HB2 CYS 893 HB1 CYS 893 -15.455 -11.330 -3.763 330 HB3 CYS 893 HB2 CYS 893 -17.006 -11.094 -4.593 331 H MET 894 HN MET 894 -15.419 -10.011 -1.312 332 HA MET 894 HA MET 894 -17.993 -10.768 -0.262 333 HB2 MET 894 HB1 MET 894 -15.759 -11.667 0.454 334 HB3 MET 894 HB2 MET 894 -15.454 -10.136 1.271 335 HG2 MET 894 HG1 MET 894 -16.194 -11.861 2.828 336 HG3 MET 894 HG2 MET 894 -17.289 -10.493 2.799 337 HE1 MET 894 HE1 MET 894 -16.696 -14.222 1.683 338 HE2 MET 894 HE2 MET 894 -18.250 -14.655 0.937 339 HE3 MET 894 HE3 MET 894 -17.170 -13.510 0.121 340 H ASN 895 HN ASN 895 -16.477 -7.683 -0.504 341 HA ASN 895 HA ASN 895 -18.230 -6.374 1.486 342 HB2 ASN 895 HB1 ASN 895 -16.462 -5.052 1.704 343 HB3 ASN 895 HB2 ASN 895 -15.605 -5.918 0.442 344 HD21 ASN 895 HD21 ASN 895 -16.249 -5.229 -1.895 345 HD22 ASN 895 HD22 ASN 895 -16.400 -3.487 -2.105 346 H ASN 896 HN ASN 896 -18.426 -7.255 -1.785 347 HA ASN 896 HA ASN 896 -19.460 -5.042 -3.097 348 HB2 ASN 896 HB1 ASN 896 -18.811 -7.165 -4.203 349 HB3 ASN 896 HB2 ASN 896 -20.224 -7.954 -3.494 350 HD21 ASN 896 HD21 ASN 896 -21.626 -8.403 -5.191 351 HD22 ASN 896 HD22 ASN 896 -22.046 -7.211 -6.390 352 H SER 897 HN SER 897 -21.299 -4.012 -3.313 353 HA SER 897 HA SER 897 -23.434 -3.965 -1.525 354 HB2 SER 897 HB1 SER 897 -23.287 -3.236 -4.477 355 HB3 SER 897 HB2 SER 897 -24.650 -2.834 -3.438 356 HG SER 897 HG1 SER 897 -23.116 -1.115 -3.527 357 H ASP 898 HN ASP 898 -23.290 -5.712 -4.591 358 HA ASP 898 HA ASP 898 -26.047 -6.734 -4.282 359 HB2 ASP 898 HB1 ASP 898 -24.200 -7.381 -6.568 360 HB3 ASP 898 HB2 ASP 898 -25.952 -7.409 -6.531 361 H LYS 899 HN LYS 899 -26.193 -8.295 -2.861 362 HA LYS 899 HA LYS 899 -24.330 -10.258 -2.138 363 HB2 LYS 899 HB1 LYS 899 -27.373 -10.385 -1.990 364 HB3 LYS 899 HB2 LYS 899 -26.261 -11.426 -1.107 365 HG2 LYS 899 HG1 LYS 899 -26.058 -8.417 -0.789 366 HG3 LYS 899 HG2 LYS 899 -27.300 -9.315 0.075 367 HD2 LYS 899 HD1 LYS 899 -24.400 -10.167 0.177 368 HD3 LYS 899 HD2 LYS 899 -25.071 -8.941 1.285 369 HE2 LYS 899 HE1 LYS 899 -26.788 -10.557 2.039 370 HE3 LYS 899 HE2 LYS 899 -26.145 -11.776 0.937 371 HZ1 LYS 899 HZ1 LYS 899 -24.646 -10.575 3.211 372 HZ2 LYS 899 HZ2 LYS 899 -25.283 -12.076 3.192 373 HZ3 LYS 899 HZ3 LYS 899 -24.047 -11.706 2.193 374 H ARG 900 HN ARG 900 -26.399 -10.271 -4.893 375 HA ARG 900 HA ARG 900 -26.264 -13.082 -5.639 376 HB2 ARG 900 HB1 ARG 900 -26.811 -10.486 -7.140 377 HB3 ARG 900 HB2 ARG 900 -26.805 -12.059 -7.938 378 HG2 ARG 900 HG1 ARG 900 -28.569 -12.874 -6.401 379 HG3 ARG 900 HG2 ARG 900 -28.604 -11.309 -5.583 380 HD2 ARG 900 HD1 ARG 900 -29.240 -11.780 -8.529 381 HD3 ARG 900 HD2 ARG 900 -30.448 -11.631 -7.261 382 HE ARG 900 HE ARG 900 -28.970 -9.486 -8.559 383 HH11 ARG 900 HH11 ARG 900 -30.774 -10.220 -5.643 384 HH12 ARG 900 HH12 ARG 900 -31.095 -8.540 -5.315 385 HH21 ARG 900 HH21 ARG 900 -29.413 -7.366 -8.072 386 HH22 ARG 900 HH22 ARG 900 -30.343 -6.977 -6.657 387 H PHE 901 HN PHE 901 -24.004 -10.454 -5.960 388 HA PHE 901 HA PHE 901 -22.182 -12.196 -7.538 389 HB2 PHE 901 HB1 PHE 901 -22.334 -9.173 -7.721 390 HB3 PHE 901 HB2 PHE 901 -21.372 -10.242 -8.725 391 HD1 PHE 901 HD1 PHE 901 -24.859 -9.148 -7.964 392 HD2 PHE 901 HD2 PHE 901 -22.272 -11.134 -10.770 393 HE1 PHE 901 HE1 PHE 901 -26.683 -9.165 -9.644 394 HE2 PHE 901 HE2 PHE 901 -24.102 -11.187 -12.432 395 HZ PHE 901 HZ PHE 901 -26.315 -10.202 -11.873 396 H ALA 902 HN ALA 902 -22.468 -11.261 -4.591 397 HA ALA 902 HA ALA 902 -19.916 -10.044 -3.995 398 HB1 ALA 902 HB1 ALA 902 -20.851 -9.846 -1.719 399 HB2 ALA 902 HB2 ALA 902 -22.051 -9.317 -2.902 400 HB3 ALA 902 HB3 ALA 902 -22.185 -10.929 -2.154 401 H ASP 903 HN ASP 903 -19.390 -12.442 -5.098 402 HA ASP 903 HA ASP 903 -17.517 -13.261 -3.024 403 HB2 ASP 903 HB1 ASP 903 -19.565 -15.019 -3.217 404 HB3 ASP 903 HB2 ASP 903 -18.627 -15.605 -4.553 405 H CYS 904 HN CYS 904 -15.583 -14.137 -3.805 406 HA CYS 904 HA CYS 904 -14.670 -13.585 -6.441 407 HB2 CYS 904 HB1 CYS 904 -13.662 -15.518 -4.298 408 HB3 CYS 904 HB2 CYS 904 -12.746 -14.943 -5.691 409 H SER 905 HN SER 905 -16.745 -16.071 -5.251 410 HA SER 905 HA SER 905 -16.152 -17.994 -7.468 411 HB2 SER 905 HB1 SER 905 -17.989 -18.264 -5.068 412 HB3 SER 905 HB2 SER 905 -17.710 -19.482 -6.324 413 HG SER 905 HG1 SER 905 -15.810 -18.438 -4.467 414 H LYS 906 HN LYS 906 -18.301 -15.400 -6.720 415 HA LYS 906 HA LYS 906 -20.566 -16.375 -8.344 416 HB2 LYS 906 HB1 LYS 906 -19.897 -13.729 -7.011 417 HB3 LYS 906 HB2 LYS 906 -21.321 -13.979 -8.016 418 HG2 LYS 906 HG1 LYS 906 -20.788 -15.191 -5.300 419 HG3 LYS 906 HG2 LYS 906 -21.976 -13.983 -5.781 420 HD2 LYS 906 HD1 LYS 906 -23.310 -15.833 -5.621 421 HD3 LYS 906 HD2 LYS 906 -22.925 -15.878 -7.344 422 HE2 LYS 906 HE1 LYS 906 -21.101 -17.554 -6.830 423 HE3 LYS 906 HE2 LYS 906 -21.536 -17.466 -5.122 424 HZ1 LYS 906 HZ1 LYS 906 -23.741 -18.325 -5.701 425 HZ2 LYS 906 HZ2 LYS 906 -23.349 -18.404 -7.286 426 HZ3 LYS 906 HZ3 LYS 906 -22.591 -19.364 -6.207 427 H SER 907 HN SER 907 -21.450 -14.826 -9.944 428 HA SER 907 HA SER 907 -19.498 -14.603 -12.128 429 HB2 SER 907 HB1 SER 907 -21.695 -15.779 -12.326 430 HB3 SER 907 HB2 SER 907 -22.506 -14.207 -12.188 431 HG SER 907 HG1 SER 907 -22.121 -14.951 -14.381 432 H GLN 908 HN GLN 908 -20.708 -12.647 -13.666 433 HA GLN 908 HA GLN 908 -20.787 -10.055 -12.328 434 HB2 GLN 908 HB1 GLN 908 -18.860 -9.093 -13.370 435 HB3 GLN 908 HB2 GLN 908 -18.349 -10.571 -12.556 436 HG2 GLN 908 HG1 GLN 908 -18.738 -11.663 -14.960 437 HG3 GLN 908 HG2 GLN 908 -18.595 -10.007 -15.476 438 HE21 GLN 908 HE21 GLN 908 -16.479 -9.167 -15.678 439 HE22 GLN 908 HE22 GLN 908 -15.041 -10.033 -15.112 440 H GLU 909 HN GLU 909 -21.180 -8.250 -14.050 441 HA GLU 909 HA GLU 909 -23.334 -9.129 -15.758 442 HB2 GLU 909 HB1 GLU 909 -21.843 -6.518 -16.005 443 HB3 GLU 909 HB2 GLU 909 -23.482 -6.851 -16.511 444 HG2 GLU 909 HG1 GLU 909 -22.424 -6.558 -13.681 445 HG3 GLU 909 HG2 GLU 909 -23.463 -5.442 -14.545 446 H MET 910 HN MET 910 -19.900 -8.520 -16.408 447 HA MET 910 HA MET 910 -20.088 -9.843 -19.030 448 HB2 MET 910 HB1 MET 910 -18.988 -7.014 -18.801 449 HB3 MET 910 HB2 MET 910 -18.772 -8.101 -20.178 450 HG2 MET 910 HG1 MET 910 -21.230 -8.084 -20.543 451 HG3 MET 910 HG2 MET 910 -21.405 -6.948 -19.194 452 HE1 MET 910 HE1 MET 910 -22.744 -5.262 -20.694 453 HE2 MET 910 HE2 MET 910 -22.183 -4.680 -22.277 454 HE3 MET 910 HE3 MET 910 -22.612 -6.392 -22.062 455 H SER 911 HN SER 911 -18.318 -11.087 -19.329 456 HA SER 911 HA SER 911 -16.371 -11.368 -17.242 457 HB2 SER 911 HB1 SER 911 -16.052 -12.524 -19.990 458 HB3 SER 911 HB2 SER 911 -15.446 -13.144 -18.461 459 HG SER 911 HG1 SER 911 -17.326 -14.279 -19.181 460 H ASN 912 HN ASN 912 -14.004 -11.405 -17.607 461 HA ASN 912 HA ASN 912 -13.290 -8.701 -17.835 462 HB2 ASN 912 HB1 ASN 912 -11.585 -11.212 -17.598 463 HB3 ASN 912 HB2 ASN 912 -10.924 -9.581 -17.515 464 HD21 ASN 912 HD21 ASN 912 -10.204 -9.638 -15.387 465 HD22 ASN 912 HD22 ASN 912 -11.359 -9.579 -14.056 466 H GLU 913 HN GLU 913 -13.277 -10.970 -20.412 467 HA GLU 913 HA GLU 913 -11.625 -9.238 -22.180 468 HB2 GLU 913 HB1 GLU 913 -11.203 -11.670 -22.030 469 HB3 GLU 913 HB2 GLU 913 -12.821 -11.992 -22.665 470 HG2 GLU 913 HG1 GLU 913 -12.223 -11.063 -24.819 471 HG3 GLU 913 HG2 GLU 913 -10.742 -10.355 -24.159 472 H GLU 914 HN GLU 914 -14.843 -9.357 -21.291 473 HA GLU 914 HA GLU 914 -15.836 -8.219 -23.876 474 HB2 GLU 914 HB1 GLU 914 -17.230 -9.818 -21.697 475 HB3 GLU 914 HB2 GLU 914 -18.104 -8.775 -22.802 476 HG2 GLU 914 HG1 GLU 914 -18.238 -10.935 -23.710 477 HG3 GLU 914 HG2 GLU 914 -17.198 -9.974 -24.750 478 H ILE 915 HN ILE 915 -15.711 -7.633 -20.311 479 HA ILE 915 HA ILE 915 -17.172 -5.121 -20.481 480 HB ILE 915 HB ILE 915 -17.065 -5.973 -18.322 481 HG12 ILE 915 HG11 ILE 915 -15.940 -4.272 -16.968 482 HG13 ILE 915 HG12 ILE 915 -14.934 -3.829 -18.350 483 HG21 ILE 915 HG21 ILE 915 -15.295 -7.517 -18.250 484 HG22 ILE 915 HG22 ILE 915 -14.045 -6.278 -18.516 485 HG23 ILE 915 HG23 ILE 915 -14.983 -6.354 -17.007 486 HD11 ILE 915 HD1 ILE 915 -16.789 -2.869 -19.512 487 HD12 ILE 915 HD2 ILE 915 -17.939 -3.556 -18.369 488 HD13 ILE 915 HD3 ILE 915 -16.790 -2.262 -17.882 489 H ASN 916 HN ASN 916 -13.655 -5.725 -20.388 490 HA ASN 916 HA ASN 916 -12.773 -3.102 -20.738 491 HB2 ASN 916 HB1 ASN 916 -10.666 -4.097 -21.492 492 HB3 ASN 916 HB2 ASN 916 -11.326 -5.032 -20.163 493 HD21 ASN 916 HD21 ASN 916 -9.351 -6.092 -22.011 494 HD22 ASN 916 HD22 ASN 916 -10.165 -7.335 -22.944 495 H GLU 917 HN GLU 917 -13.938 -5.261 -23.285 496 HA GLU 917 HA GLU 917 -13.377 -3.649 -25.579 497 HB2 GLU 917 HB1 GLU 917 -15.193 -5.895 -24.852 498 HB3 GLU 917 HB2 GLU 917 -15.612 -4.949 -26.278 499 HG2 GLU 917 HG1 GLU 917 -13.257 -5.313 -27.116 500 HG3 GLU 917 HG2 GLU 917 -12.982 -6.401 -25.754 501 H GLU 918 HN GLU 918 -16.041 -3.450 -23.229 502 HA GLU 918 HA GLU 918 -17.698 -1.630 -24.739 503 HB2 GLU 918 HB1 GLU 918 -18.315 -3.053 -22.628 504 HB3 GLU 918 HB2 GLU 918 -17.530 -1.769 -21.709 505 HG2 GLU 918 HG1 GLU 918 -19.731 -1.164 -21.610 506 HG3 GLU 918 HG2 GLU 918 -19.136 -0.132 -22.899 507 H LEU 919 HN LEU 919 -15.035 -1.153 -22.404 508 HA LEU 919 HA LEU 919 -15.086 1.774 -22.620 509 HB2 LEU 919 HB1 LEU 919 -13.101 -0.212 -21.457 510 HB3 LEU 919 HB2 LEU 919 -12.920 1.534 -21.362 511 HG LEU 919 HG LEU 919 -15.561 0.916 -20.434 512 HD11 LEU 919 HD11 LEU 919 -14.906 -1.365 -20.055 513 HD12 LEU 919 HD12 LEU 919 -13.408 -0.853 -19.251 514 HD13 LEU 919 HD13 LEU 919 -15.004 -0.551 -18.483 515 HD21 LEU 919 HD21 LEU 919 -14.673 1.791 -18.298 516 HD22 LEU 919 HD22 LEU 919 -13.014 1.686 -18.958 517 HD23 LEU 919 HD23 LEU 919 -14.184 2.797 -19.686 518 H GLY 920 HN GLY 920 -13.601 -0.865 -24.301 519 HA2 GLY 920 HA1 GLY 920 -12.836 -0.819 -26.530 520 HA3 GLY 920 HA2 GLY 920 -12.637 0.931 -26.454 521 H ILE 921 HN ILE 921 -11.303 -1.476 -24.192 522 HA ILE 921 HA ILE 921 -8.498 -0.741 -24.910 523 HB ILE 921 HB ILE 921 -8.066 -0.295 -22.505 524 HG12 ILE 921 HG11 ILE 921 -11.091 -0.405 -22.221 525 HG13 ILE 921 HG12 ILE 921 -9.970 -1.607 -21.586 526 HG21 ILE 921 HG21 ILE 921 -8.541 1.524 -24.181 527 HG22 ILE 921 HG22 ILE 921 -10.211 1.570 -23.578 528 HG23 ILE 921 HG23 ILE 921 -8.856 1.961 -22.503 529 HD11 ILE 921 HD1 ILE 921 -10.113 1.303 -20.713 530 HD12 ILE 921 HD2 ILE 921 -10.739 -0.093 -19.842 531 HD13 ILE 921 HD3 ILE 921 -8.977 0.067 -20.097 532 H GLY 922 HN GLY 922 -6.922 -1.932 -23.444 533 HA2 GLY 922 HA1 GLY 922 -7.355 -4.810 -23.859 534 HA3 GLY 922 HA2 GLY 922 -5.867 -4.016 -23.342 535 H GLN 923 HN GLN 923 -6.643 -2.716 -21.045 536 HA GLN 923 HA GLN 923 -6.946 -2.880 -18.864 537 HB2 GLN 923 HB1 GLN 923 -9.288 -3.244 -19.737 538 HB3 GLN 923 HB2 GLN 923 -9.087 -4.944 -19.334 539 HG2 GLN 923 HG1 GLN 923 -9.799 -4.517 -17.303 540 HG3 GLN 923 HG2 GLN 923 -8.258 -3.703 -17.002 541 HE21 GLN 923 HE21 GLN 923 -8.915 -1.914 -15.754 542 HE22 GLN 923 HE22 GLN 923 -10.116 -0.767 -16.352 543 H ASP 924 HN ASP 924 -7.523 -6.085 -19.560 544 HA ASP 924 HA ASP 924 -5.858 -7.167 -17.304 545 HB2 ASP 924 HB1 ASP 924 -7.816 -5.973 -16.422 546 HB3 ASP 924 HB2 ASP 924 -8.896 -6.907 -17.448 547 H GLU 925 HN GLU 925 -8.471 -7.930 -19.631 548 HA GLU 925 HA GLU 925 -9.107 -9.674 -20.827 549 HB2 GLU 925 HB1 GLU 925 -6.640 -9.494 -21.512 550 HB3 GLU 925 HB2 GLU 925 -6.376 -10.940 -20.544 551 HG2 GLU 925 HG1 GLU 925 -8.132 -12.130 -21.859 552 HG3 GLU 925 HG2 GLU 925 -8.347 -10.680 -22.844 553 H ALA 926 HN ALA 926 -7.171 -10.926 -18.162 554 HA ALA 926 HA ALA 926 -9.392 -12.523 -17.103 555 HB1 ALA 926 HB1 ALA 926 -8.177 -14.671 -17.173 556 HB2 ALA 926 HB2 ALA 926 -8.488 -14.067 -18.811 557 HB3 ALA 926 HB3 ALA 926 -6.863 -13.909 -18.099 558 H ASP 927 HN ASP 927 -5.866 -11.968 -16.894 559 HA ASP 927 HA ASP 927 -4.381 -11.990 -15.242 560 HB2 ASP 927 HB1 ASP 927 -5.735 -9.908 -14.704 561 HB3 ASP 927 HB2 ASP 927 -6.485 -10.828 -13.402 562 H ALA 928 HN ALA 928 -6.473 -14.287 -15.332 563 HA ALA 928 HA ALA 928 -6.364 -15.595 -12.776 564 HB1 ALA 928 HB1 ALA 928 -6.911 -16.697 -15.565 565 HB2 ALA 928 HB2 ALA 928 -7.265 -17.514 -14.029 566 HB3 ALA 928 HB3 ALA 928 -8.120 -16.017 -14.448 567 H1 ALA 1 HT1 ALA 1 -9.331 -0.537 -5.994 568 H2 ALA 1 HT2 ALA 1 -7.804 -0.176 -5.535 569 H3 ALA 1 HT3 ALA 1 -8.370 -1.713 -5.365 570 HA ALA 1 HA ALA 1 -6.915 -1.664 -7.232 571 HB1 ALA 1 HB1 ALA 1 -8.899 -3.172 -7.330 572 HB2 ALA 1 HB2 ALA 1 -9.837 -1.879 -8.103 573 HB3 ALA 1 HB3 ALA 1 -8.432 -2.585 -8.932 574 H ARG 2 HN ARG 2 -6.577 -0.966 -9.512 575 HA ARG 2 HA ARG 2 -6.639 1.881 -9.867 576 HB2 ARG 2 HB1 ARG 2 -5.805 1.437 -12.125 577 HB3 ARG 2 HB2 ARG 2 -4.909 0.587 -10.897 578 HG2 ARG 2 HG1 ARG 2 -5.284 -1.424 -11.809 579 HG3 ARG 2 HG2 ARG 2 -6.994 -1.200 -11.994 580 HD2 ARG 2 HD1 ARG 2 -4.850 -0.167 -13.890 581 HD3 ARG 2 HD2 ARG 2 -5.862 -1.595 -14.136 582 HE ARG 2 HE ARG 2 -7.559 0.700 -13.790 583 HH11 ARG 2 HH11 ARG 2 -5.382 -0.602 -16.214 584 HH12 ARG 2 HH12 ARG 2 -6.144 0.300 -17.492 585 HH21 ARG 2 HH21 ARG 2 -8.445 1.810 -15.429 586 HH22 ARG 2 HH22 ARG 2 -7.849 1.628 -17.066 587 H THR 3 HN THR 3 -8.582 -0.598 -11.385 588 HA THR 3 HA THR 3 -10.265 -0.630 -12.841 589 HB THR 3 HB THR 3 -11.201 -0.549 -10.535 590 HG1 THR 3 HG1 THR 3 -12.693 -1.073 -11.985 591 HG21 THR 3 HG21 THR 3 -12.582 1.363 -9.829 592 HG22 THR 3 HG22 THR 3 -10.865 1.766 -9.835 593 HG23 THR 3 HG23 THR 3 -11.922 2.350 -11.141 594 H MLZ 4 HN MLZ 4 -12.438 1.278 -13.252 595 HA MLZ 4 HA MLZ 4 -11.529 3.377 -15.037 596 HB2 MLZ 4 HB1 MLZ 4 -11.760 2.184 -17.106 597 HB3 MLZ 4 HB2 MLZ 4 -10.716 1.187 -16.138 598 HG2 MLZ 4 HG1 MLZ 4 -13.690 0.746 -16.634 599 HG3 MLZ 4 HG2 MLZ 4 -12.350 -0.086 -17.402 600 HD2 MLZ 4 HD1 MLZ 4 -11.783 -1.118 -15.179 601 HD3 MLZ 4 HD2 MLZ 4 -13.158 -0.286 -14.490 602 HE2 MLZ 4 HE1 MLZ 4 -13.754 -2.602 -14.985 603 HE3 MLZ 4 HE2 MLZ 4 -14.726 -1.481 -15.927 604 HZ MLZ 4 HZ1 MLZ 4 -12.485 -2.040 -17.520 605 HCM1 MLZ 4 HC1 MLZ 4 -12.496 -4.447 -17.657 606 HCM2 MLZ 4 HC2 MLZ 4 -11.971 -3.861 -16.071 607 HCM3 MLZ 4 HC3 MLZ 4 -13.614 -4.491 -16.274 608 HZ2 MLZ 4 HZ2 MLZ 4 -14.008 -2.556 -17.762 609 H GLN 5 HN GLN 5 -13.521 3.815 -16.720 610 HA GLN 5 HA GLN 5 -16.111 3.142 -15.541 611 HB2 GLN 5 HB1 GLN 5 -16.870 5.184 -15.028 612 HB3 GLN 5 HB2 GLN 5 -15.199 5.282 -14.504 613 HG2 GLN 5 HG1 GLN 5 -15.419 7.324 -15.413 614 HG3 GLN 5 HG2 GLN 5 -14.783 6.480 -16.813 615 HE21 GLN 5 HE21 GLN 5 -18.112 6.905 -15.303 616 HE22 GLN 5 HE22 GLN 5 -18.851 7.369 -16.833 617 H THR 6 HN THR 6 -17.434 2.504 -17.009 618 HA THR 6 HA THR 6 -17.033 2.766 -19.851 619 HB THR 6 HB THR 6 -19.528 1.980 -19.865 620 HG1 THR 6 HG1 THR 6 -19.739 2.490 -17.581 621 HG21 THR 6 HG21 THR 6 -18.861 -0.361 -19.340 622 HG22 THR 6 HG22 THR 6 -17.775 0.459 -20.466 623 HG23 THR 6 HG23 THR 6 -17.290 0.252 -18.765 624 H ALA 7 HN ALA 7 -17.584 4.298 -21.207 625 HA ALA 7 HA ALA 7 -18.985 6.698 -20.313 626 HB1 ALA 7 HB1 ALA 7 -17.772 5.932 -23.005 627 HB2 ALA 7 HB2 ALA 7 -18.283 7.558 -22.507 628 HB3 ALA 7 HB3 ALA 7 -16.930 6.770 -21.678 629 H ARG 8 HN ARG 8 -20.036 3.804 -21.814 630 HA ARG 8 HA ARG 8 -22.191 4.960 -23.431 631 HB2 ARG 8 HB1 ARG 8 -21.693 2.019 -22.807 632 HB3 ARG 8 HB2 ARG 8 -22.649 2.702 -24.129 633 HG2 ARG 8 HG1 ARG 8 -20.475 3.714 -25.032 634 HG3 ARG 8 HG2 ARG 8 -19.627 2.779 -23.784 635 HD2 ARG 8 HD1 ARG 8 -20.970 0.742 -24.774 636 HD3 ARG 8 HD2 ARG 8 -21.178 1.792 -26.181 637 HE ARG 8 HE ARG 8 -18.433 1.327 -25.075 638 HH11 ARG 8 HH11 ARG 8 -20.613 0.578 -27.726 639 HH12 ARG 8 HH12 ARG 8 -19.324 -0.111 -28.675 640 HH21 ARG 8 HH21 ARG 8 -16.921 0.433 -26.259 641 HH22 ARG 8 HH22 ARG 8 -17.253 -0.200 -27.854 642 H TYR 9 HN TYR 9 -22.745 6.019 -21.259 643 HA TYR 9 HA TYR 9 -25.062 4.656 -20.002 644 HB2 TYR 9 HB1 TYR 9 -22.974 3.963 -18.806 645 HB3 TYR 9 HB2 TYR 9 -22.659 5.642 -18.420 646 HD1 TYR 9 HD1 TYR 9 -25.425 3.084 -18.135 647 HD2 TYR 9 HD2 TYR 9 -23.361 6.403 -16.302 648 HE1 TYR 9 HE1 TYR 9 -26.785 2.794 -16.061 649 HE2 TYR 9 HE2 TYR 9 -24.736 6.125 -14.247 650 HH TYR 9 HH TYR 9 -26.434 4.961 -13.231 Start of MODEL 10 1 H1 GLY 850 HT1 GLY 850 4.976 -7.563 -8.783 2 H2 GLY 850 HT2 GLY 850 5.574 -8.930 -9.456 3 H3 GLY 850 HT3 GLY 850 4.486 -9.028 -8.235 4 HA2 GLY 850 HA1 GLY 850 3.417 -9.529 -10.332 5 HA3 GLY 850 HA2 GLY 850 2.757 -8.060 -9.588 6 H SER 851 HN SER 851 2.571 -8.672 -12.353 7 HA SER 851 HA SER 851 3.806 -6.287 -13.551 8 HB2 SER 851 HB1 SER 851 4.844 -7.512 -15.395 9 HB3 SER 851 HB2 SER 851 5.550 -8.006 -13.852 10 HG SER 851 HG1 SER 851 5.072 -9.808 -15.185 11 H ARG 852 HN ARG 852 3.035 -5.926 -15.752 12 HA ARG 852 HA ARG 852 1.472 -5.522 -17.299 13 HB2 ARG 852 HB1 ARG 852 2.151 -7.694 -18.000 14 HB3 ARG 852 HB2 ARG 852 1.061 -8.487 -16.892 15 HG2 ARG 852 HG1 ARG 852 0.238 -8.682 -19.150 16 HG3 ARG 852 HG2 ARG 852 -0.888 -7.725 -18.199 17 HD2 ARG 852 HD1 ARG 852 0.222 -5.632 -19.199 18 HD3 ARG 852 HD2 ARG 852 1.159 -6.714 -20.217 19 HE ARG 852 HE ARG 852 -0.761 -7.236 -21.473 20 HH11 ARG 852 HH11 ARG 852 -1.827 -5.271 -18.730 21 HH12 ARG 852 HH12 ARG 852 -3.251 -4.740 -19.622 22 HH21 ARG 852 HH21 ARG 852 -2.681 -6.573 -22.410 23 HH22 ARG 852 HH22 ARG 852 -3.724 -5.479 -21.524 24 H ARG 853 HN ARG 853 0.133 -6.318 -14.261 25 HA ARG 853 HA ARG 853 -2.652 -5.921 -14.793 26 HB2 ARG 853 HB1 ARG 853 -1.105 -5.066 -12.299 27 HB3 ARG 853 HB2 ARG 853 -2.834 -5.264 -12.428 28 HG2 ARG 853 HG1 ARG 853 -0.704 -7.359 -12.178 29 HG3 ARG 853 HG2 ARG 853 -2.191 -7.129 -11.274 30 HD2 ARG 853 HD1 ARG 853 -2.865 -8.931 -12.455 31 HD3 ARG 853 HD2 ARG 853 -3.305 -7.713 -13.650 32 HE ARG 853 HE ARG 853 -0.570 -8.927 -13.735 33 HH11 ARG 853 HH11 ARG 853 -3.642 -8.558 -15.493 34 HH12 ARG 853 HH12 ARG 853 -2.930 -9.465 -16.837 35 HH21 ARG 853 HH21 ARG 853 0.030 -10.140 -15.495 36 HH22 ARG 853 HH22 ARG 853 -1.099 -10.289 -16.843 37 H ALA 854 HN ALA 854 -0.105 -3.583 -14.390 38 HA ALA 854 HA ALA 854 0.071 -1.336 -14.442 39 HB1 ALA 854 HB1 ALA 854 -1.309 -0.015 -15.911 40 HB2 ALA 854 HB2 ALA 854 -0.972 -1.569 -16.686 41 HB3 ALA 854 HB3 ALA 854 -2.564 -1.266 -15.955 42 H SER 855 HN SER 855 -1.316 0.832 -13.875 43 HA SER 855 HA SER 855 -3.200 0.369 -11.674 44 HB2 SER 855 HB1 SER 855 -1.915 1.610 -10.023 45 HB3 SER 855 HB2 SER 855 -1.154 0.100 -10.480 46 HG SER 855 HG1 SER 855 0.342 1.243 -11.723 47 H VAL 856 HN VAL 856 -4.022 2.213 -10.721 48 HA VAL 856 HA VAL 856 -3.715 4.868 -11.744 49 HB VAL 856 HB VAL 856 -5.084 3.973 -13.592 50 HG11 VAL 856 HG11 VAL 856 -7.207 3.454 -11.476 51 HG12 VAL 856 HG12 VAL 856 -7.476 3.435 -13.233 52 HG13 VAL 856 HG13 VAL 856 -6.381 2.254 -12.518 53 HG21 VAL 856 HG21 VAL 856 -6.766 5.917 -11.980 54 HG22 VAL 856 HG22 VAL 856 -5.298 6.367 -12.895 55 HG23 VAL 856 HG23 VAL 856 -6.704 5.699 -13.731 56 H GLY 857 HN GLY 857 -5.066 6.388 -10.526 57 HA2 GLY 857 HA1 GLY 857 -5.241 5.650 -7.710 58 HA3 GLY 857 HA2 GLY 857 -5.474 7.242 -8.411 59 H SER 858 HN SER 858 -7.419 8.003 -7.993 60 HA SER 858 HA SER 858 -9.868 6.500 -8.584 61 HB2 SER 858 HB1 SER 858 -9.321 7.595 -5.798 62 HB3 SER 858 HB2 SER 858 -10.915 7.120 -6.407 63 HG SER 858 HG1 SER 858 -10.250 5.384 -5.438 64 H GLU 859 HN GLU 859 -11.700 7.807 -8.809 65 HA GLU 859 HA GLU 859 -11.732 10.684 -8.500 66 HB2 GLU 859 HB1 GLU 859 -11.906 11.281 -10.834 67 HB3 GLU 859 HB2 GLU 859 -10.372 10.452 -10.573 68 HG2 GLU 859 HG1 GLU 859 -11.521 8.322 -11.398 69 HG3 GLU 859 HG2 GLU 859 -12.862 9.347 -11.914 70 H PHE 860 HN PHE 860 -13.936 11.499 -9.545 71 HA PHE 860 HA PHE 860 -16.015 9.442 -8.976 72 HB2 PHE 860 HB1 PHE 860 -16.173 12.452 -9.121 73 HB3 PHE 860 HB2 PHE 860 -17.580 11.398 -9.041 74 HD1 PHE 860 HD1 PHE 860 -18.188 10.197 -7.023 75 HD2 PHE 860 HD2 PHE 860 -14.609 12.600 -7.155 76 HE1 PHE 860 HE1 PHE 860 -18.003 10.060 -4.548 77 HE2 PHE 860 HE2 PHE 860 -14.423 12.451 -4.682 78 HZ PHE 860 HZ PHE 860 -16.119 11.185 -3.376 79 H THR 861 HN THR 861 -16.322 12.118 -11.318 80 HA THR 861 HA THR 861 -17.334 12.139 -13.393 81 HB THR 861 HB THR 861 -16.215 9.492 -14.084 82 HG1 THR 861 HG1 THR 861 -14.772 11.929 -13.891 83 HG21 THR 861 HG21 THR 861 -15.719 10.626 -16.238 84 HG22 THR 861 HG22 THR 861 -17.440 10.738 -15.883 85 HG23 THR 861 HG23 THR 861 -16.397 12.138 -15.602 86 H GLU 862 HN GLU 862 -18.309 9.677 -14.813 87 HA GLU 862 HA GLU 862 -20.820 9.234 -13.251 88 HB2 GLU 862 HB1 GLU 862 -20.263 9.064 -16.224 89 HB3 GLU 862 HB2 GLU 862 -21.777 8.562 -15.455 90 HG2 GLU 862 HG1 GLU 862 -22.057 10.868 -14.546 91 HG3 GLU 862 HG2 GLU 862 -20.577 11.365 -15.364 92 H SER 863 HN SER 863 -21.861 7.002 -14.022 93 HA SER 863 HA SER 863 -20.782 5.221 -12.276 94 HB2 SER 863 HB1 SER 863 -22.320 3.532 -13.203 95 HB3 SER 863 HB2 SER 863 -23.069 5.119 -12.971 96 HG SER 863 HG1 SER 863 -23.671 4.417 -14.978 97 H ALA 864 HN ALA 864 -19.737 3.278 -12.194 98 HA ALA 864 HA ALA 864 -17.696 2.903 -14.333 99 HB1 ALA 864 HB1 ALA 864 -15.982 3.378 -12.599 100 HB2 ALA 864 HB2 ALA 864 -17.087 4.754 -12.771 101 HB3 ALA 864 HB3 ALA 864 -17.265 3.635 -11.402 102 H TRP 865 HN TRP 865 -15.936 1.303 -13.385 103 HA TRP 865 HA TRP 865 -17.296 -0.999 -12.032 104 HB2 TRP 865 HB1 TRP 865 -14.962 -0.961 -13.937 105 HB3 TRP 865 HB2 TRP 865 -15.622 -2.385 -13.154 106 HD1 TRP 865 HD1 TRP 865 -16.746 0.324 -15.660 107 HE1 TRP 865 HE1 TRP 865 -18.657 -0.542 -17.087 108 HE3 TRP 865 HE3 TRP 865 -17.228 -4.233 -13.458 109 HZ2 TRP 865 HZ2 TRP 865 -20.361 -2.990 -17.121 110 HZ3 TRP 865 HZ3 TRP 865 -18.951 -5.866 -14.242 111 HH2 TRP 865 HH2 TRP 865 -20.511 -5.245 -16.046 112 H VAL 866 HN VAL 866 -15.833 -2.378 -10.820 113 HA VAL 866 HA VAL 866 -13.335 -1.181 -9.827 114 HB VAL 866 HB VAL 866 -14.914 -0.370 -8.194 115 HG11 VAL 866 HG11 VAL 866 -16.196 -1.817 -6.742 116 HG12 VAL 866 HG12 VAL 866 -16.650 -2.167 -8.410 117 HG13 VAL 866 HG13 VAL 866 -15.573 -3.275 -7.548 118 HG21 VAL 866 HG21 VAL 866 -12.630 -0.991 -7.472 119 HG22 VAL 866 HG22 VAL 866 -13.850 -1.074 -6.194 120 HG23 VAL 866 HG23 VAL 866 -13.263 -2.571 -6.938 121 H ARG 867 HN ARG 867 -11.796 -2.661 -9.265 122 HA ARG 867 HA ARG 867 -12.253 -5.479 -10.078 123 HB2 ARG 867 HB1 ARG 867 -10.192 -3.776 -10.596 124 HB3 ARG 867 HB2 ARG 867 -9.630 -4.453 -9.096 125 HG2 ARG 867 HG1 ARG 867 -9.764 -6.756 -10.133 126 HG3 ARG 867 HG2 ARG 867 -10.300 -6.023 -11.646 127 HD2 ARG 867 HD1 ARG 867 -8.105 -6.144 -12.124 128 HD3 ARG 867 HD2 ARG 867 -8.078 -4.548 -11.386 129 HE ARG 867 HE ARG 867 -6.903 -7.063 -10.401 130 HH11 ARG 867 HH11 ARG 867 -7.743 -3.772 -9.343 131 HH12 ARG 867 HH12 ARG 867 -6.931 -4.055 -7.807 132 HH21 ARG 867 HH21 ARG 867 -5.820 -7.148 -8.406 133 HH22 ARG 867 HH22 ARG 867 -5.889 -5.725 -7.376 134 H CYS 868 HN CYS 868 -12.192 -7.179 -8.576 135 HA CYS 868 HA CYS 868 -11.944 -6.623 -5.715 136 HB2 CYS 868 HB1 CYS 868 -13.386 -8.425 -6.425 137 HB3 CYS 868 HB2 CYS 868 -12.061 -9.197 -7.304 138 H ASP 869 HN ASP 869 -10.014 -5.991 -4.896 139 HA ASP 869 HA ASP 869 -7.448 -6.697 -6.035 140 HB2 ASP 869 HB1 ASP 869 -8.409 -5.473 -3.458 141 HB3 ASP 869 HB2 ASP 869 -6.791 -6.119 -3.475 142 H ASP 870 HN ASP 870 -9.574 -8.661 -4.198 143 HA ASP 870 HA ASP 870 -7.369 -10.436 -3.320 144 HB2 ASP 870 HB1 ASP 870 -10.274 -10.226 -2.572 145 HB3 ASP 870 HB2 ASP 870 -9.447 -11.747 -2.366 146 H CYS 871 HN CYS 871 -9.604 -10.116 -5.907 147 HA CYS 871 HA CYS 871 -8.732 -12.742 -7.035 148 HB2 CYS 871 HB1 CYS 871 -11.313 -11.189 -7.572 149 HB3 CYS 871 HB2 CYS 871 -10.759 -12.612 -8.477 150 H PHE 872 HN PHE 872 -10.303 -10.384 -8.779 151 HA PHE 872 HA PHE 872 -8.650 -8.795 -10.253 152 HB2 PHE 872 HB1 PHE 872 -8.155 -10.009 -12.288 153 HB3 PHE 872 HB2 PHE 872 -7.311 -10.744 -10.956 154 HD1 PHE 872 HD1 PHE 872 -7.992 -13.034 -10.142 155 HD2 PHE 872 HD2 PHE 872 -9.933 -11.168 -13.513 156 HE1 PHE 872 HE1 PHE 872 -9.033 -15.202 -10.745 157 HE2 PHE 872 HE2 PHE 872 -10.964 -13.342 -14.118 158 HZ PHE 872 HZ PHE 872 -10.524 -15.360 -12.731 159 H LYS 873 HN LYS 873 -11.373 -10.935 -10.065 160 HA LYS 873 HA LYS 873 -13.151 -10.429 -12.053 161 HB2 LYS 873 HB1 LYS 873 -13.296 -11.712 -9.814 162 HB3 LYS 873 HB2 LYS 873 -14.066 -10.224 -9.209 163 HG2 LYS 873 HG1 LYS 873 -15.871 -10.433 -10.808 164 HG3 LYS 873 HG2 LYS 873 -14.924 -11.571 -11.800 165 HD2 LYS 873 HD1 LYS 873 -16.534 -12.872 -10.716 166 HD3 LYS 873 HD2 LYS 873 -14.938 -13.198 -10.029 167 HE2 LYS 873 HE1 LYS 873 -15.734 -11.271 -8.297 168 HE3 LYS 873 HE2 LYS 873 -17.339 -11.791 -8.817 169 HZ1 LYS 873 HZ1 LYS 873 -16.661 -14.075 -8.183 170 HZ2 LYS 873 HZ2 LYS 873 -15.240 -13.502 -7.596 171 HZ3 LYS 873 HZ3 LYS 873 -16.648 -13.054 -6.886 172 H TRP 874 HN TRP 874 -14.868 -8.930 -12.414 173 HA TRP 874 HA TRP 874 -14.395 -6.176 -11.367 174 HB2 TRP 874 HB1 TRP 874 -15.586 -7.001 -14.037 175 HB3 TRP 874 HB2 TRP 874 -15.180 -5.377 -13.518 176 HD1 TRP 874 HD1 TRP 874 -13.474 -8.542 -14.915 177 HE1 TRP 874 HE1 TRP 874 -11.009 -8.074 -15.296 178 HE3 TRP 874 HE3 TRP 874 -13.079 -3.918 -12.702 179 HZ2 TRP 874 HZ2 TRP 874 -9.148 -6.105 -14.854 180 HZ3 TRP 874 HZ3 TRP 874 -10.807 -2.911 -12.537 181 HH2 TRP 874 HH2 TRP 874 -8.871 -3.868 -13.657 182 H ARG 875 HN ARG 875 -16.197 -4.793 -10.975 183 HA ARG 875 HA ARG 875 -18.923 -5.932 -11.147 184 HB2 ARG 875 HB1 ARG 875 -17.551 -5.098 -8.567 185 HB3 ARG 875 HB2 ARG 875 -19.285 -4.911 -8.736 186 HG2 ARG 875 HG1 ARG 875 -17.735 -7.527 -8.882 187 HG3 ARG 875 HG2 ARG 875 -18.810 -7.000 -7.607 188 HD2 ARG 875 HD1 ARG 875 -19.592 -7.828 -10.398 189 HD3 ARG 875 HD2 ARG 875 -19.975 -8.617 -8.871 190 HE ARG 875 HE ARG 875 -21.105 -6.084 -8.598 191 HH11 ARG 875 HH11 ARG 875 -21.636 -8.728 -10.824 192 HH12 ARG 875 HH12 ARG 875 -23.178 -8.050 -11.326 193 HH21 ARG 875 HH21 ARG 875 -23.244 -5.497 -9.198 194 HH22 ARG 875 HH22 ARG 875 -23.944 -6.362 -10.570 195 H ARG 876 HN ARG 876 -20.487 -4.557 -11.475 196 HA ARG 876 HA ARG 876 -19.847 -1.855 -12.415 197 HB2 ARG 876 HB1 ARG 876 -21.414 -3.742 -13.412 198 HB3 ARG 876 HB2 ARG 876 -22.613 -3.123 -12.280 199 HG2 ARG 876 HG1 ARG 876 -21.202 -1.693 -14.549 200 HG3 ARG 876 HG2 ARG 876 -22.885 -2.203 -14.515 201 HD2 ARG 876 HD1 ARG 876 -23.392 -0.534 -12.769 202 HD3 ARG 876 HD2 ARG 876 -21.684 -0.048 -12.735 203 HE ARG 876 HE ARG 876 -23.657 0.621 -14.798 204 HH11 ARG 876 HH11 ARG 876 -20.216 0.601 -14.006 205 HH12 ARG 876 HH12 ARG 876 -19.806 1.252 -15.578 206 HH21 ARG 876 HH21 ARG 876 -22.971 1.590 -16.721 207 HH22 ARG 876 HH22 ARG 876 -21.272 1.827 -16.994 208 H ILE 877 HN ILE 877 -19.901 -0.099 -11.196 209 HA ILE 877 HA ILE 877 -21.730 0.052 -8.834 210 HB ILE 877 HB ILE 877 -19.964 1.104 -7.542 211 HG12 ILE 877 HG11 ILE 877 -18.179 0.661 -9.968 212 HG13 ILE 877 HG12 ILE 877 -18.715 2.215 -9.356 213 HG21 ILE 877 HG21 ILE 877 -18.696 -0.866 -7.032 214 HG22 ILE 877 HG22 ILE 877 -20.267 -1.418 -7.608 215 HG23 ILE 877 HG23 ILE 877 -18.866 -1.471 -8.703 216 HD11 ILE 877 HD1 ILE 877 -17.431 2.014 -7.350 217 HD12 ILE 877 HD2 ILE 877 -16.981 0.343 -7.719 218 HD13 ILE 877 HD3 ILE 877 -16.387 1.651 -8.735 219 HA PRO 878 HA PRO 878 -22.407 4.337 -10.189 220 HB2 PRO 878 HB1 PRO 878 -23.077 5.561 -7.847 221 HB3 PRO 878 HB2 PRO 878 -24.186 4.436 -8.689 222 HG2 PRO 878 HG1 PRO 878 -22.310 3.819 -6.387 223 HG3 PRO 878 HG2 PRO 878 -24.049 3.414 -6.528 224 HD2 PRO 878 HD1 PRO 878 -22.091 1.623 -7.139 225 HD3 PRO 878 HD2 PRO 878 -23.615 1.682 -8.069 226 H ALA 879 HN ALA 879 -21.132 6.188 -10.244 227 HA ALA 879 HA ALA 879 -18.425 6.146 -9.530 228 HB1 ALA 879 HB1 ALA 879 -20.316 8.498 -10.011 229 HB2 ALA 879 HB2 ALA 879 -18.546 8.591 -10.035 230 HB3 ALA 879 HB3 ALA 879 -19.389 7.603 -11.238 231 H SER 880 HN SER 880 -21.122 7.043 -7.488 232 HA SER 880 HA SER 880 -19.839 8.565 -5.459 233 HB2 SER 880 HB1 SER 880 -22.060 6.508 -5.118 234 HB3 SER 880 HB2 SER 880 -21.709 7.880 -4.054 235 HG SER 880 HG1 SER 880 -22.348 9.286 -5.693 236 H VAL 881 HN VAL 881 -19.724 5.105 -6.175 237 HA VAL 881 HA VAL 881 -18.253 4.516 -3.666 238 HB VAL 881 HB VAL 881 -19.150 2.725 -5.958 239 HG11 VAL 881 HG11 VAL 881 -17.075 1.791 -4.936 240 HG12 VAL 881 HG12 VAL 881 -17.852 1.879 -3.337 241 HG13 VAL 881 HG13 VAL 881 -18.494 0.803 -4.592 242 HG21 VAL 881 HG21 VAL 881 -20.112 2.882 -3.069 243 HG22 VAL 881 HG22 VAL 881 -20.999 3.481 -4.482 244 HG23 VAL 881 HG23 VAL 881 -20.693 1.749 -4.311 245 H VAL 882 HN VAL 882 -17.708 4.774 -7.175 246 HA VAL 882 HA VAL 882 -15.038 3.792 -6.882 247 HB VAL 882 HB VAL 882 -16.562 3.993 -9.014 248 HG11 VAL 882 HG11 VAL 882 -14.683 6.242 -9.694 249 HG12 VAL 882 HG12 VAL 882 -16.090 5.668 -10.581 250 HG13 VAL 882 HG13 VAL 882 -16.305 6.576 -9.075 251 HG21 VAL 882 HG21 VAL 882 -13.525 4.243 -9.201 252 HG22 VAL 882 HG22 VAL 882 -14.403 2.748 -8.848 253 HG23 VAL 882 HG23 VAL 882 -14.605 3.533 -10.419 254 H GLY 883 HN GLY 883 -16.312 6.873 -6.299 255 HA2 GLY 883 HA1 GLY 883 -13.659 8.222 -6.122 256 HA3 GLY 883 HA2 GLY 883 -15.238 8.946 -5.846 257 H SER 884 HN SER 884 -15.837 6.471 -4.033 258 HA SER 884 HA SER 884 -14.761 7.577 -1.509 259 HB2 SER 884 HB1 SER 884 -17.144 6.960 -1.732 260 HB3 SER 884 HB2 SER 884 -16.684 5.273 -2.017 261 HG SER 884 HG1 SER 884 -15.863 5.170 0.079 262 H ILE 885 HN ILE 885 -14.447 4.682 -3.542 263 HA ILE 885 HA ILE 885 -12.482 3.274 -1.897 264 HB ILE 885 HB ILE 885 -13.677 3.101 -4.657 265 HG12 ILE 885 HG11 ILE 885 -14.173 0.839 -4.109 266 HG13 ILE 885 HG12 ILE 885 -13.110 0.833 -2.702 267 HG21 ILE 885 HG21 ILE 885 -11.376 2.826 -5.274 268 HG22 ILE 885 HG22 ILE 885 -11.119 1.627 -3.974 269 HG23 ILE 885 HG23 ILE 885 -12.207 1.273 -5.338 270 HD11 ILE 885 HD1 ILE 885 -15.555 0.940 -2.135 271 HD12 ILE 885 HD2 ILE 885 -14.630 2.290 -1.474 272 HD13 ILE 885 HD3 ILE 885 -15.636 2.516 -2.924 273 H ASP 886 HN ASP 886 -10.388 3.864 -1.629 274 HA ASP 886 HA ASP 886 -9.257 6.114 -3.182 275 HB2 ASP 886 HB1 ASP 886 -8.133 4.570 -0.818 276 HB3 ASP 886 HB2 ASP 886 -7.422 5.997 -1.543 277 H GLU 887 HN GLU 887 -6.817 5.885 -3.675 278 HA GLU 887 HA GLU 887 -6.293 4.031 -5.730 279 HB2 GLU 887 HB1 GLU 887 -5.090 6.110 -5.402 280 HB3 GLU 887 HB2 GLU 887 -4.412 5.540 -3.875 281 HG2 GLU 887 HG1 GLU 887 -3.131 3.798 -5.019 282 HG3 GLU 887 HG2 GLU 887 -3.860 4.225 -6.567 283 H SER 888 HN SER 888 -5.503 3.785 -2.261 284 HA SER 888 HA SER 888 -4.325 1.097 -2.577 285 HB2 SER 888 HB1 SER 888 -3.559 1.465 -0.265 286 HB3 SER 888 HB2 SER 888 -3.087 2.778 -1.349 287 HG SER 888 HG1 SER 888 -5.061 2.770 0.686 288 H SER 889 HN SER 889 -7.501 2.118 -2.083 289 HA SER 889 HA SER 889 -8.249 0.495 0.182 290 HB2 SER 889 HB1 SER 889 -9.905 1.602 -2.102 291 HB3 SER 889 HB2 SER 889 -10.577 0.727 -0.712 292 HG SER 889 HG1 SER 889 -9.794 2.339 0.654 293 H ARG 890 HN ARG 890 -8.353 -1.606 0.336 294 HA ARG 890 HA ARG 890 -8.486 -3.443 -1.964 295 HB2 ARG 890 HB1 ARG 890 -8.420 -3.885 1.045 296 HB3 ARG 890 HB2 ARG 890 -8.604 -5.193 -0.133 297 HG2 ARG 890 HG1 ARG 890 -6.452 -4.638 -1.176 298 HG3 ARG 890 HG2 ARG 890 -6.259 -3.256 -0.088 299 HD2 ARG 890 HD1 ARG 890 -4.910 -5.075 0.731 300 HD3 ARG 890 HD2 ARG 890 -6.240 -4.771 1.860 301 HE ARG 890 HE ARG 890 -6.866 -6.871 -0.077 302 HH11 ARG 890 HH11 ARG 890 -5.185 -6.360 2.960 303 HH12 ARG 890 HH12 ARG 890 -5.360 -8.028 3.431 304 HH21 ARG 890 HH21 ARG 890 -7.053 -8.955 0.571 305 HH22 ARG 890 HH22 ARG 890 -6.401 -9.460 2.115 306 H TRP 891 HN TRP 891 -10.414 -2.504 -2.825 307 HA TRP 891 HA TRP 891 -13.005 -3.292 -1.643 308 HB2 TRP 891 HB1 TRP 891 -12.801 -1.392 -3.247 309 HB3 TRP 891 HB2 TRP 891 -12.350 -2.547 -4.507 310 HD1 TRP 891 HD1 TRP 891 -15.165 -0.903 -2.878 311 HE1 TRP 891 HE1 TRP 891 -17.428 -1.664 -3.786 312 HE3 TRP 891 HE3 TRP 891 -13.626 -5.082 -5.399 313 HZ2 TRP 891 HZ2 TRP 891 -18.489 -4.049 -5.031 314 HZ3 TRP 891 HZ3 TRP 891 -15.325 -6.658 -6.329 315 HH2 TRP 891 HH2 TRP 891 -17.725 -6.179 -6.068 316 H ILE 892 HN ILE 892 -13.867 -5.319 -1.813 317 HA ILE 892 HA ILE 892 -12.771 -7.248 -3.771 318 HB ILE 892 HB ILE 892 -12.516 -8.975 -2.085 319 HG12 ILE 892 HG11 ILE 892 -13.011 -6.945 0.112 320 HG13 ILE 892 HG12 ILE 892 -14.301 -7.965 -0.522 321 HG21 ILE 892 HG21 ILE 892 -10.560 -7.514 -2.593 322 HG22 ILE 892 HG22 ILE 892 -10.966 -6.508 -1.190 323 HG23 ILE 892 HG23 ILE 892 -10.511 -8.191 -0.959 324 HD11 ILE 892 HD1 ILE 892 -11.785 -9.125 0.677 325 HD12 ILE 892 HD2 ILE 892 -13.352 -8.949 1.484 326 HD13 ILE 892 HD3 ILE 892 -13.221 -9.993 0.051 327 H CYS 893 HN CYS 893 -14.159 -9.221 -4.024 328 HA CYS 893 HA CYS 893 -16.840 -8.744 -4.371 329 HB2 CYS 893 HB1 CYS 893 -15.769 -11.465 -3.569 330 HB3 CYS 893 HB2 CYS 893 -17.178 -11.072 -4.559 331 H MET 894 HN MET 894 -15.375 -10.042 -1.294 332 HA MET 894 HA MET 894 -17.959 -10.639 -0.144 333 HB2 MET 894 HB1 MET 894 -15.311 -10.242 1.285 334 HB3 MET 894 HB2 MET 894 -16.764 -10.990 1.948 335 HG2 MET 894 HG1 MET 894 -16.660 -12.740 0.181 336 HG3 MET 894 HG2 MET 894 -15.145 -12.043 -0.401 337 HE1 MET 894 HE1 MET 894 -13.951 -14.374 -0.247 338 HE2 MET 894 HE2 MET 894 -13.975 -15.403 1.202 339 HE3 MET 894 HE3 MET 894 -15.481 -15.094 0.310 340 H ASN 895 HN ASN 895 -16.431 -7.637 -0.591 341 HA ASN 895 HA ASN 895 -18.004 -6.262 1.524 342 HB2 ASN 895 HB1 ASN 895 -16.216 -4.961 1.653 343 HB3 ASN 895 HB2 ASN 895 -15.410 -5.894 0.406 344 HD21 ASN 895 HD21 ASN 895 -16.144 -5.256 -1.955 345 HD22 ASN 895 HD22 ASN 895 -16.220 -3.515 -2.202 346 H ASN 896 HN ASN 896 -18.361 -7.172 -1.716 347 HA ASN 896 HA ASN 896 -19.405 -4.954 -3.020 348 HB2 ASN 896 HB1 ASN 896 -18.823 -7.134 -4.087 349 HB3 ASN 896 HB2 ASN 896 -20.255 -7.849 -3.343 350 HD21 ASN 896 HD21 ASN 896 -20.575 -8.463 -5.676 351 HD22 ASN 896 HD22 ASN 896 -21.648 -7.351 -6.513 352 H SER 897 HN SER 897 -21.192 -3.865 -3.095 353 HA SER 897 HA SER 897 -23.350 -3.883 -1.254 354 HB2 SER 897 HB1 SER 897 -23.068 -2.855 -4.108 355 HB3 SER 897 HB2 SER 897 -24.480 -2.551 -3.102 356 HG SER 897 HG1 SER 897 -22.939 -0.845 -2.937 357 H ASP 898 HN ASP 898 -23.098 -5.328 -4.472 358 HA ASP 898 HA ASP 898 -25.891 -6.245 -4.451 359 HB2 ASP 898 HB1 ASP 898 -23.829 -6.954 -6.528 360 HB3 ASP 898 HB2 ASP 898 -25.575 -6.957 -6.679 361 H LYS 899 HN LYS 899 -26.229 -7.758 -3.023 362 HA LYS 899 HA LYS 899 -24.540 -9.816 -2.128 363 HB2 LYS 899 HB1 LYS 899 -27.587 -9.702 -2.101 364 HB3 LYS 899 HB2 LYS 899 -26.596 -10.790 -1.133 365 HG2 LYS 899 HG1 LYS 899 -26.168 -7.797 -0.919 366 HG3 LYS 899 HG2 LYS 899 -27.506 -8.561 -0.073 367 HD2 LYS 899 HD1 LYS 899 -24.689 -9.630 0.176 368 HD3 LYS 899 HD2 LYS 899 -25.302 -8.310 1.209 369 HE2 LYS 899 HE1 LYS 899 -27.167 -9.757 1.952 370 HE3 LYS 899 HE2 LYS 899 -26.579 -11.066 0.926 371 HZ1 LYS 899 HZ1 LYS 899 -25.831 -11.335 3.226 372 HZ2 LYS 899 HZ2 LYS 899 -24.533 -11.104 2.265 373 HZ3 LYS 899 HZ3 LYS 899 -25.081 -9.888 3.211 374 H ARG 900 HN ARG 900 -26.297 -9.760 -5.035 375 HA ARG 900 HA ARG 900 -26.442 -12.622 -5.639 376 HB2 ARG 900 HB1 ARG 900 -26.465 -10.093 -7.336 377 HB3 ARG 900 HB2 ARG 900 -26.748 -11.701 -7.975 378 HG2 ARG 900 HG1 ARG 900 -28.500 -10.181 -5.988 379 HG3 ARG 900 HG2 ARG 900 -28.821 -10.459 -7.689 380 HD2 ARG 900 HD1 ARG 900 -30.211 -12.006 -6.643 381 HD3 ARG 900 HD2 ARG 900 -28.842 -12.966 -7.181 382 HE ARG 900 HE ARG 900 -28.396 -13.503 -4.979 383 HH11 ARG 900 HH11 ARG 900 -30.528 -10.723 -4.860 384 HH12 ARG 900 HH12 ARG 900 -30.663 -10.796 -3.126 385 HH21 ARG 900 HH21 ARG 900 -28.583 -13.509 -2.777 386 HH22 ARG 900 HH22 ARG 900 -29.608 -12.348 -1.988 387 H PHE 901 HN PHE 901 -23.940 -10.241 -5.840 388 HA PHE 901 HA PHE 901 -22.090 -12.228 -7.090 389 HB2 PHE 901 HB1 PHE 901 -22.071 -9.261 -7.716 390 HB3 PHE 901 HB2 PHE 901 -21.133 -10.528 -8.489 391 HD1 PHE 901 HD1 PHE 901 -21.969 -11.595 -10.485 392 HD2 PHE 901 HD2 PHE 901 -24.531 -9.060 -8.133 393 HE1 PHE 901 HE1 PHE 901 -23.684 -11.700 -12.260 394 HE2 PHE 901 HE2 PHE 901 -26.252 -9.158 -9.921 395 HZ PHE 901 HZ PHE 901 -25.838 -10.486 -11.979 396 H ALA 902 HN ALA 902 -22.513 -11.299 -4.245 397 HA ALA 902 HA ALA 902 -20.015 -9.904 -3.635 398 HB1 ALA 902 HB1 ALA 902 -22.197 -9.020 -2.766 399 HB2 ALA 902 HB2 ALA 902 -22.412 -10.536 -1.854 400 HB3 ALA 902 HB3 ALA 902 -21.077 -9.434 -1.465 401 H ASP 903 HN ASP 903 -19.498 -12.432 -4.455 402 HA ASP 903 HA ASP 903 -17.943 -13.353 -2.142 403 HB2 ASP 903 HB1 ASP 903 -19.668 -15.240 -3.760 404 HB3 ASP 903 HB2 ASP 903 -18.379 -15.748 -2.683 405 H CYS 904 HN CYS 904 -15.961 -14.139 -2.644 406 HA CYS 904 HA CYS 904 -14.799 -13.590 -5.149 407 HB2 CYS 904 HB1 CYS 904 -13.995 -15.310 -2.772 408 HB3 CYS 904 HB2 CYS 904 -12.945 -14.992 -4.157 409 H SER 905 HN SER 905 -16.811 -16.212 -4.245 410 HA SER 905 HA SER 905 -15.946 -18.047 -6.386 411 HB2 SER 905 HB1 SER 905 -18.273 -18.247 -4.445 412 HB3 SER 905 HB2 SER 905 -17.708 -19.510 -5.555 413 HG SER 905 HG1 SER 905 -16.859 -19.787 -3.435 414 H LYS 906 HN LYS 906 -18.240 -15.445 -6.030 415 HA LYS 906 HA LYS 906 -20.178 -16.385 -8.030 416 HB2 LYS 906 HB1 LYS 906 -19.733 -13.886 -6.397 417 HB3 LYS 906 HB2 LYS 906 -20.859 -13.842 -7.738 418 HG2 LYS 906 HG1 LYS 906 -21.084 -15.686 -5.330 419 HG3 LYS 906 HG2 LYS 906 -21.961 -14.183 -5.607 420 HD2 LYS 906 HD1 LYS 906 -23.573 -15.596 -6.295 421 HD3 LYS 906 HD2 LYS 906 -22.738 -15.459 -7.843 422 HE2 LYS 906 HE1 LYS 906 -21.497 -17.592 -7.293 423 HE3 LYS 906 HE2 LYS 906 -22.344 -17.657 -5.747 424 HZ1 LYS 906 HZ1 LYS 906 -23.665 -17.788 -8.407 425 HZ2 LYS 906 HZ2 LYS 906 -23.427 -19.055 -7.407 426 HZ3 LYS 906 HZ3 LYS 906 -24.440 -17.855 -6.970 427 H SER 907 HN SER 907 -20.806 -14.450 -9.630 428 HA SER 907 HA SER 907 -18.507 -14.293 -11.538 429 HB2 SER 907 HB1 SER 907 -20.385 -15.840 -12.071 430 HB3 SER 907 HB2 SER 907 -21.464 -14.436 -12.174 431 HG SER 907 HG1 SER 907 -20.530 -15.155 -14.211 432 H GLN 908 HN GLN 908 -19.943 -12.601 -13.357 433 HA GLN 908 HA GLN 908 -20.511 -10.044 -12.019 434 HB2 GLN 908 HB1 GLN 908 -18.884 -8.743 -13.140 435 HB3 GLN 908 HB2 GLN 908 -18.052 -10.078 -12.328 436 HG2 GLN 908 HG1 GLN 908 -18.182 -11.238 -14.698 437 HG3 GLN 908 HG2 GLN 908 -18.600 -9.637 -15.256 438 HE21 GLN 908 HE21 GLN 908 -16.744 -9.017 -16.380 439 HE22 GLN 908 HE22 GLN 908 -15.127 -9.047 -15.680 440 H GLU 909 HN GLU 909 -21.252 -8.334 -13.634 441 HA GLU 909 HA GLU 909 -23.492 -9.314 -15.054 442 HB2 GLU 909 HB1 GLU 909 -22.019 -6.712 -15.565 443 HB3 GLU 909 HB2 GLU 909 -23.681 -7.055 -16.006 444 HG2 GLU 909 HG1 GLU 909 -22.545 -6.692 -13.221 445 HG3 GLU 909 HG2 GLU 909 -23.547 -5.558 -14.106 446 H MET 910 HN MET 910 -20.237 -8.675 -16.270 447 HA MET 910 HA MET 910 -20.805 -9.912 -18.898 448 HB2 MET 910 HB1 MET 910 -19.700 -7.064 -18.682 449 HB3 MET 910 HB2 MET 910 -19.731 -8.064 -20.119 450 HG2 MET 910 HG1 MET 910 -21.557 -6.844 -20.584 451 HG3 MET 910 HG2 MET 910 -22.358 -8.107 -19.659 452 HE1 MET 910 HE1 MET 910 -24.487 -6.687 -19.199 453 HE2 MET 910 HE2 MET 910 -24.467 -4.988 -18.677 454 HE3 MET 910 HE3 MET 910 -23.811 -5.435 -20.268 455 H SER 911 HN SER 911 -18.971 -11.046 -19.568 456 HA SER 911 HA SER 911 -16.751 -11.357 -17.804 457 HB2 SER 911 HB1 SER 911 -16.528 -11.969 -20.734 458 HB3 SER 911 HB2 SER 911 -15.823 -12.821 -19.366 459 HG SER 911 HG1 SER 911 -17.613 -13.969 -20.242 460 H ASN 912 HN ASN 912 -14.468 -10.971 -18.276 461 HA ASN 912 HA ASN 912 -14.015 -8.194 -18.354 462 HB2 ASN 912 HB1 ASN 912 -12.613 -9.727 -17.144 463 HB3 ASN 912 HB2 ASN 912 -12.055 -10.498 -18.632 464 HD21 ASN 912 HD21 ASN 912 -10.452 -9.591 -16.608 465 HD22 ASN 912 HD22 ASN 912 -9.474 -8.261 -17.235 466 H GLU 913 HN GLU 913 -13.685 -10.535 -20.963 467 HA GLU 913 HA GLU 913 -12.540 -8.874 -22.981 468 HB2 GLU 913 HB1 GLU 913 -12.710 -11.368 -22.894 469 HB3 GLU 913 HB2 GLU 913 -14.412 -11.271 -23.252 470 HG2 GLU 913 HG1 GLU 913 -12.313 -10.011 -25.075 471 HG3 GLU 913 HG2 GLU 913 -12.602 -11.741 -25.114 472 H GLU 914 HN GLU 914 -15.845 -8.995 -21.802 473 HA GLU 914 HA GLU 914 -16.982 -7.572 -24.146 474 HB2 GLU 914 HB1 GLU 914 -18.191 -8.624 -21.573 475 HB3 GLU 914 HB2 GLU 914 -19.114 -7.774 -22.793 476 HG2 GLU 914 HG1 GLU 914 -17.615 -10.380 -23.323 477 HG3 GLU 914 HG2 GLU 914 -19.262 -10.299 -22.720 478 H ILE 915 HN ILE 915 -16.607 -7.035 -20.570 479 HA ILE 915 HA ILE 915 -17.387 -4.287 -20.670 480 HB ILE 915 HB ILE 915 -17.471 -5.113 -18.554 481 HG12 ILE 915 HG11 ILE 915 -15.903 -3.900 -17.106 482 HG13 ILE 915 HG12 ILE 915 -14.810 -3.602 -18.451 483 HG21 ILE 915 HG21 ILE 915 -15.595 -6.146 -17.272 484 HG22 ILE 915 HG22 ILE 915 -16.203 -7.097 -18.601 485 HG23 ILE 915 HG23 ILE 915 -14.670 -6.201 -18.793 486 HD11 ILE 915 HD1 ILE 915 -16.462 -2.183 -19.528 487 HD12 ILE 915 HD2 ILE 915 -17.709 -2.679 -18.396 488 HD13 ILE 915 HD3 ILE 915 -16.310 -1.703 -17.850 489 H ASN 916 HN ASN 916 -13.994 -5.542 -20.748 490 HA ASN 916 HA ASN 916 -12.882 -2.956 -20.974 491 HB2 ASN 916 HB1 ASN 916 -10.807 -3.923 -21.392 492 HB3 ASN 916 HB2 ASN 916 -11.661 -5.045 -20.351 493 HD21 ASN 916 HD21 ASN 916 -10.826 -7.038 -20.844 494 HD22 ASN 916 HD22 ASN 916 -10.507 -7.579 -22.492 495 H GLU 917 HN GLU 917 -14.374 -4.758 -23.512 496 HA GLU 917 HA GLU 917 -13.483 -3.157 -25.747 497 HB2 GLU 917 HB1 GLU 917 -15.224 -5.409 -25.274 498 HB3 GLU 917 HB2 GLU 917 -16.157 -4.179 -26.113 499 HG2 GLU 917 HG1 GLU 917 -14.273 -3.952 -27.782 500 HG3 GLU 917 HG2 GLU 917 -13.474 -5.318 -27.002 501 H GLU 918 HN GLU 918 -16.086 -2.737 -23.375 502 HA GLU 918 HA GLU 918 -17.667 -0.836 -24.804 503 HB2 GLU 918 HB1 GLU 918 -18.306 -2.142 -22.691 504 HB3 GLU 918 HB2 GLU 918 -17.320 -1.001 -21.776 505 HG2 GLU 918 HG1 GLU 918 -19.681 -0.410 -21.663 506 HG3 GLU 918 HG2 GLU 918 -18.728 0.862 -22.405 507 H LEU 919 HN LEU 919 -14.956 -0.381 -22.547 508 HA LEU 919 HA LEU 919 -14.943 2.542 -22.978 509 HB2 LEU 919 HB1 LEU 919 -12.854 0.992 -21.437 510 HB3 LEU 919 HB2 LEU 919 -13.262 2.690 -21.353 511 HG LEU 919 HG LEU 919 -15.660 1.600 -20.585 512 HD11 LEU 919 HD11 LEU 919 -15.155 -0.209 -18.996 513 HD12 LEU 919 HD12 LEU 919 -14.823 -0.702 -20.655 514 HD13 LEU 919 HD13 LEU 919 -13.479 -0.272 -19.587 515 HD21 LEU 919 HD21 LEU 919 -14.867 1.939 -18.228 516 HD22 LEU 919 HD22 LEU 919 -13.223 2.233 -18.888 517 HD23 LEU 919 HD23 LEU 919 -14.544 3.308 -19.338 518 H GLY 920 HN GLY 920 -13.263 -0.326 -24.072 519 HA2 GLY 920 HA1 GLY 920 -11.988 -0.636 -25.998 520 HA3 GLY 920 HA2 GLY 920 -11.921 1.109 -26.264 521 H ILE 921 HN ILE 921 -10.868 -1.147 -23.671 522 HA ILE 921 HA ILE 921 -8.208 0.218 -23.538 523 HB ILE 921 HB ILE 921 -8.395 0.253 -21.106 524 HG12 ILE 921 HG11 ILE 921 -11.283 -0.650 -21.486 525 HG13 ILE 921 HG12 ILE 921 -9.970 -1.663 -20.895 526 HG21 ILE 921 HG21 ILE 921 -10.731 1.720 -22.386 527 HG22 ILE 921 HG22 ILE 921 -9.839 2.175 -20.921 528 HG23 ILE 921 HG23 ILE 921 -9.034 2.223 -22.491 529 HD11 ILE 921 HD1 ILE 921 -9.631 -0.117 -18.975 530 HD12 ILE 921 HD2 ILE 921 -11.055 0.812 -19.514 531 HD13 ILE 921 HD3 ILE 921 -11.231 -0.886 -19.029 532 H GLY 922 HN GLY 922 -6.684 -0.836 -22.060 533 HA2 GLY 922 HA1 GLY 922 -6.244 -3.458 -23.265 534 HA3 GLY 922 HA2 GLY 922 -5.041 -2.390 -22.559 535 H GLN 923 HN GLN 923 -7.954 -3.932 -21.011 536 HA GLN 923 HA GLN 923 -6.327 -5.153 -18.912 537 HB2 GLN 923 HB1 GLN 923 -9.188 -5.500 -19.793 538 HB3 GLN 923 HB2 GLN 923 -8.425 -6.804 -18.919 539 HG2 GLN 923 HG1 GLN 923 -9.464 -5.630 -17.245 540 HG3 GLN 923 HG2 GLN 923 -7.764 -5.225 -17.097 541 HE21 GLN 923 HE21 GLN 923 -8.716 -3.370 -15.763 542 HE22 GLN 923 HE22 GLN 923 -9.192 -1.943 -16.653 543 H ASP 924 HN ASP 924 -5.960 -7.371 -18.644 544 HA ASP 924 HA ASP 924 -4.640 -8.549 -20.974 545 HB2 ASP 924 HB1 ASP 924 -3.957 -8.208 -18.448 546 HB3 ASP 924 HB2 ASP 924 -4.780 -9.729 -18.206 547 H GLU 925 HN GLU 925 -7.646 -8.745 -20.098 548 HA GLU 925 HA GLU 925 -9.475 -9.994 -20.506 549 HB2 GLU 925 HB1 GLU 925 -8.133 -10.402 -22.673 550 HB3 GLU 925 HB2 GLU 925 -7.827 -12.017 -22.026 551 HG2 GLU 925 HG1 GLU 925 -10.337 -12.252 -21.708 552 HG3 GLU 925 HG2 GLU 925 -10.505 -10.736 -22.603 553 H ALA 926 HN ALA 926 -6.831 -12.255 -19.831 554 HA ALA 926 HA ALA 926 -8.450 -13.970 -18.027 555 HB1 ALA 926 HB1 ALA 926 -5.456 -13.850 -18.593 556 HB2 ALA 926 HB2 ALA 926 -6.303 -15.115 -17.674 557 HB3 ALA 926 HB3 ALA 926 -6.629 -14.914 -19.407 558 H ASP 927 HN ASP 927 -5.901 -11.562 -17.742 559 HA ASP 927 HA ASP 927 -5.011 -10.361 -16.137 560 HB2 ASP 927 HB1 ASP 927 -7.422 -9.504 -16.200 561 HB3 ASP 927 HB2 ASP 927 -7.629 -10.312 -14.646 562 H ALA 928 HN ALA 928 -5.631 -13.410 -15.421 563 HA ALA 928 HA ALA 928 -3.759 -13.416 -13.135 564 HB1 ALA 928 HB1 ALA 928 -5.231 -14.915 -11.815 565 HB2 ALA 928 HB2 ALA 928 -5.962 -13.318 -12.061 566 HB3 ALA 928 HB3 ALA 928 -6.521 -14.707 -13.019 567 H1 ALA 1 HT1 ALA 1 -9.732 2.698 -7.071 568 H2 ALA 1 HT2 ALA 1 -8.313 3.480 -7.206 569 H3 ALA 1 HT3 ALA 1 -8.803 2.930 -5.730 570 HA ALA 1 HA ALA 1 -7.103 1.480 -6.554 571 HB1 ALA 1 HB1 ALA 1 -8.944 0.434 -5.225 572 HB2 ALA 1 HB2 ALA 1 -9.857 0.140 -6.723 573 HB3 ALA 1 HB3 ALA 1 -8.316 -0.681 -6.444 574 H ARG 2 HN ARG 2 -6.469 -0.144 -8.237 575 HA ARG 2 HA ARG 2 -6.642 0.866 -10.896 576 HB2 ARG 2 HB1 ARG 2 -4.786 -0.544 -10.227 577 HB3 ARG 2 HB2 ARG 2 -5.875 -1.854 -9.795 578 HG2 ARG 2 HG1 ARG 2 -6.497 -1.352 -12.523 579 HG3 ARG 2 HG2 ARG 2 -4.764 -1.141 -12.453 580 HD2 ARG 2 HD1 ARG 2 -4.431 -3.378 -11.885 581 HD3 ARG 2 HD2 ARG 2 -6.034 -3.541 -11.137 582 HE ARG 2 HE ARG 2 -6.661 -2.993 -13.752 583 HH11 ARG 2 HH11 ARG 2 -5.225 -5.616 -11.975 584 HH12 ARG 2 HH12 ARG 2 -5.576 -6.760 -13.256 585 HH21 ARG 2 HH21 ARG 2 -6.234 -4.433 -15.595 586 HH22 ARG 2 HH22 ARG 2 -5.915 -6.114 -15.205 587 H THR 3 HN THR 3 -8.390 0.976 -12.152 588 HA THR 3 HA THR 3 -9.673 -1.360 -13.111 589 HB THR 3 HB THR 3 -10.874 -1.034 -10.792 590 HG1 THR 3 HG1 THR 3 -12.293 -1.988 -12.054 591 HG21 THR 3 HG21 THR 3 -12.240 0.806 -10.277 592 HG22 THR 3 HG22 THR 3 -10.740 1.533 -10.853 593 HG23 THR 3 HG23 THR 3 -12.161 1.471 -11.912 594 H MLZ 4 HN MLZ 4 -12.191 -0.106 -13.838 595 HA MLZ 4 HA MLZ 4 -11.381 1.946 -15.824 596 HB2 MLZ 4 HB1 MLZ 4 -12.507 0.740 -17.540 597 HB3 MLZ 4 HB2 MLZ 4 -11.379 -0.351 -16.806 598 HG2 MLZ 4 HG1 MLZ 4 -14.364 -0.330 -16.133 599 HG3 MLZ 4 HG2 MLZ 4 -13.713 -1.182 -17.512 600 HD2 MLZ 4 HD1 MLZ 4 -13.010 -1.822 -14.659 601 HD3 MLZ 4 HD2 MLZ 4 -14.096 -2.736 -15.698 602 HE2 MLZ 4 HE1 MLZ 4 -11.140 -2.242 -16.187 603 HE3 MLZ 4 HE2 MLZ 4 -11.765 -3.706 -15.479 604 HZ MLZ 4 HZ1 MLZ 4 -11.330 -3.398 -18.127 605 HCM1 MLZ 4 HC1 MLZ 4 -12.676 -5.424 -18.368 606 HCM2 MLZ 4 HC2 MLZ 4 -11.743 -5.464 -16.873 607 HCM3 MLZ 4 HC3 MLZ 4 -13.454 -5.038 -16.813 608 HZ2 MLZ 4 HZ2 MLZ 4 -12.900 -2.992 -18.094 609 H GLN 5 HN GLN 5 -13.136 3.291 -16.643 610 HA GLN 5 HA GLN 5 -15.621 3.273 -15.026 611 HB2 GLN 5 HB1 GLN 5 -15.537 5.560 -14.513 612 HB3 GLN 5 HB2 GLN 5 -14.157 4.713 -13.843 613 HG2 GLN 5 HG1 GLN 5 -12.739 6.171 -14.728 614 HG3 GLN 5 HG2 GLN 5 -13.290 5.843 -16.355 615 HE21 GLN 5 HE21 GLN 5 -12.573 8.428 -14.702 616 HE22 GLN 5 HE22 GLN 5 -13.986 9.456 -14.922 617 H THR 6 HN THR 6 -17.089 2.811 -16.435 618 HA THR 6 HA THR 6 -16.920 3.194 -19.206 619 HB THR 6 HB THR 6 -19.524 2.666 -18.935 620 HG1 THR 6 HG1 THR 6 -19.354 3.069 -16.629 621 HG21 THR 6 HG21 THR 6 -18.969 0.292 -18.744 622 HG22 THR 6 HG22 THR 6 -17.891 1.113 -19.874 623 HG23 THR 6 HG23 THR 6 -17.304 0.718 -18.245 624 H ALA 7 HN ALA 7 -18.775 5.136 -16.844 625 HA ALA 7 HA ALA 7 -20.119 6.922 -17.041 626 HB1 ALA 7 HB1 ALA 7 -19.265 8.820 -18.347 627 HB2 ALA 7 HB2 ALA 7 -17.948 7.982 -17.500 628 HB3 ALA 7 HB3 ALA 7 -18.191 7.736 -19.245 629 H ARG 8 HN ARG 8 -20.925 4.630 -18.489 630 HA ARG 8 HA ARG 8 -22.870 5.535 -20.520 631 HB2 ARG 8 HB1 ARG 8 -20.540 3.619 -21.045 632 HB3 ARG 8 HB2 ARG 8 -22.006 3.645 -22.022 633 HG2 ARG 8 HG1 ARG 8 -21.576 5.903 -22.784 634 HG3 ARG 8 HG2 ARG 8 -20.216 6.084 -21.670 635 HD2 ARG 8 HD1 ARG 8 -19.390 5.660 -23.923 636 HD3 ARG 8 HD2 ARG 8 -18.935 4.375 -22.810 637 HE ARG 8 HE ARG 8 -20.248 2.840 -23.972 638 HH11 ARG 8 HH11 ARG 8 -21.035 5.995 -25.319 639 HH12 ARG 8 HH12 ARG 8 -21.925 5.270 -26.632 640 HH21 ARG 8 HH21 ARG 8 -21.318 2.042 -25.532 641 HH22 ARG 8 HH22 ARG 8 -22.094 3.030 -26.772 642 H TYR 9 HN TYR 9 -24.643 4.659 -19.701 643 HA TYR 9 HA TYR 9 -24.808 1.804 -19.047 644 HB2 TYR 9 HB1 TYR 9 -24.059 3.211 -16.978 645 HB3 TYR 9 HB2 TYR 9 -25.677 3.857 -16.983 646 HD1 TYR 9 HD1 TYR 9 -24.707 0.241 -17.645 647 HD2 TYR 9 HD2 TYR 9 -26.385 3.097 -14.866 648 HE1 TYR 9 HE1 TYR 9 -25.315 -1.603 -16.105 649 HE2 TYR 9 HE2 TYR 9 -26.992 1.237 -13.333 650 HH TYR 9 HH TYR 9 -27.013 -1.033 -13.005 Start of MODEL 11 1 H1 GLY 850 HT1 GLY 850 0.527 3.979 -6.422 2 H2 GLY 850 HT2 GLY 850 1.937 4.400 -5.698 3 H3 GLY 850 HT3 GLY 850 0.862 3.451 -4.904 4 HA2 GLY 850 HA1 GLY 850 2.362 2.693 -7.332 5 HA3 GLY 850 HA2 GLY 850 2.697 2.114 -5.691 6 H SER 851 HN SER 851 0.548 1.907 -8.448 7 HA SER 851 HA SER 851 -1.389 0.100 -7.226 8 HB2 SER 851 HB1 SER 851 -1.910 1.752 -9.029 9 HB3 SER 851 HB2 SER 851 -0.899 0.808 -10.122 10 HG SER 851 HG1 SER 851 -3.369 0.116 -8.915 11 H ARG 852 HN ARG 852 -1.947 -1.949 -8.149 12 HA ARG 852 HA ARG 852 0.244 -3.852 -8.676 13 HB2 ARG 852 HB1 ARG 852 -2.793 -4.163 -8.709 14 HB3 ARG 852 HB2 ARG 852 -1.629 -5.489 -8.821 15 HG2 ARG 852 HG1 ARG 852 -0.799 -5.014 -6.551 16 HG3 ARG 852 HG2 ARG 852 -1.824 -3.580 -6.448 17 HD2 ARG 852 HD1 ARG 852 -2.988 -5.163 -5.225 18 HD3 ARG 852 HD2 ARG 852 -3.837 -5.076 -6.774 19 HE ARG 852 HE ARG 852 -1.884 -7.174 -6.882 20 HH11 ARG 852 HH11 ARG 852 -4.961 -6.501 -5.344 21 HH12 ARG 852 HH12 ARG 852 -5.241 -8.188 -4.951 22 HH21 ARG 852 HH21 ARG 852 -2.365 -9.332 -6.453 23 HH22 ARG 852 HH22 ARG 852 -3.860 -9.733 -5.658 24 H ARG 853 HN ARG 853 -2.055 -2.018 -10.576 25 HA ARG 853 HA ARG 853 -0.875 -3.017 -13.130 26 HB2 ARG 853 HB1 ARG 853 -3.750 -3.333 -12.235 27 HB3 ARG 853 HB2 ARG 853 -3.416 -3.073 -13.941 28 HG2 ARG 853 HG1 ARG 853 -2.299 -5.361 -12.268 29 HG3 ARG 853 HG2 ARG 853 -3.686 -5.446 -13.352 30 HD2 ARG 853 HD1 ARG 853 -2.227 -4.829 -15.273 31 HD3 ARG 853 HD2 ARG 853 -0.821 -4.841 -14.191 32 HE ARG 853 HE ARG 853 -2.107 -7.338 -13.902 33 HH11 ARG 853 HH11 ARG 853 -0.306 -5.661 -16.441 34 HH12 ARG 853 HH12 ARG 853 0.220 -7.203 -17.121 35 HH21 ARG 853 HH21 ARG 853 -1.314 -9.213 -14.925 36 HH22 ARG 853 HH22 ARG 853 -0.291 -8.997 -16.343 37 H ALA 854 HN ALA 854 -2.385 -0.444 -11.469 38 HA ALA 854 HA ALA 854 -2.336 1.727 -11.681 39 HB1 ALA 854 HB1 ALA 854 0.042 1.315 -12.152 40 HB2 ALA 854 HB2 ALA 854 -0.308 1.386 -13.894 41 HB3 ALA 854 HB3 ALA 854 -0.579 2.815 -12.875 42 H SER 855 HN SER 855 -3.014 3.562 -12.486 43 HA SER 855 HA SER 855 -4.043 4.052 -15.119 44 HB2 SER 855 HB1 SER 855 -6.387 4.271 -14.608 45 HB3 SER 855 HB2 SER 855 -5.821 2.609 -14.432 46 HG SER 855 HG1 SER 855 -5.711 2.982 -12.147 47 H VAL 856 HN VAL 856 -5.791 5.449 -12.667 48 HA VAL 856 HA VAL 856 -4.081 7.862 -12.293 49 HB VAL 856 HB VAL 856 -6.036 9.348 -12.685 50 HG11 VAL 856 HG11 VAL 856 -5.271 7.745 -15.143 51 HG12 VAL 856 HG12 VAL 856 -5.891 9.408 -15.085 52 HG13 VAL 856 HG13 VAL 856 -4.303 9.038 -14.392 53 HG21 VAL 856 HG21 VAL 856 -7.967 8.602 -13.962 54 HG22 VAL 856 HG22 VAL 856 -7.381 6.928 -13.957 55 HG23 VAL 856 HG23 VAL 856 -7.881 7.708 -12.440 56 H GLY 857 HN GLY 857 -5.024 9.363 -10.676 57 HA2 GLY 857 HA1 GLY 857 -5.866 8.059 -8.199 58 HA3 GLY 857 HA2 GLY 857 -5.543 9.779 -8.458 59 H SER 858 HN SER 858 -7.806 7.267 -8.631 60 HA SER 858 HA SER 858 -9.912 7.939 -10.092 61 HB2 SER 858 HB1 SER 858 -10.225 6.843 -7.278 62 HB3 SER 858 HB2 SER 858 -11.331 6.597 -8.637 63 HG SER 858 HG1 SER 858 -9.730 5.400 -9.690 64 H GLU 859 HN GLU 859 -11.703 9.066 -10.151 65 HA GLU 859 HA GLU 859 -12.588 10.831 -7.924 66 HB2 GLU 859 HB1 GLU 859 -12.339 11.680 -10.842 67 HB3 GLU 859 HB2 GLU 859 -13.166 12.583 -9.569 68 HG2 GLU 859 HG1 GLU 859 -10.999 12.712 -8.305 69 HG3 GLU 859 HG2 GLU 859 -10.194 11.932 -9.669 70 H PHE 860 HN PHE 860 -14.875 11.521 -8.202 71 HA PHE 860 HA PHE 860 -16.490 9.277 -8.197 72 HB2 PHE 860 HB1 PHE 860 -17.277 12.192 -8.572 73 HB3 PHE 860 HB2 PHE 860 -18.397 10.898 -8.181 74 HD1 PHE 860 HD1 PHE 860 -15.588 12.960 -6.862 75 HD2 PHE 860 HD2 PHE 860 -18.535 9.943 -5.965 76 HE1 PHE 860 HE1 PHE 860 -15.085 13.180 -4.442 77 HE2 PHE 860 HE2 PHE 860 -18.031 10.166 -3.544 78 HZ PHE 860 HZ PHE 860 -16.296 11.780 -2.780 79 H THR 861 HN THR 861 -16.358 11.660 -10.910 80 HA THR 861 HA THR 861 -17.077 11.493 -13.106 81 HB THR 861 HB THR 861 -16.434 8.585 -12.858 82 HG1 THR 861 HG1 THR 861 -14.753 9.640 -11.950 83 HG21 THR 861 HG21 THR 861 -15.270 9.165 -15.134 84 HG22 THR 861 HG22 THR 861 -16.994 8.873 -15.131 85 HG23 THR 861 HG23 THR 861 -16.378 10.548 -15.164 86 H GLU 862 HN GLU 862 -18.472 9.404 -14.534 87 HA GLU 862 HA GLU 862 -21.173 9.311 -13.320 88 HB2 GLU 862 HB1 GLU 862 -20.613 9.719 -15.805 89 HB3 GLU 862 HB2 GLU 862 -20.263 7.983 -15.884 90 HG2 GLU 862 HG1 GLU 862 -22.554 7.450 -15.307 91 HG3 GLU 862 HG2 GLU 862 -22.877 9.107 -14.808 92 H SER 863 HN SER 863 -22.194 6.919 -13.509 93 HA SER 863 HA SER 863 -20.906 5.281 -11.570 94 HB2 SER 863 HB1 SER 863 -22.557 3.657 -11.914 95 HB3 SER 863 HB2 SER 863 -23.352 5.219 -12.103 96 HG SER 863 HG1 SER 863 -23.286 4.902 -14.370 97 H ALA 864 HN ALA 864 -19.685 3.410 -11.637 98 HA ALA 864 HA ALA 864 -18.188 2.914 -14.188 99 HB1 ALA 864 HB1 ALA 864 -17.175 4.908 -13.230 100 HB2 ALA 864 HB2 ALA 864 -17.116 4.144 -11.623 101 HB3 ALA 864 HB3 ALA 864 -16.088 3.545 -12.934 102 H TRP 865 HN TRP 865 -16.246 1.348 -13.649 103 HA TRP 865 HA TRP 865 -17.351 -0.912 -12.072 104 HB2 TRP 865 HB1 TRP 865 -14.982 -0.752 -13.942 105 HB3 TRP 865 HB2 TRP 865 -15.547 -2.203 -13.130 106 HD1 TRP 865 HD1 TRP 865 -16.762 0.348 -15.737 107 HE1 TRP 865 HE1 TRP 865 -18.538 -0.693 -17.216 108 HE3 TRP 865 HE3 TRP 865 -17.197 -4.149 -13.367 109 HZ2 TRP 865 HZ2 TRP 865 -20.068 -3.183 -17.307 110 HZ3 TRP 865 HZ3 TRP 865 -18.763 -5.902 -14.234 111 HH2 TRP 865 HH2 TRP 865 -20.188 -5.416 -16.187 112 H VAL 866 HN VAL 866 -15.749 -2.235 -10.859 113 HA VAL 866 HA VAL 866 -13.355 -0.919 -9.824 114 HB VAL 866 HB VAL 866 -15.034 -0.209 -8.213 115 HG11 VAL 866 HG11 VAL 866 -15.410 -3.154 -7.517 116 HG12 VAL 866 HG12 VAL 866 -16.169 -1.753 -6.738 117 HG13 VAL 866 HG13 VAL 866 -16.585 -2.174 -8.402 118 HG21 VAL 866 HG21 VAL 866 -12.684 -0.648 -7.509 119 HG22 VAL 866 HG22 VAL 866 -13.880 -0.815 -6.211 120 HG23 VAL 866 HG23 VAL 866 -13.189 -2.263 -6.957 121 H ARG 867 HN ARG 867 -11.733 -2.401 -9.255 122 HA ARG 867 HA ARG 867 -12.192 -5.220 -10.037 123 HB2 ARG 867 HB1 ARG 867 -10.065 -3.587 -10.470 124 HB3 ARG 867 HB2 ARG 867 -9.576 -4.229 -8.929 125 HG2 ARG 867 HG1 ARG 867 -9.725 -6.556 -9.842 126 HG3 ARG 867 HG2 ARG 867 -10.348 -5.912 -11.363 127 HD2 ARG 867 HD1 ARG 867 -8.283 -5.874 -12.112 128 HD3 ARG 867 HD2 ARG 867 -8.002 -4.461 -11.110 129 HE ARG 867 HE ARG 867 -6.796 -7.042 -10.914 130 HH11 ARG 867 HH11 ARG 867 -7.853 -4.560 -8.702 131 HH12 ARG 867 HH12 ARG 867 -6.807 -5.126 -7.417 132 HH21 ARG 867 HH21 ARG 867 -5.597 -7.793 -9.184 133 HH22 ARG 867 HH22 ARG 867 -5.616 -6.895 -7.691 134 H CYS 868 HN CYS 868 -12.124 -6.961 -8.655 135 HA CYS 868 HA CYS 868 -11.945 -6.589 -5.756 136 HB2 CYS 868 HB1 CYS 868 -13.453 -8.265 -6.653 137 HB3 CYS 868 HB2 CYS 868 -12.120 -9.047 -7.517 138 H ASP 869 HN ASP 869 -10.107 -6.412 -4.694 139 HA ASP 869 HA ASP 869 -7.527 -7.239 -5.836 140 HB2 ASP 869 HB1 ASP 869 -8.410 -5.763 -3.345 141 HB3 ASP 869 HB2 ASP 869 -6.766 -6.385 -3.470 142 H ASP 870 HN ASP 870 -9.863 -9.017 -4.152 143 HA ASP 870 HA ASP 870 -7.857 -10.725 -2.798 144 HB2 ASP 870 HB1 ASP 870 -10.083 -10.094 -1.739 145 HB3 ASP 870 HB2 ASP 870 -10.857 -11.154 -2.910 146 H CYS 871 HN CYS 871 -9.985 -10.687 -5.618 147 HA CYS 871 HA CYS 871 -8.346 -12.882 -6.727 148 HB2 CYS 871 HB1 CYS 871 -10.093 -13.811 -7.970 149 HB3 CYS 871 HB2 CYS 871 -10.565 -13.764 -6.288 150 H PHE 872 HN PHE 872 -10.547 -11.122 -8.597 151 HA PHE 872 HA PHE 872 -8.894 -9.034 -9.679 152 HB2 PHE 872 HB1 PHE 872 -8.277 -9.881 -11.799 153 HB3 PHE 872 HB2 PHE 872 -7.642 -10.991 -10.604 154 HD1 PHE 872 HD1 PHE 872 -9.552 -10.680 -13.614 155 HD2 PHE 872 HD2 PHE 872 -8.993 -13.195 -10.157 156 HE1 PHE 872 HE1 PHE 872 -10.615 -12.585 -14.818 157 HE2 PHE 872 HE2 PHE 872 -10.079 -15.080 -11.351 158 HZ PHE 872 HZ PHE 872 -10.891 -14.776 -13.682 159 H LYS 873 HN LYS 873 -11.780 -10.851 -9.732 160 HA LYS 873 HA LYS 873 -13.251 -10.224 -11.926 161 HB2 LYS 873 HB1 LYS 873 -13.808 -11.581 -9.880 162 HB3 LYS 873 HB2 LYS 873 -14.406 -10.075 -9.142 163 HG2 LYS 873 HG1 LYS 873 -16.226 -9.960 -10.637 164 HG3 LYS 873 HG2 LYS 873 -15.346 -10.846 -11.897 165 HD2 LYS 873 HD1 LYS 873 -17.051 -12.310 -11.091 166 HD3 LYS 873 HD2 LYS 873 -15.462 -12.893 -10.583 167 HE2 LYS 873 HE1 LYS 873 -16.101 -11.301 -8.435 168 HE3 LYS 873 HE2 LYS 873 -17.731 -11.733 -8.959 169 HZ1 LYS 873 HZ1 LYS 873 -16.881 -13.310 -7.354 170 HZ2 LYS 873 HZ2 LYS 873 -17.051 -14.078 -8.797 171 HZ3 LYS 873 HZ3 LYS 873 -15.557 -13.640 -8.275 172 H TRP 874 HN TRP 874 -14.963 -8.733 -12.387 173 HA TRP 874 HA TRP 874 -14.558 -5.999 -11.296 174 HB2 TRP 874 HB1 TRP 874 -15.561 -6.818 -14.044 175 HB3 TRP 874 HB2 TRP 874 -15.265 -5.177 -13.485 176 HD1 TRP 874 HD1 TRP 874 -13.417 -8.182 -14.846 177 HE1 TRP 874 HE1 TRP 874 -10.883 -7.608 -15.126 178 HE3 TRP 874 HE3 TRP 874 -13.314 -3.666 -12.467 179 HZ2 TRP 874 HZ2 TRP 874 -9.143 -5.532 -14.455 180 HZ3 TRP 874 HZ3 TRP 874 -11.138 -2.514 -12.143 181 HH2 TRP 874 HH2 TRP 874 -9.079 -3.327 -13.214 182 H ARG 875 HN ARG 875 -16.316 -4.663 -10.936 183 HA ARG 875 HA ARG 875 -19.100 -5.675 -11.197 184 HB2 ARG 875 HB1 ARG 875 -17.777 -4.790 -8.591 185 HB3 ARG 875 HB2 ARG 875 -19.514 -4.736 -8.815 186 HG2 ARG 875 HG1 ARG 875 -17.773 -7.235 -8.870 187 HG3 ARG 875 HG2 ARG 875 -18.878 -6.746 -7.598 188 HD2 ARG 875 HD1 ARG 875 -19.602 -7.671 -10.378 189 HD3 ARG 875 HD2 ARG 875 -19.913 -8.487 -8.847 190 HE ARG 875 HE ARG 875 -21.261 -6.096 -8.532 191 HH11 ARG 875 HH11 ARG 875 -21.456 -8.581 -10.987 192 HH12 ARG 875 HH12 ARG 875 -23.065 -8.034 -11.474 193 HH21 ARG 875 HH21 ARG 875 -23.436 -5.680 -9.145 194 HH22 ARG 875 HH22 ARG 875 -24.023 -6.506 -10.597 195 H ARG 876 HN ARG 876 -20.520 -4.123 -11.732 196 HA ARG 876 HA ARG 876 -19.606 -1.337 -12.183 197 HB2 ARG 876 HB1 ARG 876 -20.961 -2.821 -13.803 198 HB3 ARG 876 HB2 ARG 876 -22.347 -2.484 -12.784 199 HG2 ARG 876 HG1 ARG 876 -20.623 -0.520 -14.361 200 HG3 ARG 876 HG2 ARG 876 -22.294 -0.970 -14.687 201 HD2 ARG 876 HD1 ARG 876 -21.245 0.697 -12.390 202 HD3 ARG 876 HD2 ARG 876 -22.204 1.262 -13.753 203 HE ARG 876 HE ARG 876 -23.243 -0.679 -11.694 204 HH11 ARG 876 HH11 ARG 876 -23.900 2.305 -13.492 205 HH12 ARG 876 HH12 ARG 876 -25.575 2.252 -13.037 206 HH21 ARG 876 HH21 ARG 876 -25.340 -0.575 -11.118 207 HH22 ARG 876 HH22 ARG 876 -26.344 0.725 -11.687 208 H ILE 877 HN ILE 877 -19.642 0.019 -10.623 209 HA ILE 877 HA ILE 877 -21.657 -0.070 -8.426 210 HB ILE 877 HB ILE 877 -19.951 0.901 -6.999 211 HG12 ILE 877 HG11 ILE 877 -18.066 0.835 -9.393 212 HG13 ILE 877 HG12 ILE 877 -18.762 2.284 -8.694 213 HG21 ILE 877 HG21 ILE 877 -18.721 -1.453 -8.470 214 HG22 ILE 877 HG22 ILE 877 -18.560 -1.043 -6.746 215 HG23 ILE 877 HG23 ILE 877 -20.111 -1.602 -7.372 216 HD11 ILE 877 HD1 ILE 877 -17.579 2.017 -6.637 217 HD12 ILE 877 HD2 ILE 877 -16.942 0.439 -7.117 218 HD13 ILE 877 HD3 ILE 877 -16.435 1.894 -7.974 219 HA PRO 878 HA PRO 878 -22.556 4.199 -9.547 220 HB2 PRO 878 HB1 PRO 878 -23.294 5.345 -7.166 221 HB3 PRO 878 HB2 PRO 878 -24.322 4.147 -8.013 222 HG2 PRO 878 HG1 PRO 878 -22.358 3.641 -5.749 223 HG3 PRO 878 HG2 PRO 878 -24.066 3.107 -5.866 224 HD2 PRO 878 HD1 PRO 878 -22.002 1.473 -6.544 225 HD3 PRO 878 HD2 PRO 878 -23.534 1.450 -7.463 226 H ALA 879 HN ALA 879 -21.533 6.093 -9.655 227 HA ALA 879 HA ALA 879 -18.902 6.618 -9.170 228 HB1 ALA 879 HB1 ALA 879 -19.707 9.061 -9.279 229 HB2 ALA 879 HB2 ALA 879 -20.374 8.018 -10.548 230 HB3 ALA 879 HB3 ALA 879 -21.360 8.465 -9.138 231 H SER 880 HN SER 880 -21.485 7.079 -6.776 232 HA SER 880 HA SER 880 -20.139 8.618 -4.830 233 HB2 SER 880 HB1 SER 880 -22.178 6.411 -4.346 234 HB3 SER 880 HB2 SER 880 -21.809 7.781 -3.278 235 HG SER 880 HG1 SER 880 -23.675 8.190 -4.537 236 H VAL 881 HN VAL 881 -19.835 5.187 -5.592 237 HA VAL 881 HA VAL 881 -18.051 4.741 -3.255 238 HB VAL 881 HB VAL 881 -19.189 2.772 -5.274 239 HG11 VAL 881 HG11 VAL 881 -18.348 1.005 -3.771 240 HG12 VAL 881 HG12 VAL 881 -17.002 1.965 -4.386 241 HG13 VAL 881 HG13 VAL 881 -17.590 2.229 -2.731 242 HG21 VAL 881 HG21 VAL 881 -20.515 1.923 -3.369 243 HG22 VAL 881 HG22 VAL 881 -19.877 3.226 -2.341 244 HG23 VAL 881 HG23 VAL 881 -20.917 3.602 -3.730 245 H VAL 882 HN VAL 882 -17.981 4.938 -6.814 246 HA VAL 882 HA VAL 882 -15.270 4.028 -6.908 247 HB VAL 882 HB VAL 882 -16.999 4.279 -8.860 248 HG11 VAL 882 HG11 VAL 882 -16.825 6.839 -8.795 249 HG12 VAL 882 HG12 VAL 882 -15.206 6.658 -9.468 250 HG13 VAL 882 HG13 VAL 882 -16.607 6.071 -10.377 251 HG21 VAL 882 HG21 VAL 882 -13.982 4.607 -9.253 252 HG22 VAL 882 HG22 VAL 882 -14.816 3.074 -8.966 253 HG23 VAL 882 HG23 VAL 882 -15.123 3.975 -10.450 254 H GLY 883 HN GLY 883 -16.561 7.100 -6.103 255 HA2 GLY 883 HA1 GLY 883 -14.011 8.582 -6.274 256 HA3 GLY 883 HA2 GLY 883 -15.536 9.155 -5.605 257 H SER 884 HN SER 884 -15.534 6.524 -3.915 258 HA SER 884 HA SER 884 -13.966 7.543 -1.609 259 HB2 SER 884 HB1 SER 884 -16.288 6.795 -1.273 260 HB3 SER 884 HB2 SER 884 -15.866 5.182 -1.879 261 HG SER 884 HG1 SER 884 -15.831 5.355 0.440 262 H ILE 885 HN ILE 885 -14.157 4.710 -3.745 263 HA ILE 885 HA ILE 885 -11.744 3.376 -2.839 264 HB ILE 885 HB ILE 885 -13.695 3.149 -5.126 265 HG12 ILE 885 HG11 ILE 885 -14.067 0.914 -4.353 266 HG13 ILE 885 HG12 ILE 885 -12.692 0.938 -3.262 267 HG21 ILE 885 HG21 ILE 885 -11.589 2.753 -6.288 268 HG22 ILE 885 HG22 ILE 885 -11.116 1.546 -5.056 269 HG23 ILE 885 HG23 ILE 885 -12.515 1.270 -6.109 270 HD11 ILE 885 HD1 ILE 885 -15.170 2.681 -2.935 271 HD12 ILE 885 HD2 ILE 885 -14.942 1.127 -2.141 272 HD13 ILE 885 HD3 ILE 885 -13.852 2.464 -1.756 273 H ASP 886 HN ASP 886 -9.803 3.187 -4.165 274 HA ASP 886 HA ASP 886 -9.078 5.423 -5.924 275 HB2 ASP 886 HB1 ASP 886 -8.720 5.960 -3.309 276 HB3 ASP 886 HB2 ASP 886 -7.314 4.961 -3.509 277 H GLU 887 HN GLU 887 -6.732 5.245 -6.519 278 HA GLU 887 HA GLU 887 -5.875 2.790 -7.616 279 HB2 GLU 887 HB1 GLU 887 -4.996 5.077 -8.143 280 HB3 GLU 887 HB2 GLU 887 -4.220 5.115 -6.556 281 HG2 GLU 887 HG1 GLU 887 -3.012 2.926 -7.340 282 HG3 GLU 887 HG2 GLU 887 -3.542 3.391 -8.953 283 H SER 888 HN SER 888 -5.354 4.145 -4.341 284 HA SER 888 HA SER 888 -3.489 2.003 -3.554 285 HB2 SER 888 HB1 SER 888 -3.308 3.332 -1.483 286 HB3 SER 888 HB2 SER 888 -3.031 4.315 -2.932 287 HG SER 888 HG1 SER 888 -4.449 5.342 -1.427 288 H SER 889 HN SER 889 -6.911 2.472 -3.352 289 HA SER 889 HA SER 889 -7.320 1.115 -0.807 290 HB2 SER 889 HB1 SER 889 -8.880 2.813 -1.708 291 HB3 SER 889 HB2 SER 889 -9.334 1.674 -2.999 292 HG SER 889 HG1 SER 889 -10.689 1.707 -1.015 293 H ARG 890 HN ARG 890 -8.600 -0.823 -0.575 294 HA ARG 890 HA ARG 890 -8.093 -2.947 -2.625 295 HB2 ARG 890 HB1 ARG 890 -7.620 -3.183 0.365 296 HB3 ARG 890 HB2 ARG 890 -7.681 -4.547 -0.765 297 HG2 ARG 890 HG1 ARG 890 -5.809 -3.531 -2.076 298 HG3 ARG 890 HG2 ARG 890 -5.688 -2.239 -0.862 299 HD2 ARG 890 HD1 ARG 890 -5.235 -3.933 0.890 300 HD3 ARG 890 HD2 ARG 890 -5.350 -5.219 -0.332 301 HE ARG 890 HE ARG 890 -3.418 -3.259 -1.150 302 HH11 ARG 890 HH11 ARG 890 -3.711 -5.859 1.182 303 HH12 ARG 890 HH12 ARG 890 -1.992 -6.140 1.222 304 HH21 ARG 890 HH21 ARG 890 -1.233 -3.670 -1.048 305 HH22 ARG 890 HH22 ARG 890 -0.632 -4.927 -0.009 306 H TRP 891 HN TRP 891 -10.130 -2.553 -3.380 307 HA TRP 891 HA TRP 891 -12.543 -3.083 -1.754 308 HB2 TRP 891 HB1 TRP 891 -12.463 -1.333 -3.509 309 HB3 TRP 891 HB2 TRP 891 -12.194 -2.588 -4.717 310 HD1 TRP 891 HD1 TRP 891 -14.769 -0.767 -2.847 311 HE1 TRP 891 HE1 TRP 891 -17.122 -1.419 -3.567 312 HE3 TRP 891 HE3 TRP 891 -13.595 -5.043 -5.359 313 HZ2 TRP 891 HZ2 TRP 891 -18.371 -3.682 -4.913 314 HZ3 TRP 891 HZ3 TRP 891 -15.410 -6.493 -6.283 315 HH2 TRP 891 HH2 TRP 891 -17.776 -5.824 -6.028 316 H ILE 892 HN ILE 892 -13.705 -5.101 -1.827 317 HA ILE 892 HA ILE 892 -12.708 -7.207 -3.677 318 HB ILE 892 HB ILE 892 -12.553 -8.836 -1.932 319 HG12 ILE 892 HG11 ILE 892 -13.027 -6.697 0.167 320 HG13 ILE 892 HG12 ILE 892 -14.310 -7.749 -0.426 321 HG21 ILE 892 HG21 ILE 892 -10.909 -6.408 -1.092 322 HG22 ILE 892 HG22 ILE 892 -10.517 -8.100 -0.796 323 HG23 ILE 892 HG23 ILE 892 -10.528 -7.485 -2.452 324 HD11 ILE 892 HD1 ILE 892 -11.811 -8.849 0.872 325 HD12 ILE 892 HD2 ILE 892 -13.388 -8.632 1.645 326 HD13 ILE 892 HD3 ILE 892 -13.236 -9.747 0.266 327 H CYS 893 HN CYS 893 -14.095 -9.073 -3.945 328 HA CYS 893 HA CYS 893 -16.783 -8.647 -4.315 329 HB2 CYS 893 HB1 CYS 893 -15.435 -11.283 -3.585 330 HB3 CYS 893 HB2 CYS 893 -17.042 -11.072 -4.291 331 H MET 894 HN MET 894 -15.335 -9.861 -1.178 332 HA MET 894 HA MET 894 -17.899 -10.570 -0.087 333 HB2 MET 894 HB1 MET 894 -15.671 -11.429 0.677 334 HB3 MET 894 HB2 MET 894 -15.360 -9.850 1.407 335 HG2 MET 894 HG1 MET 894 -16.072 -11.396 3.099 336 HG3 MET 894 HG2 MET 894 -17.290 -10.145 2.914 337 HE1 MET 894 HE1 MET 894 -17.795 -12.781 4.552 338 HE2 MET 894 HE2 MET 894 -19.032 -11.527 4.295 339 HE3 MET 894 HE3 MET 894 -19.419 -13.235 3.990 340 H ASN 895 HN ASN 895 -16.379 -7.494 -0.435 341 HA ASN 895 HA ASN 895 -18.121 -6.109 1.511 342 HB2 ASN 895 HB1 ASN 895 -16.330 -4.804 1.678 343 HB3 ASN 895 HB2 ASN 895 -15.494 -5.720 0.440 344 HD21 ASN 895 HD21 ASN 895 -16.150 -5.095 -1.923 345 HD22 ASN 895 HD22 ASN 895 -16.250 -3.358 -2.173 346 H ASN 896 HN ASN 896 -18.357 -7.104 -1.715 347 HA ASN 896 HA ASN 896 -19.333 -4.924 -3.116 348 HB2 ASN 896 HB1 ASN 896 -18.743 -7.132 -4.114 349 HB3 ASN 896 HB2 ASN 896 -20.206 -7.821 -3.406 350 HD21 ASN 896 HD21 ASN 896 -21.623 -8.239 -5.096 351 HD22 ASN 896 HD22 ASN 896 -21.946 -7.071 -6.353 352 H SER 897 HN SER 897 -21.151 -3.861 -3.396 353 HA SER 897 HA SER 897 -23.288 -3.681 -1.614 354 HB2 SER 897 HB1 SER 897 -23.108 -3.086 -4.595 355 HB3 SER 897 HB2 SER 897 -24.468 -2.609 -3.584 356 HG SER 897 HG1 SER 897 -22.905 -0.927 -3.727 357 H ASP 898 HN ASP 898 -23.161 -5.569 -4.593 358 HA ASP 898 HA ASP 898 -25.948 -6.507 -4.279 359 HB2 ASP 898 HB1 ASP 898 -24.094 -7.284 -6.523 360 HB3 ASP 898 HB2 ASP 898 -25.847 -7.247 -6.508 361 H LYS 899 HN LYS 899 -26.171 -8.031 -2.827 362 HA LYS 899 HA LYS 899 -24.370 -10.014 -2.011 363 HB2 LYS 899 HB1 LYS 899 -27.416 -10.069 -1.945 364 HB3 LYS 899 HB2 LYS 899 -26.357 -11.123 -1.011 365 HG2 LYS 899 HG1 LYS 899 -26.106 -8.106 -0.751 366 HG3 LYS 899 HG2 LYS 899 -27.359 -8.990 0.119 367 HD2 LYS 899 HD1 LYS 899 -24.499 -9.906 0.270 368 HD3 LYS 899 HD2 LYS 899 -25.083 -8.594 1.312 369 HE2 LYS 899 HE1 LYS 899 -26.595 -11.205 1.086 370 HE3 LYS 899 HE2 LYS 899 -25.175 -11.100 2.146 371 HZ1 LYS 899 HZ1 LYS 899 -26.276 -9.289 3.339 372 HZ2 LYS 899 HZ2 LYS 899 -27.591 -9.379 2.371 373 HZ3 LYS 899 HZ3 LYS 899 -27.218 -10.619 3.362 374 H ARG 900 HN ARG 900 -26.393 -10.054 -4.807 375 HA ARG 900 HA ARG 900 -26.279 -12.872 -5.513 376 HB2 ARG 900 HB1 ARG 900 -26.705 -10.291 -7.078 377 HB3 ARG 900 HB2 ARG 900 -26.704 -11.879 -7.845 378 HG2 ARG 900 HG1 ARG 900 -28.570 -12.605 -6.373 379 HG3 ARG 900 HG2 ARG 900 -28.587 -11.007 -5.604 380 HD2 ARG 900 HD1 ARG 900 -29.085 -9.953 -7.787 381 HD3 ARG 900 HD2 ARG 900 -29.075 -11.530 -8.574 382 HE ARG 900 HE ARG 900 -31.163 -10.385 -6.836 383 HH11 ARG 900 HH11 ARG 900 -30.086 -13.357 -8.360 384 HH12 ARG 900 HH12 ARG 900 -31.654 -14.101 -8.212 385 HH21 ARG 900 HH21 ARG 900 -33.127 -11.397 -6.683 386 HH22 ARG 900 HH22 ARG 900 -33.324 -13.017 -7.288 387 H PHE 901 HN PHE 901 -23.933 -10.319 -5.776 388 HA PHE 901 HA PHE 901 -22.079 -12.149 -7.214 389 HB2 PHE 901 HB1 PHE 901 -22.201 -9.147 -7.605 390 HB3 PHE 901 HB2 PHE 901 -21.229 -10.300 -8.508 391 HD1 PHE 901 HD1 PHE 901 -24.707 -9.079 -7.932 392 HD2 PHE 901 HD2 PHE 901 -22.098 -11.347 -10.495 393 HE1 PHE 901 HE1 PHE 901 -26.494 -9.204 -9.649 394 HE2 PHE 901 HE2 PHE 901 -23.887 -11.495 -12.197 395 HZ PHE 901 HZ PHE 901 -26.092 -10.425 -11.777 396 H ALA 902 HN ALA 902 -22.451 -11.197 -4.316 397 HA ALA 902 HA ALA 902 -19.908 -9.930 -3.711 398 HB1 ALA 902 HB1 ALA 902 -22.049 -9.121 -2.705 399 HB2 ALA 902 HB2 ALA 902 -22.225 -10.692 -1.881 400 HB3 ALA 902 HB3 ALA 902 -20.877 -9.610 -1.477 401 H ASP 903 HN ASP 903 -19.406 -12.417 -4.709 402 HA ASP 903 HA ASP 903 -17.593 -13.201 -2.585 403 HB2 ASP 903 HB1 ASP 903 -19.760 -14.881 -2.753 404 HB3 ASP 903 HB2 ASP 903 -18.733 -15.613 -3.940 405 H CYS 904 HN CYS 904 -15.657 -14.122 -3.335 406 HA CYS 904 HA CYS 904 -14.831 -13.766 -6.023 407 HB2 CYS 904 HB1 CYS 904 -13.754 -15.547 -3.798 408 HB3 CYS 904 HB2 CYS 904 -12.899 -15.114 -5.279 409 H SER 905 HN SER 905 -16.996 -16.087 -4.751 410 HA SER 905 HA SER 905 -16.378 -18.206 -6.767 411 HB2 SER 905 HB1 SER 905 -18.360 -18.190 -4.466 412 HB3 SER 905 HB2 SER 905 -18.077 -19.519 -5.605 413 HG SER 905 HG1 SER 905 -16.212 -18.416 -3.747 414 H LYS 906 HN LYS 906 -18.515 -15.498 -6.240 415 HA LYS 906 HA LYS 906 -20.677 -16.451 -7.987 416 HB2 LYS 906 HB1 LYS 906 -19.979 -13.713 -6.885 417 HB3 LYS 906 HB2 LYS 906 -21.483 -14.143 -7.741 418 HG2 LYS 906 HG1 LYS 906 -20.651 -14.891 -4.975 419 HG3 LYS 906 HG2 LYS 906 -22.055 -13.974 -5.507 420 HD2 LYS 906 HD1 LYS 906 -21.532 -16.927 -5.984 421 HD3 LYS 906 HD2 LYS 906 -22.612 -16.261 -4.752 422 HE2 LYS 906 HE1 LYS 906 -24.028 -15.282 -6.543 423 HE3 LYS 906 HE2 LYS 906 -22.975 -15.983 -7.771 424 HZ1 LYS 906 HZ1 LYS 906 -24.540 -17.537 -5.775 425 HZ2 LYS 906 HZ2 LYS 906 -24.909 -17.390 -7.356 426 HZ3 LYS 906 HZ3 LYS 906 -23.564 -18.196 -6.908 427 H SER 907 HN SER 907 -21.382 -14.680 -9.669 428 HA SER 907 HA SER 907 -19.281 -14.719 -11.763 429 HB2 SER 907 HB1 SER 907 -21.464 -15.888 -12.072 430 HB3 SER 907 HB2 SER 907 -22.269 -14.308 -12.062 431 HG SER 907 HG1 SER 907 -21.721 -15.152 -14.187 432 H GLN 908 HN GLN 908 -20.487 -12.786 -13.440 433 HA GLN 908 HA GLN 908 -20.576 -10.170 -12.126 434 HB2 GLN 908 HB1 GLN 908 -18.764 -9.164 -13.308 435 HB3 GLN 908 HB2 GLN 908 -18.137 -10.598 -12.497 436 HG2 GLN 908 HG1 GLN 908 -18.647 -11.758 -14.855 437 HG3 GLN 908 HG2 GLN 908 -18.660 -10.112 -15.421 438 HE21 GLN 908 HE21 GLN 908 -16.653 -9.203 -15.925 439 HE22 GLN 908 HE22 GLN 908 -15.120 -9.986 -15.555 440 H GLU 909 HN GLU 909 -21.135 -8.408 -13.795 441 HA GLU 909 HA GLU 909 -23.397 -9.257 -15.335 442 HB2 GLU 909 HB1 GLU 909 -21.810 -6.700 -15.702 443 HB3 GLU 909 HB2 GLU 909 -23.459 -6.979 -16.215 444 HG2 GLU 909 HG1 GLU 909 -22.415 -6.700 -13.383 445 HG3 GLU 909 HG2 GLU 909 -23.399 -5.550 -14.268 446 H MET 910 HN MET 910 -20.031 -8.722 -16.314 447 HA MET 910 HA MET 910 -20.460 -10.014 -18.932 448 HB2 MET 910 HB1 MET 910 -19.437 -7.139 -18.746 449 HB3 MET 910 HB2 MET 910 -19.275 -8.179 -20.158 450 HG2 MET 910 HG1 MET 910 -21.764 -8.380 -20.265 451 HG3 MET 910 HG2 MET 910 -21.884 -7.189 -18.960 452 HE1 MET 910 HE1 MET 910 -23.246 -7.084 -21.917 453 HE2 MET 910 HE2 MET 910 -23.565 -5.906 -20.624 454 HE3 MET 910 HE3 MET 910 -23.099 -5.345 -22.247 455 H SER 911 HN SER 911 -18.617 -11.123 -19.572 456 HA SER 911 HA SER 911 -16.412 -11.386 -17.736 457 HB2 SER 911 HB1 SER 911 -15.384 -12.655 -19.738 458 HB3 SER 911 HB2 SER 911 -16.760 -13.309 -18.880 459 HG SER 911 HG1 SER 911 -17.024 -13.391 -21.186 460 H ASN 912 HN ASN 912 -14.260 -11.103 -18.176 461 HA ASN 912 HA ASN 912 -13.869 -8.369 -18.220 462 HB2 ASN 912 HB1 ASN 912 -11.644 -10.425 -18.518 463 HB3 ASN 912 HB2 ASN 912 -11.485 -8.788 -17.898 464 HD21 ASN 912 HD21 ASN 912 -10.568 -9.585 -15.944 465 HD22 ASN 912 HD22 ASN 912 -11.593 -10.388 -14.749 466 H GLU 913 HN GLU 913 -13.364 -10.555 -20.897 467 HA GLU 913 HA GLU 913 -12.125 -8.602 -22.688 468 HB2 GLU 913 HB1 GLU 913 -12.139 -10.364 -24.304 469 HB3 GLU 913 HB2 GLU 913 -11.576 -11.000 -22.759 470 HG2 GLU 913 HG1 GLU 913 -13.884 -11.923 -22.345 471 HG3 GLU 913 HG2 GLU 913 -14.360 -11.377 -23.953 472 H GLU 914 HN GLU 914 -15.389 -9.144 -21.780 473 HA GLU 914 HA GLU 914 -16.486 -7.952 -24.287 474 HB2 GLU 914 HB1 GLU 914 -17.868 -9.190 -21.870 475 HB3 GLU 914 HB2 GLU 914 -18.690 -8.487 -23.251 476 HG2 GLU 914 HG1 GLU 914 -16.879 -10.938 -23.272 477 HG3 GLU 914 HG2 GLU 914 -18.634 -10.934 -23.375 478 H ILE 915 HN ILE 915 -16.250 -7.362 -20.727 479 HA ILE 915 HA ILE 915 -17.383 -4.714 -20.974 480 HB ILE 915 HB ILE 915 -17.546 -5.562 -18.837 481 HG12 ILE 915 HG11 ILE 915 -16.363 -4.007 -17.369 482 HG13 ILE 915 HG12 ILE 915 -15.201 -3.637 -18.642 483 HG21 ILE 915 HG21 ILE 915 -16.018 -7.312 -18.590 484 HG22 ILE 915 HG22 ILE 915 -14.605 -6.267 -18.868 485 HG23 ILE 915 HG23 ILE 915 -15.559 -6.170 -17.367 486 HD11 ILE 915 HD1 ILE 915 -18.184 -3.051 -18.755 487 HD12 ILE 915 HD2 ILE 915 -16.862 -1.878 -18.450 488 HD13 ILE 915 HD3 ILE 915 -17.026 -2.647 -20.003 489 H ASN 916 HN ASN 916 -13.904 -5.637 -20.786 490 HA ASN 916 HA ASN 916 -12.947 -2.996 -20.944 491 HB2 ASN 916 HB1 ASN 916 -10.801 -3.862 -21.513 492 HB3 ASN 916 HB2 ASN 916 -11.542 -4.963 -20.375 493 HD21 ASN 916 HD21 ASN 916 -9.520 -6.046 -21.424 494 HD22 ASN 916 HD22 ASN 916 -9.886 -7.110 -22.772 495 H GLU 917 HN GLU 917 -14.032 -4.930 -23.616 496 HA GLU 917 HA GLU 917 -13.341 -3.321 -25.841 497 HB2 GLU 917 HB1 GLU 917 -15.310 -5.426 -25.131 498 HB3 GLU 917 HB2 GLU 917 -15.755 -4.441 -26.508 499 HG2 GLU 917 HG1 GLU 917 -13.111 -5.938 -26.173 500 HG3 GLU 917 HG2 GLU 917 -14.492 -6.528 -27.093 501 H GLU 918 HN GLU 918 -15.987 -2.894 -23.509 502 HA GLU 918 HA GLU 918 -17.520 -0.947 -24.982 503 HB2 GLU 918 HB1 GLU 918 -18.309 -2.155 -22.899 504 HB3 GLU 918 HB2 GLU 918 -17.193 -1.174 -21.949 505 HG2 GLU 918 HG1 GLU 918 -19.316 -0.205 -21.704 506 HG3 GLU 918 HG2 GLU 918 -18.387 0.896 -22.696 507 H LEU 919 HN LEU 919 -14.831 -0.579 -22.667 508 HA LEU 919 HA LEU 919 -14.777 2.352 -22.960 509 HB2 LEU 919 HB1 LEU 919 -12.762 0.585 -21.543 510 HB3 LEU 919 HB2 LEU 919 -12.999 2.309 -21.372 511 HG LEU 919 HG LEU 919 -15.505 1.386 -20.677 512 HD11 LEU 919 HD11 LEU 919 -15.130 -0.489 -19.074 513 HD12 LEU 919 HD12 LEU 919 -14.880 -0.976 -20.750 514 HD13 LEU 919 HD13 LEU 919 -13.481 -0.677 -19.705 515 HD21 LEU 919 HD21 LEU 919 -14.736 1.676 -18.324 516 HD22 LEU 919 HD22 LEU 919 -13.056 1.784 -18.920 517 HD23 LEU 919 HD23 LEU 919 -14.231 3.014 -19.413 518 H GLY 920 HN GLY 920 -13.002 -0.425 -24.159 519 HA2 GLY 920 HA1 GLY 920 -11.804 -0.538 -26.207 520 HA3 GLY 920 HA2 GLY 920 -11.616 1.219 -26.228 521 H ILE 921 HN ILE 921 -10.926 -1.127 -23.636 522 HA ILE 921 HA ILE 921 -8.071 -0.236 -23.527 523 HB ILE 921 HB ILE 921 -8.200 -0.224 -21.109 524 HG12 ILE 921 HG11 ILE 921 -11.152 -0.893 -21.445 525 HG13 ILE 921 HG12 ILE 921 -9.905 -1.903 -20.719 526 HG21 ILE 921 HG21 ILE 921 -10.396 1.538 -22.249 527 HG22 ILE 921 HG22 ILE 921 -9.348 1.861 -20.852 528 HG23 ILE 921 HG23 ILE 921 -8.654 1.818 -22.472 529 HD11 ILE 921 HD1 ILE 921 -11.214 -0.902 -18.953 530 HD12 ILE 921 HD2 ILE 921 -9.579 -0.218 -18.912 531 HD13 ILE 921 HD3 ILE 921 -10.934 0.725 -19.583 532 H GLY 922 HN GLY 922 -6.856 -1.713 -21.856 533 HA2 GLY 922 HA1 GLY 922 -7.344 -4.586 -22.380 534 HA3 GLY 922 HA2 GLY 922 -5.845 -3.855 -22.959 535 H GLN 923 HN GLN 923 -7.321 -5.364 -20.450 536 HA GLN 923 HA GLN 923 -5.082 -4.951 -18.574 537 HB2 GLN 923 HB1 GLN 923 -6.472 -4.436 -16.690 538 HB3 GLN 923 HB2 GLN 923 -6.878 -3.320 -17.983 539 HG2 GLN 923 HG1 GLN 923 -8.707 -5.388 -18.415 540 HG3 GLN 923 HG2 GLN 923 -8.547 -5.411 -16.666 541 HE21 GLN 923 HE21 GLN 923 -8.895 -3.133 -15.579 542 HE22 GLN 923 HE22 GLN 923 -10.049 -2.082 -16.388 543 H ASP 924 HN ASP 924 -5.384 -6.467 -16.640 544 HA ASP 924 HA ASP 924 -5.365 -8.493 -15.696 545 HB2 ASP 924 HB1 ASP 924 -7.580 -9.263 -17.615 546 HB3 ASP 924 HB2 ASP 924 -7.053 -10.158 -16.211 547 H GLU 925 HN GLU 925 -4.800 -8.252 -18.922 548 HA GLU 925 HA GLU 925 -3.299 -9.010 -20.404 549 HB2 GLU 925 HB1 GLU 925 -1.918 -8.436 -18.383 550 HB3 GLU 925 HB2 GLU 925 -1.799 -10.164 -18.039 551 HG2 GLU 925 HG1 GLU 925 -0.806 -10.520 -20.298 552 HG3 GLU 925 HG2 GLU 925 -0.923 -8.781 -20.599 553 H ALA 926 HN ALA 926 -3.567 -11.670 -18.101 554 HA ALA 926 HA ALA 926 -3.338 -13.754 -20.205 555 HB1 ALA 926 HB1 ALA 926 -2.151 -14.019 -18.067 556 HB2 ALA 926 HB2 ALA 926 -3.693 -13.942 -17.185 557 HB3 ALA 926 HB3 ALA 926 -3.363 -15.293 -18.292 558 H ASP 927 HN ASP 927 -5.753 -12.707 -17.796 559 HA ASP 927 HA ASP 927 -7.865 -13.297 -17.359 560 HB2 ASP 927 HB1 ASP 927 -8.114 -11.945 -19.481 561 HB3 ASP 927 HB2 ASP 927 -8.305 -13.463 -20.354 562 H ALA 928 HN ALA 928 -5.854 -15.512 -17.864 563 HA ALA 928 HA ALA 928 -7.269 -17.871 -18.688 564 HB1 ALA 928 HB1 ALA 928 -4.827 -17.625 -18.848 565 HB2 ALA 928 HB2 ALA 928 -4.704 -17.538 -17.074 566 HB3 ALA 928 HB3 ALA 928 -5.258 -19.031 -17.857 567 H1 ALA 1 HT1 ALA 1 -8.338 -0.414 -6.262 568 H2 ALA 1 HT2 ALA 1 -7.285 0.814 -6.035 569 H3 ALA 1 HT3 ALA 1 -6.975 -0.665 -5.386 570 HA ALA 1 HA ALA 1 -5.589 -0.347 -7.315 571 HB1 ALA 1 HB1 ALA 1 -6.367 -2.627 -6.832 572 HB2 ALA 1 HB2 ALA 1 -7.855 -2.348 -7.784 573 HB3 ALA 1 HB3 ALA 1 -6.261 -2.387 -8.574 574 H ARG 2 HN ARG 2 -5.779 -0.625 -9.880 575 HA ARG 2 HA ARG 2 -7.243 1.612 -10.988 576 HB2 ARG 2 HB1 ARG 2 -6.439 0.973 -13.070 577 HB3 ARG 2 HB2 ARG 2 -5.120 0.632 -11.971 578 HG2 ARG 2 HG1 ARG 2 -5.259 -1.665 -12.302 579 HG3 ARG 2 HG2 ARG 2 -6.970 -1.668 -12.684 580 HD2 ARG 2 HD1 ARG 2 -4.766 -0.711 -14.521 581 HD3 ARG 2 HD2 ARG 2 -5.695 -2.194 -14.671 582 HE ARG 2 HE ARG 2 -7.755 -0.658 -14.879 583 HH11 ARG 2 HH11 ARG 2 -4.655 0.525 -16.027 584 HH12 ARG 2 HH12 ARG 2 -5.392 1.359 -17.366 585 HH21 ARG 2 HH21 ARG 2 -8.598 0.820 -16.274 586 HH22 ARG 2 HH22 ARG 2 -7.570 1.552 -17.472 587 H THR 3 HN THR 3 -8.849 1.484 -12.722 588 HA THR 3 HA THR 3 -10.298 -0.944 -13.165 589 HB THR 3 HB THR 3 -11.225 -0.445 -10.923 590 HG1 THR 3 HG1 THR 3 -12.596 -1.415 -12.415 591 HG21 THR 3 HG21 THR 3 -12.395 2.124 -12.072 592 HG22 THR 3 HG22 THR 3 -12.602 1.457 -10.445 593 HG23 THR 3 HG23 THR 3 -11.020 2.052 -10.947 594 H MLZ 4 HN MLZ 4 -12.826 0.682 -13.738 595 HA MLZ 4 HA MLZ 4 -12.087 1.772 -16.406 596 HB2 MLZ 4 HB1 MLZ 4 -14.422 -0.084 -16.229 597 HB3 MLZ 4 HB2 MLZ 4 -13.204 0.068 -17.478 598 HG2 MLZ 4 HG1 MLZ 4 -11.711 -1.416 -16.319 599 HG3 MLZ 4 HG2 MLZ 4 -12.805 -1.513 -14.919 600 HD2 MLZ 4 HD1 MLZ 4 -14.562 -2.481 -16.245 601 HD3 MLZ 4 HD2 MLZ 4 -13.642 -2.252 -17.728 602 HE2 MLZ 4 HE1 MLZ 4 -12.138 -3.864 -15.769 603 HE3 MLZ 4 HE2 MLZ 4 -13.734 -4.547 -16.043 604 HZ MLZ 4 HZ1 MLZ 4 -11.738 -3.911 -18.179 605 HCM1 MLZ 4 HC1 MLZ 4 -11.753 -6.350 -18.495 606 HCM2 MLZ 4 HC2 MLZ 4 -11.178 -5.874 -16.889 607 HCM3 MLZ 4 HC3 MLZ 4 -12.832 -6.457 -17.086 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.249 -4.457 -18.482 609 H GLN 5 HN GLN 5 -13.181 3.735 -16.699 610 HA GLN 5 HA GLN 5 -15.216 4.502 -14.772 611 HB2 GLN 5 HB1 GLN 5 -15.061 6.657 -15.624 612 HB3 GLN 5 HB2 GLN 5 -13.430 5.980 -15.571 613 HG2 GLN 5 HG1 GLN 5 -13.604 5.525 -18.062 614 HG3 GLN 5 HG2 GLN 5 -15.170 6.340 -18.060 615 HE21 GLN 5 HE21 GLN 5 -13.811 7.590 -19.790 616 HE22 GLN 5 HE22 GLN 5 -12.954 8.992 -19.165 617 H THR 6 HN THR 6 -15.435 3.288 -17.983 618 HA THR 6 HA THR 6 -16.977 2.946 -19.521 619 HB THR 6 HB THR 6 -19.496 2.725 -18.374 620 HG1 THR 6 HG1 THR 6 -18.612 2.982 -16.320 621 HG21 THR 6 HG21 THR 6 -19.110 0.357 -18.562 622 HG22 THR 6 HG22 THR 6 -18.338 1.164 -19.926 623 HG23 THR 6 HG23 THR 6 -17.338 0.601 -18.570 624 H ALA 7 HN ALA 7 -18.907 3.484 -20.726 625 HA ALA 7 HA ALA 7 -19.826 6.293 -20.439 626 HB1 ALA 7 HB1 ALA 7 -18.592 5.084 -22.950 627 HB2 ALA 7 HB2 ALA 7 -19.247 6.728 -22.785 628 HB3 ALA 7 HB3 ALA 7 -17.804 6.260 -21.873 629 H ARG 8 HN ARG 8 -21.109 3.481 -20.187 630 HA ARG 8 HA ARG 8 -23.270 3.598 -22.183 631 HB2 ARG 8 HB1 ARG 8 -23.822 1.362 -21.360 632 HB3 ARG 8 HB2 ARG 8 -22.167 1.431 -21.933 633 HG2 ARG 8 HG1 ARG 8 -21.269 1.371 -19.701 634 HG3 ARG 8 HG2 ARG 8 -22.845 1.708 -18.976 635 HD2 ARG 8 HD1 ARG 8 -22.258 -0.609 -18.658 636 HD3 ARG 8 HD2 ARG 8 -23.695 -0.473 -19.681 637 HE ARG 8 HE ARG 8 -21.766 -0.686 -21.581 638 HH11 ARG 8 HH11 ARG 8 -22.361 -2.731 -18.784 639 HH12 ARG 8 HH12 ARG 8 -21.657 -4.117 -19.580 640 HH21 ARG 8 HH21 ARG 8 -20.992 -2.408 -22.491 641 HH22 ARG 8 HH22 ARG 8 -20.888 -3.953 -21.649 642 H TYR 9 HN TYR 9 -25.135 2.653 -20.930 643 HA TYR 9 HA TYR 9 -26.016 4.021 -18.496 644 HB2 TYR 9 HB1 TYR 9 -27.865 5.253 -19.555 645 HB3 TYR 9 HB2 TYR 9 -26.294 5.847 -20.037 646 HD1 TYR 9 HD1 TYR 9 -25.518 5.695 -22.349 647 HD2 TYR 9 HD2 TYR 9 -29.325 4.046 -21.171 648 HE1 TYR 9 HE1 TYR 9 -26.177 5.496 -24.748 649 HE2 TYR 9 HE2 TYR 9 -29.985 3.853 -23.566 650 HH TYR 9 HH TYR 9 -29.363 4.188 -25.743 Start of MODEL 12 1 H1 GLY 850 HT1 GLY 850 -0.559 2.876 -2.829 2 H2 GLY 850 HT2 GLY 850 0.583 2.314 -1.794 3 H3 GLY 850 HT3 GLY 850 -0.910 1.626 -1.833 4 HA2 GLY 850 HA1 GLY 850 1.032 1.585 -4.061 5 HA3 GLY 850 HA2 GLY 850 0.737 0.234 -2.951 6 H SER 851 HN SER 851 0.223 -0.980 -4.896 7 HA SER 851 HA SER 851 -2.660 -1.135 -5.295 8 HB2 SER 851 HB1 SER 851 -2.137 0.443 -7.082 9 HB3 SER 851 HB2 SER 851 -0.833 -0.600 -7.672 10 HG SER 851 HG1 SER 851 -2.898 -0.745 -8.785 11 H ARG 852 HN ARG 852 -3.289 -3.176 -6.164 12 HA ARG 852 HA ARG 852 -1.489 -5.448 -5.714 13 HB2 ARG 852 HB1 ARG 852 -4.234 -5.182 -7.028 14 HB3 ARG 852 HB2 ARG 852 -3.409 -6.719 -6.813 15 HG2 ARG 852 HG1 ARG 852 -4.344 -4.895 -4.560 16 HG3 ARG 852 HG2 ARG 852 -5.108 -6.377 -5.141 17 HD2 ARG 852 HD1 ARG 852 -2.757 -7.472 -4.596 18 HD3 ARG 852 HD2 ARG 852 -2.583 -6.057 -3.538 19 HE ARG 852 HE ARG 852 -5.115 -7.598 -3.354 20 HH11 ARG 852 HH11 ARG 852 -1.964 -7.266 -1.845 21 HH12 ARG 852 HH12 ARG 852 -2.491 -8.128 -0.423 22 HH21 ARG 852 HH21 ARG 852 -5.688 -8.634 -1.645 23 HH22 ARG 852 HH22 ARG 852 -4.593 -8.908 -0.305 24 H ARG 853 HN ARG 853 -2.403 -3.552 -8.526 25 HA ARG 853 HA ARG 853 -1.001 -5.497 -10.356 26 HB2 ARG 853 HB1 ARG 853 -3.547 -3.924 -10.934 27 HB3 ARG 853 HB2 ARG 853 -2.715 -5.006 -12.038 28 HG2 ARG 853 HG1 ARG 853 -4.166 -5.769 -9.475 29 HG3 ARG 853 HG2 ARG 853 -4.686 -6.057 -11.133 30 HD2 ARG 853 HD1 ARG 853 -2.607 -7.514 -11.428 31 HD3 ARG 853 HD2 ARG 853 -2.332 -7.348 -9.703 32 HE ARG 853 HE ARG 853 -4.153 -8.733 -9.232 33 HH11 ARG 853 HH11 ARG 853 -4.033 -8.230 -12.758 34 HH12 ARG 853 HH12 ARG 853 -5.174 -9.567 -12.971 35 HH21 ARG 853 HH21 ARG 853 -5.708 -10.326 -9.769 36 HH22 ARG 853 HH22 ARG 853 -5.984 -10.620 -11.486 37 H ALA 854 HN ALA 854 -2.256 -2.161 -10.511 38 HA ALA 854 HA ALA 854 0.277 -1.033 -11.419 39 HB1 ALA 854 HB1 ALA 854 -0.618 -0.373 -13.653 40 HB2 ALA 854 HB2 ALA 854 -0.526 -2.134 -13.499 41 HB3 ALA 854 HB3 ALA 854 -2.093 -1.311 -13.340 42 H SER 855 HN SER 855 -0.039 1.353 -11.972 43 HA SER 855 HA SER 855 -1.834 2.665 -10.100 44 HB2 SER 855 HB1 SER 855 -1.105 4.758 -11.173 45 HB3 SER 855 HB2 SER 855 0.176 3.794 -10.475 46 HG SER 855 HG1 SER 855 0.979 3.387 -12.454 47 H VAL 856 HN VAL 856 -3.363 4.281 -10.664 48 HA VAL 856 HA VAL 856 -5.355 3.194 -12.516 49 HB VAL 856 HB VAL 856 -6.828 5.003 -11.818 50 HG11 VAL 856 HG11 VAL 856 -5.495 3.524 -9.534 51 HG12 VAL 856 HG12 VAL 856 -7.108 4.270 -9.500 52 HG13 VAL 856 HG13 VAL 856 -6.783 2.917 -10.596 53 HG21 VAL 856 HG21 VAL 856 -5.236 6.814 -11.439 54 HG22 VAL 856 HG22 VAL 856 -6.264 6.539 -10.029 55 HG23 VAL 856 HG23 VAL 856 -4.584 5.966 -10.019 56 H GLY 857 HN GLY 857 -6.531 4.402 -14.062 57 HA2 GLY 857 HA1 GLY 857 -4.786 5.730 -16.035 58 HA3 GLY 857 HA2 GLY 857 -6.453 5.195 -16.272 59 H SER 858 HN SER 858 -4.794 7.475 -14.052 60 HA SER 858 HA SER 858 -5.364 9.466 -13.158 61 HB2 SER 858 HB1 SER 858 -5.258 10.236 -15.541 62 HB3 SER 858 HB2 SER 858 -7.022 10.063 -15.621 63 HG SER 858 HG1 SER 858 -6.236 12.205 -15.056 64 H GLU 859 HN GLU 859 -7.787 10.839 -13.186 65 HA GLU 859 HA GLU 859 -9.311 9.468 -11.169 66 HB2 GLU 859 HB1 GLU 859 -10.691 11.415 -11.138 67 HB3 GLU 859 HB2 GLU 859 -9.018 11.931 -11.345 68 HG2 GLU 859 HG1 GLU 859 -9.461 12.128 -13.831 69 HG3 GLU 859 HG2 GLU 859 -11.168 11.817 -13.502 70 H PHE 860 HN PHE 860 -11.836 9.563 -11.398 71 HA PHE 860 HA PHE 860 -12.803 8.286 -13.835 72 HB2 PHE 860 HB1 PHE 860 -13.406 7.050 -11.247 73 HB3 PHE 860 HB2 PHE 860 -13.799 6.454 -12.833 74 HD1 PHE 860 HD1 PHE 860 -11.690 5.901 -10.073 75 HD2 PHE 860 HD2 PHE 860 -11.599 5.982 -14.378 76 HE1 PHE 860 HE1 PHE 860 -9.748 4.356 -10.060 77 HE2 PHE 860 HE2 PHE 860 -9.645 4.448 -14.367 78 HZ PHE 860 HZ PHE 860 -8.736 3.613 -12.210 79 H THR 861 HN THR 861 -13.801 9.802 -14.101 80 HA THR 861 HA THR 861 -16.014 11.081 -12.594 81 HB THR 861 HB THR 861 -16.602 12.051 -14.950 82 HG1 THR 861 HG1 THR 861 -15.256 10.786 -16.205 83 HG21 THR 861 HG21 THR 861 -15.740 13.320 -13.093 84 HG22 THR 861 HG22 THR 861 -14.068 12.812 -13.460 85 HG23 THR 861 HG23 THR 861 -14.966 13.842 -14.605 86 H GLU 862 HN GLU 862 -18.135 10.966 -13.009 87 HA GLU 862 HA GLU 862 -20.121 9.875 -13.135 88 HB2 GLU 862 HB1 GLU 862 -19.094 8.865 -15.804 89 HB3 GLU 862 HB2 GLU 862 -20.762 8.806 -15.226 90 HG2 GLU 862 HG1 GLU 862 -20.841 11.256 -15.058 91 HG3 GLU 862 HG2 GLU 862 -19.167 11.364 -15.602 92 H SER 863 HN SER 863 -21.260 7.594 -13.614 93 HA SER 863 HA SER 863 -20.325 5.821 -11.597 94 HB2 SER 863 HB1 SER 863 -22.300 5.318 -13.844 95 HB3 SER 863 HB2 SER 863 -22.052 4.279 -12.421 96 HG SER 863 HG1 SER 863 -23.790 5.860 -12.202 97 H ALA 864 HN ALA 864 -19.240 3.922 -11.603 98 HA ALA 864 HA ALA 864 -17.515 3.483 -14.034 99 HB1 ALA 864 HB1 ALA 864 -16.670 3.878 -11.140 100 HB2 ALA 864 HB2 ALA 864 -15.580 3.636 -12.522 101 HB3 ALA 864 HB3 ALA 864 -16.553 5.113 -12.415 102 H TRP 865 HN TRP 865 -15.834 1.599 -13.402 103 HA TRP 865 HA TRP 865 -17.328 -0.629 -12.051 104 HB2 TRP 865 HB1 TRP 865 -15.019 -0.718 -13.974 105 HB3 TRP 865 HB2 TRP 865 -15.630 -2.101 -13.089 106 HD1 TRP 865 HD1 TRP 865 -16.840 0.441 -15.715 107 HE1 TRP 865 HE1 TRP 865 -18.634 -0.602 -17.182 108 HE3 TRP 865 HE3 TRP 865 -17.178 -4.050 -13.360 109 HZ2 TRP 865 HZ2 TRP 865 -20.123 -3.143 -17.261 110 HZ3 TRP 865 HZ3 TRP 865 -18.715 -5.851 -14.228 111 HH2 TRP 865 HH2 TRP 865 -20.184 -5.383 -16.124 112 H VAL 866 HN VAL 866 -15.919 -2.049 -10.785 113 HA VAL 866 HA VAL 866 -13.423 -0.913 -9.723 114 HB VAL 866 HB VAL 866 -15.089 -0.101 -8.166 115 HG11 VAL 866 HG11 VAL 866 -15.675 -3.013 -7.479 116 HG12 VAL 866 HG12 VAL 866 -16.354 -1.566 -6.705 117 HG13 VAL 866 HG13 VAL 866 -16.765 -1.950 -8.381 118 HG21 VAL 866 HG21 VAL 866 -13.387 -2.248 -6.862 119 HG22 VAL 866 HG22 VAL 866 -12.804 -0.648 -7.388 120 HG23 VAL 866 HG23 VAL 866 -14.038 -0.777 -6.125 121 H ARG 867 HN ARG 867 -11.967 -2.447 -9.027 122 HA ARG 867 HA ARG 867 -12.491 -5.249 -9.884 123 HB2 ARG 867 HB1 ARG 867 -10.519 -3.651 -10.676 124 HB3 ARG 867 HB2 ARG 867 -9.802 -4.138 -9.160 125 HG2 ARG 867 HG1 ARG 867 -10.139 -6.568 -9.934 126 HG3 ARG 867 HG2 ARG 867 -10.656 -5.908 -11.487 127 HD2 ARG 867 HD1 ARG 867 -8.492 -6.255 -12.023 128 HD3 ARG 867 HD2 ARG 867 -8.279 -4.642 -11.352 129 HE ARG 867 HE ARG 867 -7.420 -7.238 -10.240 130 HH11 ARG 867 HH11 ARG 867 -7.786 -3.828 -9.442 131 HH12 ARG 867 HH12 ARG 867 -7.200 -4.143 -7.793 132 HH21 ARG 867 HH21 ARG 867 -6.703 -7.400 -8.093 133 HH22 ARG 867 HH22 ARG 867 -6.538 -5.909 -7.176 134 H CYS 868 HN CYS 868 -12.261 -6.957 -8.475 135 HA CYS 868 HA CYS 868 -11.975 -6.556 -5.637 136 HB2 CYS 868 HB1 CYS 868 -13.354 -8.324 -6.596 137 HB3 CYS 868 HB2 CYS 868 -11.940 -9.030 -7.384 138 H ASP 869 HN ASP 869 -10.149 -6.059 -4.653 139 HA ASP 869 HA ASP 869 -7.491 -6.882 -5.597 140 HB2 ASP 869 HB1 ASP 869 -8.523 -5.390 -3.188 141 HB3 ASP 869 HB2 ASP 869 -6.842 -5.825 -3.341 142 H ASP 870 HN ASP 870 -9.765 -8.829 -4.320 143 HA ASP 870 HA ASP 870 -7.703 -10.381 -2.856 144 HB2 ASP 870 HB1 ASP 870 -9.933 -9.951 -1.724 145 HB3 ASP 870 HB2 ASP 870 -10.662 -11.023 -2.917 146 H CYS 871 HN CYS 871 -9.854 -10.408 -5.675 147 HA CYS 871 HA CYS 871 -8.127 -12.493 -6.846 148 HB2 CYS 871 HB1 CYS 871 -9.841 -13.682 -7.860 149 HB3 CYS 871 HB2 CYS 871 -10.231 -13.554 -6.162 150 H PHE 872 HN PHE 872 -10.666 -11.120 -8.592 151 HA PHE 872 HA PHE 872 -9.248 -8.906 -9.874 152 HB2 PHE 872 HB1 PHE 872 -9.073 -9.819 -12.055 153 HB3 PHE 872 HB2 PHE 872 -8.294 -10.956 -10.972 154 HD1 PHE 872 HD1 PHE 872 -11.251 -10.366 -13.143 155 HD2 PHE 872 HD2 PHE 872 -9.221 -13.210 -10.614 156 HE1 PHE 872 HE1 PHE 872 -12.724 -12.178 -14.000 157 HE2 PHE 872 HE2 PHE 872 -10.683 -15.020 -11.485 158 HZ PHE 872 HZ PHE 872 -12.433 -14.507 -13.176 159 H LYS 873 HN LYS 873 -12.155 -10.647 -9.306 160 HA LYS 873 HA LYS 873 -14.009 -10.164 -11.204 161 HB2 LYS 873 HB1 LYS 873 -14.246 -11.062 -8.764 162 HB3 LYS 873 HB2 LYS 873 -14.922 -9.418 -8.529 163 HG2 LYS 873 HG1 LYS 873 -16.300 -9.804 -10.631 164 HG3 LYS 873 HG2 LYS 873 -15.725 -11.491 -10.614 165 HD2 LYS 873 HD1 LYS 873 -17.086 -10.180 -8.309 166 HD3 LYS 873 HD2 LYS 873 -17.993 -10.909 -9.653 167 HE2 LYS 873 HE1 LYS 873 -15.855 -12.367 -8.074 168 HE3 LYS 873 HE2 LYS 873 -17.581 -12.456 -7.633 169 HZ1 LYS 873 HZ1 LYS 873 -17.936 -13.283 -9.960 170 HZ2 LYS 873 HZ2 LYS 873 -16.318 -13.397 -10.154 171 HZ3 LYS 873 HZ3 LYS 873 -17.072 -14.327 -9.044 172 H TRP 874 HN TRP 874 -15.125 -8.653 -12.131 173 HA TRP 874 HA TRP 874 -14.743 -5.819 -11.323 174 HB2 TRP 874 HB1 TRP 874 -15.737 -6.909 -13.958 175 HB3 TRP 874 HB2 TRP 874 -15.364 -5.240 -13.588 176 HD1 TRP 874 HD1 TRP 874 -13.657 -8.425 -14.639 177 HE1 TRP 874 HE1 TRP 874 -11.149 -7.996 -15.046 178 HE3 TRP 874 HE3 TRP 874 -13.344 -3.723 -12.686 179 HZ2 TRP 874 HZ2 TRP 874 -9.257 -5.873 -14.548 180 HZ3 TRP 874 HZ3 TRP 874 -11.151 -2.560 -12.650 181 HH2 TRP 874 HH2 TRP 874 -9.134 -3.570 -13.559 182 H ARG 875 HN ARG 875 -16.443 -4.480 -10.956 183 HA ARG 875 HA ARG 875 -19.261 -5.406 -11.206 184 HB2 ARG 875 HB1 ARG 875 -17.967 -4.427 -8.614 185 HB3 ARG 875 HB2 ARG 875 -19.702 -4.480 -8.869 186 HG2 ARG 875 HG1 ARG 875 -17.815 -6.873 -8.809 187 HG3 ARG 875 HG2 ARG 875 -18.953 -6.395 -7.562 188 HD2 ARG 875 HD1 ARG 875 -19.627 -7.459 -10.302 189 HD3 ARG 875 HD2 ARG 875 -19.849 -8.261 -8.750 190 HE ARG 875 HE ARG 875 -21.389 -5.987 -8.462 191 HH11 ARG 875 HH11 ARG 875 -21.338 -8.457 -10.959 192 HH12 ARG 875 HH12 ARG 875 -22.995 -8.067 -11.426 193 HH21 ARG 875 HH21 ARG 875 -23.592 -5.757 -9.096 194 HH22 ARG 875 HH22 ARG 875 -24.085 -6.620 -10.562 195 H ARG 876 HN ARG 876 -20.628 -3.789 -11.752 196 HA ARG 876 HA ARG 876 -19.555 -1.076 -12.250 197 HB2 ARG 876 HB1 ARG 876 -21.218 -2.625 -13.709 198 HB3 ARG 876 HB2 ARG 876 -22.425 -1.716 -12.805 199 HG2 ARG 876 HG1 ARG 876 -20.117 -0.492 -14.394 200 HG3 ARG 876 HG2 ARG 876 -21.730 -0.757 -15.053 201 HD2 ARG 876 HD1 ARG 876 -22.698 0.836 -13.463 202 HD3 ARG 876 HD2 ARG 876 -21.153 0.960 -12.628 203 HE ARG 876 HE ARG 876 -20.328 2.398 -14.204 204 HH11 ARG 876 HH11 ARG 876 -23.233 1.035 -15.615 205 HH12 ARG 876 HH12 ARG 876 -23.227 2.176 -16.930 206 HH21 ARG 876 HH21 ARG 876 -20.481 3.926 -15.814 207 HH22 ARG 876 HH22 ARG 876 -21.710 3.769 -17.028 208 H ILE 877 HN ILE 877 -19.750 0.539 -10.969 209 HA ILE 877 HA ILE 877 -21.604 0.525 -8.630 210 HB ILE 877 HB ILE 877 -19.795 1.534 -7.315 211 HG12 ILE 877 HG11 ILE 877 -17.948 0.978 -9.675 212 HG13 ILE 877 HG12 ILE 877 -18.525 2.570 -9.227 213 HG21 ILE 877 HG21 ILE 877 -20.214 -0.946 -7.364 214 HG22 ILE 877 HG22 ILE 877 -18.879 -1.100 -8.519 215 HG23 ILE 877 HG23 ILE 877 -18.584 -0.505 -6.860 216 HD11 ILE 877 HD1 ILE 877 -16.226 2.081 -8.439 217 HD12 ILE 877 HD2 ILE 877 -17.350 2.593 -7.179 218 HD13 ILE 877 HD3 ILE 877 -16.896 0.889 -7.309 219 HA PRO 878 HA PRO 878 -22.284 4.811 -9.863 220 HB2 PRO 878 HB1 PRO 878 -23.068 6.001 -7.533 221 HB3 PRO 878 HB2 PRO 878 -24.106 4.823 -8.393 222 HG2 PRO 878 HG1 PRO 878 -22.237 4.295 -6.058 223 HG3 PRO 878 HG2 PRO 878 -23.954 3.811 -6.224 224 HD2 PRO 878 HD1 PRO 878 -21.901 2.111 -6.812 225 HD3 PRO 878 HD2 PRO 878 -23.421 2.096 -7.753 226 H ALA 879 HN ALA 879 -21.164 6.738 -9.846 227 HA ALA 879 HA ALA 879 -18.522 6.999 -9.134 228 HB1 ALA 879 HB1 ALA 879 -19.885 8.539 -10.590 229 HB2 ALA 879 HB2 ALA 879 -20.607 9.233 -9.130 230 HB3 ALA 879 HB3 ALA 879 -18.864 9.411 -9.433 231 H SER 880 HN SER 880 -21.238 7.422 -6.925 232 HA SER 880 HA SER 880 -19.996 8.803 -4.779 233 HB2 SER 880 HB1 SER 880 -22.109 6.617 -4.606 234 HB3 SER 880 HB2 SER 880 -21.782 7.887 -3.411 235 HG SER 880 HG1 SER 880 -23.554 8.444 -4.740 236 H VAL 881 HN VAL 881 -19.675 5.455 -5.824 237 HA VAL 881 HA VAL 881 -18.097 4.735 -3.402 238 HB VAL 881 HB VAL 881 -19.040 3.049 -5.745 239 HG11 VAL 881 HG11 VAL 881 -16.903 2.132 -4.835 240 HG12 VAL 881 HG12 VAL 881 -17.625 2.126 -3.209 241 HG13 VAL 881 HG13 VAL 881 -18.278 1.084 -4.490 242 HG21 VAL 881 HG21 VAL 881 -20.869 3.657 -4.203 243 HG22 VAL 881 HG22 VAL 881 -20.486 1.937 -4.088 244 HG23 VAL 881 HG23 VAL 881 -19.917 3.057 -2.829 245 H VAL 882 HN VAL 882 -17.738 5.285 -6.908 246 HA VAL 882 HA VAL 882 -14.980 4.489 -6.829 247 HB VAL 882 HB VAL 882 -16.616 4.841 -8.894 248 HG11 VAL 882 HG11 VAL 882 -16.082 6.697 -10.294 249 HG12 VAL 882 HG12 VAL 882 -16.473 7.399 -8.713 250 HG13 VAL 882 HG13 VAL 882 -14.789 7.251 -9.216 251 HG21 VAL 882 HG21 VAL 882 -14.518 3.590 -8.966 252 HG22 VAL 882 HG22 VAL 882 -14.557 4.699 -10.345 253 HG23 VAL 882 HG23 VAL 882 -13.576 5.089 -8.925 254 H GLY 883 HN GLY 883 -16.495 7.401 -5.880 255 HA2 GLY 883 HA1 GLY 883 -14.067 9.050 -5.728 256 HA3 GLY 883 HA2 GLY 883 -15.658 9.413 -5.052 257 H SER 884 HN SER 884 -15.476 6.582 -3.733 258 HA SER 884 HA SER 884 -14.051 7.421 -1.260 259 HB2 SER 884 HB1 SER 884 -16.383 6.657 -1.090 260 HB3 SER 884 HB2 SER 884 -15.936 5.100 -1.812 261 HG SER 884 HG1 SER 884 -16.002 5.079 0.514 262 H ILE 885 HN ILE 885 -14.112 4.795 -3.669 263 HA ILE 885 HA ILE 885 -11.838 3.350 -2.529 264 HB ILE 885 HB ILE 885 -13.571 3.065 -4.991 265 HG12 ILE 885 HG11 ILE 885 -14.082 0.880 -4.122 266 HG13 ILE 885 HG12 ILE 885 -12.873 1.005 -2.843 267 HG21 ILE 885 HG21 ILE 885 -11.373 2.494 -5.866 268 HG22 ILE 885 HG22 ILE 885 -11.030 1.473 -4.449 269 HG23 ILE 885 HG23 ILE 885 -12.298 1.023 -5.613 270 HD11 ILE 885 HD1 ILE 885 -15.342 2.759 -3.020 271 HD12 ILE 885 HD2 ILE 885 -15.261 1.257 -2.101 272 HD13 ILE 885 HD3 ILE 885 -14.219 2.614 -1.644 273 H ASP 886 HN ASP 886 -9.835 4.034 -2.662 274 HA ASP 886 HA ASP 886 -8.853 5.689 -4.933 275 HB2 ASP 886 HB1 ASP 886 -7.505 4.853 -2.339 276 HB3 ASP 886 HB2 ASP 886 -6.819 5.918 -3.554 277 H GLU 887 HN GLU 887 -6.579 5.107 -5.650 278 HA GLU 887 HA GLU 887 -6.307 2.632 -6.942 279 HB2 GLU 887 HB1 GLU 887 -5.011 4.641 -7.446 280 HB3 GLU 887 HB2 GLU 887 -4.219 4.574 -5.871 281 HG2 GLU 887 HG1 GLU 887 -3.130 2.442 -6.481 282 HG3 GLU 887 HG2 GLU 887 -3.921 2.472 -8.056 283 H SER 888 HN SER 888 -5.265 3.529 -3.652 284 HA SER 888 HA SER 888 -4.123 0.865 -3.139 285 HB2 SER 888 HB1 SER 888 -3.123 3.135 -2.489 286 HB3 SER 888 HB2 SER 888 -4.306 3.123 -1.176 287 HG SER 888 HG1 SER 888 -3.392 1.163 -0.451 288 H SER 889 HN SER 889 -7.279 2.174 -2.750 289 HA SER 889 HA SER 889 -7.953 0.977 -0.202 290 HB2 SER 889 HB1 SER 889 -9.774 1.820 -2.479 291 HB3 SER 889 HB2 SER 889 -10.282 1.422 -0.828 292 HG SER 889 HG1 SER 889 -9.122 3.201 -0.070 293 H ARG 890 HN ARG 890 -8.279 -1.089 0.244 294 HA ARG 890 HA ARG 890 -8.338 -3.123 -1.843 295 HB2 ARG 890 HB1 ARG 890 -7.011 -3.199 0.274 296 HB3 ARG 890 HB2 ARG 890 -8.517 -3.476 1.159 297 HG2 ARG 890 HG1 ARG 890 -8.888 -5.557 -0.184 298 HG3 ARG 890 HG2 ARG 890 -7.379 -5.258 -1.054 299 HD2 ARG 890 HD1 ARG 890 -7.592 -5.685 1.950 300 HD3 ARG 890 HD2 ARG 890 -7.214 -6.956 0.773 301 HE ARG 890 HE ARG 890 -5.373 -4.851 0.339 302 HH11 ARG 890 HH11 ARG 890 -6.024 -7.174 2.878 303 HH12 ARG 890 HH12 ARG 890 -4.374 -7.168 3.434 304 HH21 ARG 890 HH21 ARG 890 -3.287 -4.873 1.114 305 HH22 ARG 890 HH22 ARG 890 -2.872 -5.893 2.458 306 H TRP 891 HN TRP 891 -10.282 -2.394 -2.785 307 HA TRP 891 HA TRP 891 -12.882 -3.117 -1.571 308 HB2 TRP 891 HB1 TRP 891 -12.642 -1.238 -3.193 309 HB3 TRP 891 HB2 TRP 891 -12.280 -2.419 -4.452 310 HD1 TRP 891 HD1 TRP 891 -15.012 -0.712 -2.668 311 HE1 TRP 891 HE1 TRP 891 -17.301 -1.358 -3.592 312 HE3 TRP 891 HE3 TRP 891 -13.643 -4.857 -5.342 313 HZ2 TRP 891 HZ2 TRP 891 -18.468 -3.696 -4.837 314 HZ3 TRP 891 HZ3 TRP 891 -15.410 -6.349 -6.292 315 HH2 TRP 891 HH2 TRP 891 -17.787 -5.811 -5.967 316 H ILE 892 HN ILE 892 -13.864 -5.127 -1.779 317 HA ILE 892 HA ILE 892 -12.716 -7.128 -3.681 318 HB ILE 892 HB ILE 892 -12.581 -8.771 -1.909 319 HG12 ILE 892 HG11 ILE 892 -13.138 -6.600 0.144 320 HG13 ILE 892 HG12 ILE 892 -14.397 -7.683 -0.474 321 HG21 ILE 892 HG21 ILE 892 -10.562 -7.368 -2.411 322 HG22 ILE 892 HG22 ILE 892 -11.001 -6.308 -1.060 323 HG23 ILE 892 HG23 ILE 892 -10.583 -7.994 -0.757 324 HD11 ILE 892 HD1 ILE 892 -13.195 -9.623 0.265 325 HD12 ILE 892 HD2 ILE 892 -11.949 -8.577 1.023 326 HD13 ILE 892 HD3 ILE 892 -13.636 -8.509 1.586 327 H CYS 893 HN CYS 893 -14.043 -9.120 -3.930 328 HA CYS 893 HA CYS 893 -16.745 -8.763 -4.352 329 HB2 CYS 893 HB1 CYS 893 -15.355 -11.345 -3.514 330 HB3 CYS 893 HB2 CYS 893 -16.961 -11.185 -4.244 331 H MET 894 HN MET 894 -15.302 -9.878 -1.179 332 HA MET 894 HA MET 894 -17.873 -10.583 -0.099 333 HB2 MET 894 HB1 MET 894 -16.037 -11.643 0.814 334 HB3 MET 894 HB2 MET 894 -15.137 -10.166 1.068 335 HG2 MET 894 HG1 MET 894 -17.638 -10.758 2.643 336 HG3 MET 894 HG2 MET 894 -16.043 -11.366 3.096 337 HE1 MET 894 HE1 MET 894 -16.730 -8.580 5.768 338 HE2 MET 894 HE2 MET 894 -17.950 -9.608 4.985 339 HE3 MET 894 HE3 MET 894 -16.395 -10.305 5.497 340 H ASN 895 HN ASN 895 -16.331 -7.448 -0.384 341 HA ASN 895 HA ASN 895 -18.189 -6.224 1.560 342 HB2 ASN 895 HB1 ASN 895 -16.913 -4.280 1.386 343 HB3 ASN 895 HB2 ASN 895 -15.807 -5.651 1.540 344 HD21 ASN 895 HD21 ASN 895 -17.241 -4.382 -1.535 345 HD22 ASN 895 HD22 ASN 895 -15.673 -3.926 -2.145 346 H ASN 896 HN ASN 896 -18.331 -7.027 -1.616 347 HA ASN 896 HA ASN 896 -19.634 -4.915 -2.959 348 HB2 ASN 896 HB1 ASN 896 -18.829 -7.051 -4.003 349 HB3 ASN 896 HB2 ASN 896 -20.187 -7.891 -3.245 350 HD21 ASN 896 HD21 ASN 896 -20.334 -8.489 -5.653 351 HD22 ASN 896 HD22 ASN 896 -21.538 -7.511 -6.479 352 H SER 897 HN SER 897 -21.609 -4.080 -3.021 353 HA SER 897 HA SER 897 -23.632 -4.402 -1.024 354 HB2 SER 897 HB1 SER 897 -23.605 -3.257 -3.847 355 HB3 SER 897 HB2 SER 897 -25.001 -3.158 -2.787 356 HG SER 897 HG1 SER 897 -23.769 -1.917 -1.334 357 H ASP 898 HN ASP 898 -23.309 -5.700 -4.290 358 HA ASP 898 HA ASP 898 -25.997 -6.878 -4.270 359 HB2 ASP 898 HB1 ASP 898 -23.898 -7.303 -6.394 360 HB3 ASP 898 HB2 ASP 898 -25.635 -7.474 -6.536 361 H LYS 899 HN LYS 899 -26.202 -8.506 -2.939 362 HA LYS 899 HA LYS 899 -24.367 -10.486 -2.181 363 HB2 LYS 899 HB1 LYS 899 -27.413 -10.645 -2.258 364 HB3 LYS 899 HB2 LYS 899 -26.354 -11.721 -1.348 365 HG2 LYS 899 HG1 LYS 899 -26.207 -8.730 -0.868 366 HG3 LYS 899 HG2 LYS 899 -27.502 -9.675 -0.146 367 HD2 LYS 899 HD1 LYS 899 -24.611 -10.518 0.136 368 HD3 LYS 899 HD2 LYS 899 -25.376 -9.350 1.246 369 HE2 LYS 899 HE1 LYS 899 -27.131 -11.009 1.787 370 HE3 LYS 899 HE2 LYS 899 -26.392 -12.170 0.682 371 HZ1 LYS 899 HZ1 LYS 899 -25.087 -11.069 3.119 372 HZ2 LYS 899 HZ2 LYS 899 -25.707 -12.572 2.981 373 HZ3 LYS 899 HZ3 LYS 899 -24.400 -12.149 2.101 374 H ARG 900 HN ARG 900 -26.174 -10.361 -5.098 375 HA ARG 900 HA ARG 900 -26.011 -13.125 -5.995 376 HB2 ARG 900 HB1 ARG 900 -26.254 -10.420 -7.379 377 HB3 ARG 900 HB2 ARG 900 -26.198 -11.943 -8.271 378 HG2 ARG 900 HG1 ARG 900 -28.237 -12.734 -7.105 379 HG3 ARG 900 HG2 ARG 900 -28.286 -11.240 -6.157 380 HD2 ARG 900 HD1 ARG 900 -29.866 -11.065 -7.983 381 HD3 ARG 900 HD2 ARG 900 -28.540 -9.916 -8.228 382 HE ARG 900 HE ARG 900 -28.167 -12.502 -9.570 383 HH11 ARG 900 HH11 ARG 900 -29.594 -9.332 -10.014 384 HH12 ARG 900 HH12 ARG 900 -29.512 -9.440 -11.750 385 HH21 ARG 900 HH21 ARG 900 -28.105 -12.577 -11.788 386 HH22 ARG 900 HH22 ARG 900 -28.707 -11.239 -12.721 387 H PHE 901 HN PHE 901 -23.685 -10.518 -5.884 388 HA PHE 901 HA PHE 901 -21.666 -12.202 -7.269 389 HB2 PHE 901 HB1 PHE 901 -21.968 -9.215 -7.666 390 HB3 PHE 901 HB2 PHE 901 -20.869 -10.299 -8.509 391 HD1 PHE 901 HD1 PHE 901 -24.395 -9.186 -8.182 392 HD2 PHE 901 HD2 PHE 901 -21.583 -11.488 -10.473 393 HE1 PHE 901 HE1 PHE 901 -26.064 -9.406 -10.009 394 HE2 PHE 901 HE2 PHE 901 -23.255 -11.728 -12.300 395 HZ PHE 901 HZ PHE 901 -25.500 -10.688 -12.063 396 H ALA 902 HN ALA 902 -22.251 -11.362 -4.380 397 HA ALA 902 HA ALA 902 -19.813 -9.975 -3.637 398 HB1 ALA 902 HB1 ALA 902 -22.139 -10.934 -1.919 399 HB2 ALA 902 HB2 ALA 902 -20.871 -9.790 -1.431 400 HB3 ALA 902 HB3 ALA 902 -22.025 -9.330 -2.687 401 H ASP 903 HN ASP 903 -19.316 -12.578 -4.689 402 HA ASP 903 HA ASP 903 -17.301 -13.257 -2.762 403 HB2 ASP 903 HB1 ASP 903 -19.550 -15.182 -3.172 404 HB3 ASP 903 HB2 ASP 903 -17.921 -15.834 -3.197 405 H CYS 904 HN CYS 904 -15.509 -14.157 -3.554 406 HA CYS 904 HA CYS 904 -14.793 -13.757 -6.204 407 HB2 CYS 904 HB1 CYS 904 -13.658 -15.687 -4.122 408 HB3 CYS 904 HB2 CYS 904 -12.807 -15.068 -5.539 409 H SER 905 HN SER 905 -16.778 -16.229 -5.000 410 HA SER 905 HA SER 905 -16.208 -18.276 -7.092 411 HB2 SER 905 HB1 SER 905 -18.147 -18.327 -4.756 412 HB3 SER 905 HB2 SER 905 -17.763 -19.673 -5.841 413 HG SER 905 HG1 SER 905 -15.654 -19.689 -5.034 414 H LYS 906 HN LYS 906 -18.349 -15.605 -6.530 415 HA LYS 906 HA LYS 906 -20.689 -16.659 -7.941 416 HB2 LYS 906 HB1 LYS 906 -19.757 -13.877 -7.169 417 HB3 LYS 906 HB2 LYS 906 -21.348 -14.218 -7.854 418 HG2 LYS 906 HG1 LYS 906 -20.315 -15.170 -5.175 419 HG3 LYS 906 HG2 LYS 906 -21.472 -13.881 -5.478 420 HD2 LYS 906 HD1 LYS 906 -22.929 -15.528 -4.910 421 HD3 LYS 906 HD2 LYS 906 -22.877 -15.810 -6.653 422 HE2 LYS 906 HE1 LYS 906 -21.148 -17.608 -6.255 423 HE3 LYS 906 HE2 LYS 906 -21.244 -17.282 -4.522 424 HZ1 LYS 906 HZ1 LYS 906 -22.651 -19.160 -5.150 425 HZ2 LYS 906 HZ2 LYS 906 -23.587 -17.949 -4.588 426 HZ3 LYS 906 HZ3 LYS 906 -23.508 -18.245 -6.193 427 H SER 907 HN SER 907 -21.574 -14.905 -9.630 428 HA SER 907 HA SER 907 -20.037 -15.361 -12.086 429 HB2 SER 907 HB1 SER 907 -22.485 -15.831 -11.821 430 HB3 SER 907 HB2 SER 907 -22.760 -14.086 -11.719 431 HG SER 907 HG1 SER 907 -21.877 -15.667 -13.903 432 H GLN 908 HN GLN 908 -20.985 -13.129 -13.574 433 HA GLN 908 HA GLN 908 -20.112 -10.587 -12.425 434 HB2 GLN 908 HB1 GLN 908 -17.987 -11.744 -13.154 435 HB3 GLN 908 HB2 GLN 908 -18.594 -11.734 -14.813 436 HG2 GLN 908 HG1 GLN 908 -18.459 -9.349 -14.945 437 HG3 GLN 908 HG2 GLN 908 -18.308 -9.178 -13.208 438 HE21 GLN 908 HE21 GLN 908 -16.540 -9.427 -16.124 439 HE22 GLN 908 HE22 GLN 908 -14.960 -9.806 -15.443 440 H GLU 909 HN GLU 909 -20.790 -8.712 -13.925 441 HA GLU 909 HA GLU 909 -23.231 -9.359 -15.350 442 HB2 GLU 909 HB1 GLU 909 -21.514 -6.876 -15.542 443 HB3 GLU 909 HB2 GLU 909 -23.156 -7.023 -16.144 444 HG2 GLU 909 HG1 GLU 909 -22.223 -6.988 -13.275 445 HG3 GLU 909 HG2 GLU 909 -23.087 -5.719 -14.116 446 H MET 910 HN MET 910 -19.899 -8.702 -16.419 447 HA MET 910 HA MET 910 -20.449 -9.985 -19.050 448 HB2 MET 910 HB1 MET 910 -19.117 -7.243 -18.787 449 HB3 MET 910 HB2 MET 910 -19.195 -8.226 -20.238 450 HG2 MET 910 HG1 MET 910 -20.883 -6.823 -20.703 451 HG3 MET 910 HG2 MET 910 -21.805 -8.079 -19.887 452 HE1 MET 910 HE1 MET 910 -23.021 -5.260 -20.432 453 HE2 MET 910 HE2 MET 910 -23.856 -6.518 -19.490 454 HE3 MET 910 HE3 MET 910 -23.748 -4.860 -18.859 455 H SER 911 HN SER 911 -18.669 -11.209 -19.779 456 HA SER 911 HA SER 911 -16.423 -11.694 -18.051 457 HB2 SER 911 HB1 SER 911 -16.269 -12.161 -21.005 458 HB3 SER 911 HB2 SER 911 -15.580 -13.106 -19.692 459 HG SER 911 HG1 SER 911 -17.404 -14.159 -20.611 460 H ASN 912 HN ASN 912 -14.167 -11.294 -18.525 461 HA ASN 912 HA ASN 912 -13.861 -8.513 -18.386 462 HB2 ASN 912 HB1 ASN 912 -11.651 -10.564 -18.827 463 HB3 ASN 912 HB2 ASN 912 -11.423 -8.903 -18.273 464 HD21 ASN 912 HD21 ASN 912 -10.265 -10.404 -16.632 465 HD22 ASN 912 HD22 ASN 912 -11.235 -10.799 -15.223 466 H GLU 913 HN GLU 913 -13.399 -10.552 -21.183 467 HA GLU 913 HA GLU 913 -12.169 -8.541 -22.904 468 HB2 GLU 913 HB1 GLU 913 -11.885 -10.957 -23.210 469 HB3 GLU 913 HB2 GLU 913 -13.619 -11.143 -23.519 470 HG2 GLU 913 HG1 GLU 913 -13.448 -9.882 -25.588 471 HG3 GLU 913 HG2 GLU 913 -11.796 -9.383 -25.201 472 H GLU 914 HN GLU 914 -15.478 -9.256 -21.979 473 HA GLU 914 HA GLU 914 -16.671 -7.818 -24.277 474 HB2 GLU 914 HB1 GLU 914 -17.931 -9.107 -21.827 475 HB3 GLU 914 HB2 GLU 914 -18.813 -8.399 -23.172 476 HG2 GLU 914 HG1 GLU 914 -17.015 -10.857 -23.219 477 HG3 GLU 914 HG2 GLU 914 -18.766 -10.828 -23.337 478 H ILE 915 HN ILE 915 -16.142 -7.319 -20.749 479 HA ILE 915 HA ILE 915 -17.313 -4.654 -20.822 480 HB ILE 915 HB ILE 915 -17.366 -5.488 -18.707 481 HG12 ILE 915 HG11 ILE 915 -15.959 -4.071 -17.273 482 HG13 ILE 915 HG12 ILE 915 -14.903 -3.675 -18.630 483 HG21 ILE 915 HG21 ILE 915 -14.453 -6.301 -18.838 484 HG22 ILE 915 HG22 ILE 915 -15.463 -6.335 -17.369 485 HG23 ILE 915 HG23 ILE 915 -15.895 -7.344 -18.721 486 HD11 ILE 915 HD1 ILE 915 -16.585 -1.942 -18.127 487 HD12 ILE 915 HD2 ILE 915 -16.720 -2.540 -19.769 488 HD13 ILE 915 HD3 ILE 915 -17.886 -3.088 -18.569 489 H ASN 916 HN ASN 916 -13.843 -5.677 -20.821 490 HA ASN 916 HA ASN 916 -12.891 -3.073 -21.187 491 HB2 ASN 916 HB1 ASN 916 -10.778 -3.907 -21.613 492 HB3 ASN 916 HB2 ASN 916 -11.541 -5.051 -20.531 493 HD21 ASN 916 HD21 ASN 916 -10.259 -6.816 -21.027 494 HD22 ASN 916 HD22 ASN 916 -10.083 -7.464 -22.653 495 H GLU 917 HN GLU 917 -14.181 -5.105 -23.743 496 HA GLU 917 HA GLU 917 -13.589 -3.393 -25.966 497 HB2 GLU 917 HB1 GLU 917 -15.526 -5.559 -25.322 498 HB3 GLU 917 HB2 GLU 917 -15.952 -4.522 -26.662 499 HG2 GLU 917 HG1 GLU 917 -13.292 -5.996 -26.391 500 HG3 GLU 917 HG2 GLU 917 -14.674 -6.589 -27.306 501 H GLU 918 HN GLU 918 -16.215 -3.233 -23.561 502 HA GLU 918 HA GLU 918 -17.752 -1.165 -24.860 503 HB2 GLU 918 HB1 GLU 918 -18.420 -2.803 -22.899 504 HB3 GLU 918 HB2 GLU 918 -17.654 -1.605 -21.852 505 HG2 GLU 918 HG1 GLU 918 -19.954 -1.112 -21.849 506 HG3 GLU 918 HG2 GLU 918 -19.200 0.142 -22.813 507 H LEU 919 HN LEU 919 -14.995 -1.105 -22.623 508 HA LEU 919 HA LEU 919 -14.974 1.840 -22.424 509 HB2 LEU 919 HB1 LEU 919 -13.006 -0.316 -21.612 510 HB3 LEU 919 HB2 LEU 919 -12.767 1.396 -21.298 511 HG LEU 919 HG LEU 919 -15.401 0.564 -20.338 512 HD11 LEU 919 HD11 LEU 919 -14.462 -1.641 -20.100 513 HD12 LEU 919 HD12 LEU 919 -13.012 -1.008 -19.320 514 HD13 LEU 919 HD13 LEU 919 -14.594 -0.911 -18.498 515 HD21 LEU 919 HD21 LEU 919 -14.216 2.555 -19.583 516 HD22 LEU 919 HD22 LEU 919 -14.600 1.450 -18.234 517 HD23 LEU 919 HD23 LEU 919 -12.936 1.547 -18.884 518 H GLY 920 HN GLY 920 -13.231 -0.693 -24.208 519 HA2 GLY 920 HA1 GLY 920 -12.412 -0.485 -26.431 520 HA3 GLY 920 HA2 GLY 920 -12.289 1.267 -26.254 521 H ILE 921 HN ILE 921 -11.082 -1.334 -24.109 522 HA ILE 921 HA ILE 921 -8.274 -0.358 -24.396 523 HB ILE 921 HB ILE 921 -8.038 -0.191 -21.997 524 HG12 ILE 921 HG11 ILE 921 -10.957 -1.022 -21.857 525 HG13 ILE 921 HG12 ILE 921 -9.560 -1.891 -21.225 526 HG21 ILE 921 HG21 ILE 921 -9.183 1.864 -21.628 527 HG22 ILE 921 HG22 ILE 921 -8.784 1.774 -23.343 528 HG23 ILE 921 HG23 ILE 921 -10.451 1.461 -22.803 529 HD11 ILE 921 HD1 ILE 921 -10.669 0.729 -20.165 530 HD12 ILE 921 HD2 ILE 921 -10.688 -0.860 -19.396 531 HD13 ILE 921 HD3 ILE 921 -9.140 -0.022 -19.623 532 H GLY 922 HN GLY 922 -6.797 -1.690 -22.927 533 HA2 GLY 922 HA1 GLY 922 -7.314 -4.628 -23.245 534 HA3 GLY 922 HA2 GLY 922 -5.749 -3.868 -23.531 535 H GLN 923 HN GLN 923 -8.020 -4.928 -21.164 536 HA GLN 923 HA GLN 923 -6.925 -3.767 -18.827 537 HB2 GLN 923 HB1 GLN 923 -9.167 -5.187 -19.342 538 HB3 GLN 923 HB2 GLN 923 -8.229 -6.459 -18.594 539 HG2 GLN 923 HG1 GLN 923 -9.450 -5.538 -16.844 540 HG3 GLN 923 HG2 GLN 923 -7.866 -4.804 -16.622 541 HE21 GLN 923 HE21 GLN 923 -8.615 -2.826 -15.569 542 HE22 GLN 923 HE22 GLN 923 -9.706 -1.729 -16.390 543 H ASP 924 HN ASP 924 -5.950 -4.804 -17.009 544 HA ASP 924 HA ASP 924 -3.420 -6.032 -17.598 545 HB2 ASP 924 HB1 ASP 924 -3.773 -4.526 -15.699 546 HB3 ASP 924 HB2 ASP 924 -4.928 -5.644 -14.979 547 H GLU 925 HN GLU 925 -6.374 -7.403 -16.093 548 HA GLU 925 HA GLU 925 -5.381 -10.057 -15.721 549 HB2 GLU 925 HB1 GLU 925 -7.391 -8.870 -14.688 550 HB3 GLU 925 HB2 GLU 925 -8.240 -9.093 -16.193 551 HG2 GLU 925 HG1 GLU 925 -8.879 -10.773 -14.549 552 HG3 GLU 925 HG2 GLU 925 -8.173 -11.498 -15.990 553 H ALA 926 HN ALA 926 -6.985 -8.464 -18.370 554 HA ALA 926 HA ALA 926 -7.491 -10.772 -20.068 555 HB1 ALA 926 HB1 ALA 926 -7.301 -7.816 -20.754 556 HB2 ALA 926 HB2 ALA 926 -8.036 -9.090 -21.747 557 HB3 ALA 926 HB3 ALA 926 -8.770 -8.657 -20.192 558 H ASP 927 HN ASP 927 -4.946 -8.290 -20.042 559 HA ASP 927 HA ASP 927 -3.060 -7.968 -21.161 560 HB2 ASP 927 HB1 ASP 927 -2.460 -10.109 -19.938 561 HB3 ASP 927 HB2 ASP 927 -2.740 -10.970 -21.450 562 H ALA 928 HN ALA 928 -5.666 -8.460 -22.624 563 HA ALA 928 HA ALA 928 -5.198 -9.276 -25.296 564 HB1 ALA 928 HB1 ALA 928 -7.426 -9.074 -24.281 565 HB2 ALA 928 HB2 ALA 928 -7.235 -7.307 -24.168 566 HB3 ALA 928 HB3 ALA 928 -7.321 -8.095 -25.755 567 H1 ALA 1 HT1 ALA 1 -8.412 0.580 -5.414 568 H2 ALA 1 HT2 ALA 1 -6.881 0.016 -5.226 569 H3 ALA 1 HT3 ALA 1 -8.130 -0.768 -4.506 570 HA ALA 1 HA ALA 1 -7.315 -1.958 -6.421 571 HB1 ALA 1 HB1 ALA 1 -10.153 -0.869 -6.719 572 HB2 ALA 1 HB2 ALA 1 -9.511 -2.338 -7.482 573 HB3 ALA 1 HB3 ALA 1 -9.667 -2.254 -5.719 574 H ARG 2 HN ARG 2 -6.387 -1.844 -8.420 575 HA ARG 2 HA ARG 2 -6.544 0.434 -10.227 576 HB2 ARG 2 HB1 ARG 2 -4.715 -1.192 -10.402 577 HB3 ARG 2 HB2 ARG 2 -5.848 -2.521 -10.590 578 HG2 ARG 2 HG1 ARG 2 -4.887 -2.047 -12.729 579 HG3 ARG 2 HG2 ARG 2 -6.588 -1.635 -12.786 580 HD2 ARG 2 HD1 ARG 2 -5.107 0.739 -11.977 581 HD3 ARG 2 HD2 ARG 2 -4.241 -0.015 -13.307 582 HE ARG 2 HE ARG 2 -7.174 0.451 -13.649 583 HH11 ARG 2 HH11 ARG 2 -3.972 1.626 -14.495 584 HH12 ARG 2 HH12 ARG 2 -4.543 2.289 -16.004 585 HH21 ARG 2 HH21 ARG 2 -7.850 1.649 -15.314 586 HH22 ARG 2 HH22 ARG 2 -6.705 2.309 -16.461 587 H THR 3 HN THR 3 -8.221 0.975 -11.589 588 HA THR 3 HA THR 3 -9.866 -1.047 -12.861 589 HB THR 3 HB THR 3 -10.906 -0.842 -10.539 590 HG1 THR 3 HG1 THR 3 -12.436 -1.455 -11.850 591 HG21 THR 3 HG21 THR 3 -12.178 1.111 -9.901 592 HG22 THR 3 HG22 THR 3 -10.485 1.573 -10.116 593 HG23 THR 3 HG23 THR 3 -11.693 1.985 -11.357 594 H MLZ 4 HN MLZ 4 -12.106 0.726 -13.405 595 HA MLZ 4 HA MLZ 4 -11.190 2.797 -15.226 596 HB2 MLZ 4 HB1 MLZ 4 -11.393 1.549 -17.254 597 HB3 MLZ 4 HB2 MLZ 4 -10.363 0.594 -16.234 598 HG2 MLZ 4 HG1 MLZ 4 -13.285 0.098 -16.877 599 HG3 MLZ 4 HG2 MLZ 4 -11.877 -0.815 -17.434 600 HD2 MLZ 4 HD1 MLZ 4 -11.516 -1.517 -15.029 601 HD3 MLZ 4 HD2 MLZ 4 -13.043 -0.753 -14.660 602 HE2 MLZ 4 HE1 MLZ 4 -13.816 -2.898 -14.989 603 HE3 MLZ 4 HE2 MLZ 4 -13.999 -2.282 -16.629 604 HZ MLZ 4 HZ1 MLZ 4 -11.666 -3.828 -15.575 605 HCM1 MLZ 4 HC1 MLZ 4 -12.389 -5.661 -16.831 606 HCM2 MLZ 4 HC2 MLZ 4 -13.829 -5.057 -15.997 607 HCM3 MLZ 4 HC3 MLZ 4 -13.538 -4.648 -17.702 608 HZ2 MLZ 4 HZ2 MLZ 4 -11.739 -3.261 -17.111 609 H GLN 5 HN GLN 5 -13.154 3.314 -16.841 610 HA GLN 5 HA GLN 5 -15.744 3.023 -15.460 611 HB2 GLN 5 HB1 GLN 5 -16.017 5.206 -14.947 612 HB3 GLN 5 HB2 GLN 5 -14.356 4.892 -14.490 613 HG2 GLN 5 HG1 GLN 5 -15.401 6.558 -16.802 614 HG3 GLN 5 HG2 GLN 5 -14.558 7.109 -15.378 615 HE21 GLN 5 HE21 GLN 5 -13.688 8.016 -17.810 616 HE22 GLN 5 HE22 GLN 5 -12.135 7.272 -18.164 617 H THR 6 HN THR 6 -17.135 2.363 -16.890 618 HA THR 6 HA THR 6 -17.025 2.859 -19.727 619 HB THR 6 HB THR 6 -19.470 1.954 -19.570 620 HG1 THR 6 HG1 THR 6 -19.742 2.216 -17.360 621 HG21 THR 6 HG21 THR 6 -17.666 0.585 -20.404 622 HG22 THR 6 HG22 THR 6 -17.099 0.259 -18.743 623 HG23 THR 6 HG23 THR 6 -18.672 -0.364 -19.305 624 H ALA 7 HN ALA 7 -17.843 4.438 -20.921 625 HA ALA 7 HA ALA 7 -19.950 6.254 -19.807 626 HB1 ALA 7 HB1 ALA 7 -19.004 7.971 -21.273 627 HB2 ALA 7 HB2 ALA 7 -17.758 7.320 -20.193 628 HB3 ALA 7 HB3 ALA 7 -17.808 6.814 -21.898 629 H ARG 8 HN ARG 8 -19.586 3.733 -21.998 630 HA ARG 8 HA ARG 8 -21.539 4.731 -24.006 631 HB2 ARG 8 HB1 ARG 8 -19.913 2.158 -23.897 632 HB3 ARG 8 HB2 ARG 8 -21.027 2.630 -25.191 633 HG2 ARG 8 HG1 ARG 8 -19.637 4.706 -25.557 634 HG3 ARG 8 HG2 ARG 8 -18.467 4.075 -24.382 635 HD2 ARG 8 HD1 ARG 8 -18.205 2.023 -25.823 636 HD3 ARG 8 HD2 ARG 8 -19.313 2.740 -26.987 637 HE ARG 8 HE ARG 8 -17.677 4.242 -27.689 638 HH11 ARG 8 HH11 ARG 8 -16.392 2.485 -24.932 639 HH12 ARG 8 HH12 ARG 8 -14.799 3.171 -25.129 640 HH21 ARG 8 HH21 ARG 8 -15.608 5.035 -27.902 641 HH22 ARG 8 HH22 ARG 8 -14.376 4.557 -26.769 642 H TYR 9 HN TYR 9 -23.075 4.930 -22.208 643 HA TYR 9 HA TYR 9 -24.336 2.718 -20.922 644 HB2 TYR 9 HB1 TYR 9 -25.500 5.426 -21.660 645 HB3 TYR 9 HB2 TYR 9 -26.185 4.293 -20.512 646 HD1 TYR 9 HD1 TYR 9 -23.627 6.857 -21.062 647 HD2 TYR 9 HD2 TYR 9 -25.102 3.881 -18.312 648 HE1 TYR 9 HE1 TYR 9 -22.336 7.922 -19.224 649 HE2 TYR 9 HE2 TYR 9 -23.829 4.977 -16.454 650 HH TYR 9 HH TYR 9 -21.953 7.973 -16.991 Start of MODEL 13 1 H1 GLY 850 HT1 GLY 850 -0.538 -0.927 -2.141 2 H2 GLY 850 HT2 GLY 850 0.906 -0.379 -1.593 3 H3 GLY 850 HT3 GLY 850 0.855 -1.514 -2.773 4 HA2 GLY 850 HA1 GLY 850 -0.083 1.274 -3.020 5 HA3 GLY 850 HA2 GLY 850 1.407 0.623 -3.727 6 H SER 851 HN SER 851 0.976 0.780 -5.902 7 HA SER 851 HA SER 851 -1.561 0.218 -7.130 8 HB2 SER 851 HB1 SER 851 0.068 1.668 -8.194 9 HB3 SER 851 HB2 SER 851 1.230 0.329 -8.304 10 HG SER 851 HG1 SER 851 0.187 0.490 -10.251 11 H ARG 852 HN ARG 852 -2.414 -1.556 -7.984 12 HA ARG 852 HA ARG 852 -1.172 -4.236 -7.587 13 HB2 ARG 852 HB1 ARG 852 -3.881 -3.420 -8.754 14 HB3 ARG 852 HB2 ARG 852 -3.339 -5.065 -8.481 15 HG2 ARG 852 HG1 ARG 852 -4.846 -4.510 -6.763 16 HG3 ARG 852 HG2 ARG 852 -3.250 -4.644 -6.023 17 HD2 ARG 852 HD1 ARG 852 -3.081 -2.325 -5.679 18 HD3 ARG 852 HD2 ARG 852 -4.305 -1.947 -6.906 19 HE ARG 852 HE ARG 852 -5.887 -3.201 -5.212 20 HH11 ARG 852 HH11 ARG 852 -3.381 -0.863 -4.368 21 HH12 ARG 852 HH12 ARG 852 -4.348 -0.178 -3.086 22 HH21 ARG 852 HH21 ARG 852 -7.014 -2.307 -3.571 23 HH22 ARG 852 HH22 ARG 852 -6.330 -1.009 -2.604 24 H ARG 853 HN ARG 853 -1.704 -1.961 -10.107 25 HA ARG 853 HA ARG 853 -0.599 -3.516 -12.332 26 HB2 ARG 853 HB1 ARG 853 -2.939 -4.466 -11.878 27 HB3 ARG 853 HB2 ARG 853 -3.591 -2.897 -12.256 28 HG2 ARG 853 HG1 ARG 853 -2.252 -4.886 -14.116 29 HG3 ARG 853 HG2 ARG 853 -3.943 -4.373 -14.077 30 HD2 ARG 853 HD1 ARG 853 -3.091 -2.008 -14.648 31 HD3 ARG 853 HD2 ARG 853 -1.487 -2.729 -14.884 32 HE ARG 853 HE ARG 853 -3.224 -4.126 -16.597 33 HH11 ARG 853 HH11 ARG 853 -1.932 -0.878 -16.254 34 HH12 ARG 853 HH12 ARG 853 -2.093 -0.534 -17.950 35 HH21 ARG 853 HH21 ARG 853 -3.299 -3.602 -18.855 36 HH22 ARG 853 HH22 ARG 853 -2.866 -1.995 -19.324 37 H ALA 854 HN ALA 854 -2.963 -0.932 -11.678 38 HA ALA 854 HA ALA 854 -1.081 1.199 -12.019 39 HB1 ALA 854 HB1 ALA 854 -2.336 2.450 -13.730 40 HB2 ALA 854 HB2 ALA 854 -1.655 0.956 -14.405 41 HB3 ALA 854 HB3 ALA 854 -3.391 1.048 -14.012 42 H SER 855 HN SER 855 -2.129 3.289 -11.305 43 HA SER 855 HA SER 855 -4.186 2.635 -9.263 44 HB2 SER 855 HB1 SER 855 -3.454 4.679 -8.127 45 HB3 SER 855 HB2 SER 855 -2.264 3.397 -8.260 46 HG SER 855 HG1 SER 855 -1.380 5.491 -8.764 47 H VAL 856 HN VAL 856 -5.816 3.854 -8.710 48 HA VAL 856 HA VAL 856 -6.647 6.314 -9.873 49 HB VAL 856 HB VAL 856 -7.172 4.876 -11.853 50 HG11 VAL 856 HG11 VAL 856 -7.857 2.820 -10.689 51 HG12 VAL 856 HG12 VAL 856 -9.318 3.645 -10.095 52 HG13 VAL 856 HG13 VAL 856 -9.088 3.387 -11.838 53 HG21 VAL 856 HG21 VAL 856 -8.421 6.995 -11.416 54 HG22 VAL 856 HG22 VAL 856 -9.296 5.791 -12.371 55 HG23 VAL 856 HG23 VAL 856 -9.720 6.021 -10.674 56 H GLY 857 HN GLY 857 -8.638 7.138 -8.928 57 HA2 GLY 857 HA1 GLY 857 -10.406 5.835 -7.218 58 HA3 GLY 857 HA2 GLY 857 -9.042 6.267 -6.187 59 H SER 858 HN SER 858 -10.898 7.942 -8.799 60 HA SER 858 HA SER 858 -11.605 10.167 -6.974 61 HB2 SER 858 HB1 SER 858 -10.001 10.586 -9.530 62 HB3 SER 858 HB2 SER 858 -10.800 11.864 -8.604 63 HG SER 858 HG1 SER 858 -8.679 10.176 -7.723 64 H GLU 859 HN GLU 859 -13.361 11.401 -7.636 65 HA GLU 859 HA GLU 859 -15.112 10.378 -9.767 66 HB2 GLU 859 HB1 GLU 859 -15.297 12.668 -7.784 67 HB3 GLU 859 HB2 GLU 859 -16.463 12.462 -9.099 68 HG2 GLU 859 HG1 GLU 859 -17.166 10.329 -8.270 69 HG3 GLU 859 HG2 GLU 859 -15.854 10.280 -7.091 70 H PHE 860 HN PHE 860 -15.489 11.277 -11.686 71 HA PHE 860 HA PHE 860 -14.912 14.013 -12.374 72 HB2 PHE 860 HB1 PHE 860 -12.636 12.991 -12.716 73 HB3 PHE 860 HB2 PHE 860 -13.317 11.872 -13.865 74 HD1 PHE 860 HD1 PHE 860 -13.637 12.523 -16.168 75 HD2 PHE 860 HD2 PHE 860 -12.751 15.506 -13.182 76 HE1 PHE 860 HE1 PHE 860 -13.307 14.214 -17.956 77 HE2 PHE 860 HE2 PHE 860 -12.419 17.197 -14.974 78 HZ PHE 860 HZ PHE 860 -12.697 16.553 -17.362 79 H THR 861 HN THR 861 -15.231 10.835 -13.897 80 HA THR 861 HA THR 861 -17.295 11.546 -15.820 81 HB THR 861 HB THR 861 -17.289 8.954 -16.069 82 HG1 THR 861 HG1 THR 861 -16.418 8.375 -14.142 83 HG21 THR 861 HG21 THR 861 -14.688 10.432 -16.516 84 HG22 THR 861 HG22 THR 861 -15.260 8.960 -17.340 85 HG23 THR 861 HG23 THR 861 -16.132 10.484 -17.567 86 H GLU 862 HN GLU 862 -19.139 10.048 -16.042 87 HA GLU 862 HA GLU 862 -20.891 9.774 -13.706 88 HB2 GLU 862 HB1 GLU 862 -21.489 10.171 -16.202 89 HB3 GLU 862 HB2 GLU 862 -21.219 8.439 -16.407 90 HG2 GLU 862 HG1 GLU 862 -23.039 7.958 -14.827 91 HG3 GLU 862 HG2 GLU 862 -23.129 9.654 -14.361 92 H SER 863 HN SER 863 -21.916 7.358 -13.647 93 HA SER 863 HA SER 863 -20.503 5.825 -11.989 94 HB2 SER 863 HB1 SER 863 -22.502 4.833 -14.047 95 HB3 SER 863 HB2 SER 863 -22.095 4.011 -12.532 96 HG SER 863 HG1 SER 863 -23.984 5.363 -12.376 97 H ALA 864 HN ALA 864 -19.382 3.881 -11.889 98 HA ALA 864 HA ALA 864 -17.586 3.416 -14.236 99 HB1 ALA 864 HB1 ALA 864 -16.918 3.833 -11.289 100 HB2 ALA 864 HB2 ALA 864 -15.741 3.560 -12.581 101 HB3 ALA 864 HB3 ALA 864 -16.707 5.041 -12.577 102 H TRP 865 HN TRP 865 -15.935 1.512 -13.447 103 HA TRP 865 HA TRP 865 -17.483 -0.693 -12.083 104 HB2 TRP 865 HB1 TRP 865 -15.079 -0.800 -13.895 105 HB3 TRP 865 HB2 TRP 865 -15.719 -2.173 -13.004 106 HD1 TRP 865 HD1 TRP 865 -16.781 0.280 -15.759 107 HE1 TRP 865 HE1 TRP 865 -18.494 -0.776 -17.265 108 HE3 TRP 865 HE3 TRP 865 -17.322 -4.123 -13.255 109 HZ2 TRP 865 HZ2 TRP 865 -20.149 -3.250 -17.243 110 HZ3 TRP 865 HZ3 TRP 865 -18.869 -5.913 -14.124 111 HH2 TRP 865 HH2 TRP 865 -20.285 -5.453 -16.068 112 H VAL 866 HN VAL 866 -16.080 -2.082 -10.729 113 HA VAL 866 HA VAL 866 -13.540 -0.937 -9.783 114 HB VAL 866 HB VAL 866 -15.103 -0.075 -8.159 115 HG11 VAL 866 HG11 VAL 866 -16.363 -1.474 -6.650 116 HG12 VAL 866 HG12 VAL 866 -16.822 -1.910 -8.300 117 HG13 VAL 866 HG13 VAL 866 -15.724 -2.958 -7.392 118 HG21 VAL 866 HG21 VAL 866 -12.809 -0.654 -7.450 119 HG22 VAL 866 HG22 VAL 866 -14.003 -0.733 -6.149 120 HG23 VAL 866 HG23 VAL 866 -13.410 -2.232 -6.877 121 H ARG 867 HN ARG 867 -12.057 -2.446 -9.095 122 HA ARG 867 HA ARG 867 -12.519 -5.269 -9.908 123 HB2 ARG 867 HB1 ARG 867 -10.603 -3.648 -10.674 124 HB3 ARG 867 HB2 ARG 867 -9.898 -3.961 -9.110 125 HG2 ARG 867 HG1 ARG 867 -9.895 -6.432 -9.719 126 HG3 ARG 867 HG2 ARG 867 -10.551 -5.968 -11.299 127 HD2 ARG 867 HD1 ARG 867 -8.497 -5.724 -12.074 128 HD3 ARG 867 HD2 ARG 867 -8.287 -4.322 -11.036 129 HE ARG 867 HE ARG 867 -6.992 -6.867 -10.832 130 HH11 ARG 867 HH11 ARG 867 -8.143 -4.286 -8.777 131 HH12 ARG 867 HH12 ARG 867 -7.294 -4.842 -7.361 132 HH21 ARG 867 HH21 ARG 867 -5.885 -7.553 -8.974 133 HH22 ARG 867 HH22 ARG 867 -5.964 -6.589 -7.528 134 H CYS 868 HN CYS 868 -12.353 -6.968 -8.490 135 HA CYS 868 HA CYS 868 -12.071 -6.562 -5.649 136 HB2 CYS 868 HB1 CYS 868 -13.482 -8.313 -6.565 137 HB3 CYS 868 HB2 CYS 868 -12.097 -9.039 -7.388 138 H ASP 869 HN ASP 869 -10.306 -6.353 -4.520 139 HA ASP 869 HA ASP 869 -7.619 -6.960 -5.555 140 HB2 ASP 869 HB1 ASP 869 -8.639 -5.826 -2.929 141 HB3 ASP 869 HB2 ASP 869 -6.933 -6.043 -3.318 142 H ASP 870 HN ASP 870 -9.927 -8.898 -3.978 143 HA ASP 870 HA ASP 870 -7.865 -10.656 -2.742 144 HB2 ASP 870 HB1 ASP 870 -10.859 -10.471 -2.524 145 HB3 ASP 870 HB2 ASP 870 -10.115 -12.046 -2.347 146 H CYS 871 HN CYS 871 -9.933 -10.451 -5.590 147 HA CYS 871 HA CYS 871 -8.241 -12.565 -6.738 148 HB2 CYS 871 HB1 CYS 871 -9.946 -13.701 -7.853 149 HB3 CYS 871 HB2 CYS 871 -10.358 -13.638 -6.155 150 H PHE 872 HN PHE 872 -10.758 -10.945 -8.389 151 HA PHE 872 HA PHE 872 -9.316 -8.775 -9.642 152 HB2 PHE 872 HB1 PHE 872 -9.020 -9.591 -11.835 153 HB3 PHE 872 HB2 PHE 872 -8.206 -10.717 -10.777 154 HD1 PHE 872 HD1 PHE 872 -9.216 -13.000 -10.329 155 HD2 PHE 872 HD2 PHE 872 -10.912 -10.272 -13.207 156 HE1 PHE 872 HE1 PHE 872 -10.559 -14.852 -11.297 157 HE2 PHE 872 HE2 PHE 872 -12.251 -12.125 -14.174 158 HZ PHE 872 HZ PHE 872 -12.081 -14.418 -13.216 159 H LYS 873 HN LYS 873 -12.161 -10.839 -9.412 160 HA LYS 873 HA LYS 873 -13.838 -10.161 -11.412 161 HB2 LYS 873 HB1 LYS 873 -14.511 -10.553 -8.505 162 HB3 LYS 873 HB2 LYS 873 -15.731 -10.158 -9.719 163 HG2 LYS 873 HG1 LYS 873 -14.527 -12.130 -11.060 164 HG3 LYS 873 HG2 LYS 873 -14.212 -12.685 -9.405 165 HD2 LYS 873 HD1 LYS 873 -16.873 -12.047 -10.721 166 HD3 LYS 873 HD2 LYS 873 -16.262 -13.638 -10.280 167 HE2 LYS 873 HE1 LYS 873 -17.473 -13.435 -8.384 168 HE3 LYS 873 HE2 LYS 873 -16.160 -12.369 -7.843 169 HZ1 LYS 873 HZ1 LYS 873 -18.382 -11.402 -7.570 170 HZ2 LYS 873 HZ2 LYS 873 -17.506 -10.500 -8.618 171 HZ3 LYS 873 HZ3 LYS 873 -18.661 -11.536 -9.195 172 H TRP 874 HN TRP 874 -15.198 -8.753 -12.084 173 HA TRP 874 HA TRP 874 -14.883 -5.948 -11.161 174 HB2 TRP 874 HB1 TRP 874 -15.901 -7.001 -13.832 175 HB3 TRP 874 HB2 TRP 874 -15.545 -5.353 -13.415 176 HD1 TRP 874 HD1 TRP 874 -13.709 -8.554 -14.358 177 HE1 TRP 874 HE1 TRP 874 -11.233 -7.992 -14.814 178 HE3 TRP 874 HE3 TRP 874 -13.631 -3.820 -12.466 179 HZ2 TRP 874 HZ2 TRP 874 -9.493 -5.752 -14.448 180 HZ3 TRP 874 HZ3 TRP 874 -11.527 -2.509 -12.525 181 HH2 TRP 874 HH2 TRP 874 -9.469 -3.425 -13.514 182 H ARG 875 HN ARG 875 -16.620 -4.549 -10.906 183 HA ARG 875 HA ARG 875 -19.403 -5.533 -11.112 184 HB2 ARG 875 HB1 ARG 875 -18.163 -4.518 -8.512 185 HB3 ARG 875 HB2 ARG 875 -19.894 -4.559 -8.798 186 HG2 ARG 875 HG1 ARG 875 -18.036 -6.968 -8.688 187 HG3 ARG 875 HG2 ARG 875 -19.183 -6.477 -7.466 188 HD2 ARG 875 HD1 ARG 875 -19.837 -7.550 -10.207 189 HD3 ARG 875 HD2 ARG 875 -20.078 -8.345 -8.655 190 HE ARG 875 HE ARG 875 -21.602 -6.046 -8.414 191 HH11 ARG 875 HH11 ARG 875 -21.569 -8.611 -10.826 192 HH12 ARG 875 HH12 ARG 875 -23.204 -8.193 -11.335 193 HH21 ARG 875 HH21 ARG 875 -23.786 -5.814 -9.073 194 HH22 ARG 875 HH22 ARG 875 -24.279 -6.697 -10.529 195 H ARG 876 HN ARG 876 -20.795 -3.991 -11.650 196 HA ARG 876 HA ARG 876 -19.852 -1.337 -12.430 197 HB2 ARG 876 HB1 ARG 876 -21.560 -2.898 -13.635 198 HB3 ARG 876 HB2 ARG 876 -22.702 -2.429 -12.383 199 HG2 ARG 876 HG1 ARG 876 -23.244 -0.979 -14.098 200 HG3 ARG 876 HG2 ARG 876 -22.144 0.043 -13.159 201 HD2 ARG 876 HD1 ARG 876 -20.284 -0.591 -14.697 202 HD3 ARG 876 HD2 ARG 876 -21.373 -1.678 -15.561 203 HE ARG 876 HE ARG 876 -22.427 0.107 -16.622 204 HH11 ARG 876 HH11 ARG 876 -20.165 1.397 -14.272 205 HH12 ARG 876 HH12 ARG 876 -20.147 2.964 -15.052 206 HH21 ARG 876 HH21 ARG 876 -22.385 2.196 -17.505 207 HH22 ARG 876 HH22 ARG 876 -21.560 3.443 -16.605 208 H ILE 877 HN ILE 877 -19.960 0.481 -11.249 209 HA ILE 877 HA ILE 877 -21.656 0.604 -8.790 210 HB ILE 877 HB ILE 877 -19.795 1.593 -7.561 211 HG12 ILE 877 HG11 ILE 877 -18.021 0.963 -9.952 212 HG13 ILE 877 HG12 ILE 877 -18.573 2.568 -9.536 213 HG21 ILE 877 HG21 ILE 877 -18.928 -1.075 -8.716 214 HG22 ILE 877 HG22 ILE 877 -18.606 -0.448 -7.074 215 HG23 ILE 877 HG23 ILE 877 -20.243 -0.888 -7.540 216 HD11 ILE 877 HD1 ILE 877 -17.364 2.673 -7.532 217 HD12 ILE 877 HD2 ILE 877 -16.942 0.957 -7.574 218 HD13 ILE 877 HD3 ILE 877 -16.261 2.080 -8.768 219 HA PRO 878 HA PRO 878 -22.230 4.945 -9.994 220 HB2 PRO 878 HB1 PRO 878 -22.730 6.136 -7.590 221 HB3 PRO 878 HB2 PRO 878 -23.926 5.086 -8.411 222 HG2 PRO 878 HG1 PRO 878 -21.975 4.317 -6.217 223 HG3 PRO 878 HG2 PRO 878 -23.737 3.994 -6.288 224 HD2 PRO 878 HD1 PRO 878 -21.902 2.132 -7.038 225 HD3 PRO 878 HD2 PRO 878 -23.454 2.299 -7.907 226 H ALA 879 HN ALA 879 -20.893 6.772 -10.071 227 HA ALA 879 HA ALA 879 -18.137 6.487 -9.505 228 HB1 ALA 879 HB1 ALA 879 -18.012 8.856 -10.175 229 HB2 ALA 879 HB2 ALA 879 -19.096 7.952 -11.247 230 HB3 ALA 879 HB3 ALA 879 -19.772 9.015 -9.986 231 H SER 880 HN SER 880 -20.658 7.588 -7.360 232 HA SER 880 HA SER 880 -19.097 9.018 -5.418 233 HB2 SER 880 HB1 SER 880 -21.580 7.296 -5.022 234 HB3 SER 880 HB2 SER 880 -20.888 8.404 -3.827 235 HG SER 880 HG1 SER 880 -22.068 9.056 -6.339 236 H VAL 881 HN VAL 881 -19.284 5.573 -6.146 237 HA VAL 881 HA VAL 881 -17.792 4.851 -3.682 238 HB VAL 881 HB VAL 881 -18.847 3.186 -5.991 239 HG11 VAL 881 HG11 VAL 881 -16.748 2.126 -5.117 240 HG12 VAL 881 HG12 VAL 881 -17.468 2.145 -3.488 241 HG13 VAL 881 HG13 VAL 881 -18.197 1.178 -4.782 242 HG21 VAL 881 HG21 VAL 881 -20.334 2.214 -4.304 243 HG22 VAL 881 HG22 VAL 881 -19.626 3.256 -3.050 244 HG23 VAL 881 HG23 VAL 881 -20.559 3.965 -4.380 245 H VAL 882 HN VAL 882 -17.278 5.285 -7.176 246 HA VAL 882 HA VAL 882 -14.606 4.264 -6.981 247 HB VAL 882 HB VAL 882 -16.174 4.671 -9.096 248 HG11 VAL 882 HG11 VAL 882 -15.883 7.179 -9.123 249 HG12 VAL 882 HG12 VAL 882 -14.163 6.927 -9.456 250 HG13 VAL 882 HG13 VAL 882 -15.382 6.365 -10.609 251 HG21 VAL 882 HG21 VAL 882 -14.163 3.252 -9.017 252 HG22 VAL 882 HG22 VAL 882 -14.221 4.188 -10.514 253 HG23 VAL 882 HG23 VAL 882 -13.130 4.684 -9.203 254 H GLY 883 HN GLY 883 -15.899 7.316 -6.176 255 HA2 GLY 883 HA1 GLY 883 -13.274 8.674 -5.893 256 HA3 GLY 883 HA2 GLY 883 -14.860 9.305 -5.445 257 H SER 884 HN SER 884 -15.370 6.674 -3.916 258 HA SER 884 HA SER 884 -14.198 7.520 -1.339 259 HB2 SER 884 HB1 SER 884 -16.588 6.884 -1.566 260 HB3 SER 884 HB2 SER 884 -16.101 5.238 -1.999 261 HG SER 884 HG1 SER 884 -15.214 4.986 0.060 262 H ILE 885 HN ILE 885 -13.953 4.827 -3.642 263 HA ILE 885 HA ILE 885 -12.036 3.273 -2.086 264 HB ILE 885 HB ILE 885 -13.277 3.114 -4.826 265 HG12 ILE 885 HG11 ILE 885 -13.937 0.908 -4.150 266 HG13 ILE 885 HG12 ILE 885 -12.893 0.928 -2.727 267 HG21 ILE 885 HG21 ILE 885 -11.012 2.582 -5.406 268 HG22 ILE 885 HG22 ILE 885 -10.826 1.538 -3.966 269 HG23 ILE 885 HG23 ILE 885 -11.923 1.079 -5.304 270 HD11 ILE 885 HD1 ILE 885 -15.359 1.213 -2.255 271 HD12 ILE 885 HD2 ILE 885 -14.349 2.516 -1.608 272 HD13 ILE 885 HD3 ILE 885 -15.288 2.759 -3.101 273 H ASP 886 HN ASP 886 -10.097 3.898 -1.727 274 HA ASP 886 HA ASP 886 -8.550 5.694 -3.538 275 HB2 ASP 886 HB1 ASP 886 -7.968 4.709 -0.720 276 HB3 ASP 886 HB2 ASP 886 -7.000 5.867 -1.618 277 H GLU 887 HN GLU 887 -6.076 5.130 -3.542 278 HA GLU 887 HA GLU 887 -5.696 2.303 -4.267 279 HB2 GLU 887 HB1 GLU 887 -4.558 4.464 -5.322 280 HB3 GLU 887 HB2 GLU 887 -3.432 4.274 -3.987 281 HG2 GLU 887 HG1 GLU 887 -2.568 3.135 -5.953 282 HG3 GLU 887 HG2 GLU 887 -2.958 1.944 -4.719 283 H SER 888 HN SER 888 -5.089 4.363 -1.473 284 HA SER 888 HA SER 888 -3.557 2.423 0.049 285 HB2 SER 888 HB1 SER 888 -3.514 4.826 0.511 286 HB3 SER 888 HB2 SER 888 -5.229 4.760 0.949 287 HG SER 888 HG1 SER 888 -3.815 4.659 2.779 288 H SER 889 HN SER 889 -6.966 3.018 -0.437 289 HA SER 889 HA SER 889 -7.984 1.082 1.513 290 HB2 SER 889 HB1 SER 889 -9.247 3.114 0.669 291 HB3 SER 889 HB2 SER 889 -9.366 2.295 -0.902 292 HG SER 889 HG1 SER 889 -10.559 1.630 1.576 293 H ARG 890 HN ARG 890 -9.541 -0.660 0.526 294 HA ARG 890 HA ARG 890 -8.753 -1.802 -2.009 295 HB2 ARG 890 HB1 ARG 890 -8.072 -3.977 -1.306 296 HB3 ARG 890 HB2 ARG 890 -7.029 -2.780 -0.547 297 HG2 ARG 890 HG1 ARG 890 -8.458 -3.038 1.553 298 HG3 ARG 890 HG2 ARG 890 -9.227 -4.425 0.760 299 HD2 ARG 890 HD1 ARG 890 -6.288 -4.079 1.472 300 HD3 ARG 890 HD2 ARG 890 -7.423 -5.187 2.232 301 HE ARG 890 HE ARG 890 -5.993 -5.527 -0.306 302 HH11 ARG 890 HH11 ARG 890 -8.699 -6.837 1.566 303 HH12 ARG 890 HH12 ARG 890 -8.646 -8.323 0.613 304 HH21 ARG 890 HH21 ARG 890 -6.125 -7.499 -1.413 305 HH22 ARG 890 HH22 ARG 890 -7.357 -8.639 -0.900 306 H TRP 891 HN TRP 891 -10.349 -2.687 -3.006 307 HA TRP 891 HA TRP 891 -12.962 -3.146 -1.612 308 HB2 TRP 891 HB1 TRP 891 -12.777 -1.311 -3.322 309 HB3 TRP 891 HB2 TRP 891 -12.423 -2.535 -4.535 310 HD1 TRP 891 HD1 TRP 891 -15.106 -0.713 -2.873 311 HE1 TRP 891 HE1 TRP 891 -17.405 -1.355 -3.783 312 HE3 TRP 891 HE3 TRP 891 -13.806 -5.043 -5.273 313 HZ2 TRP 891 HZ2 TRP 891 -18.608 -3.709 -4.966 314 HZ3 TRP 891 HZ3 TRP 891 -15.608 -6.529 -6.192 315 HH2 TRP 891 HH2 TRP 891 -17.962 -5.901 -5.945 316 H ILE 892 HN ILE 892 -13.954 -5.156 -1.786 317 HA ILE 892 HA ILE 892 -12.840 -7.178 -3.649 318 HB ILE 892 HB ILE 892 -12.649 -8.844 -1.907 319 HG12 ILE 892 HG11 ILE 892 -13.163 -6.696 0.184 320 HG13 ILE 892 HG12 ILE 892 -14.415 -7.795 -0.391 321 HG21 ILE 892 HG21 ILE 892 -11.043 -6.401 -1.048 322 HG22 ILE 892 HG22 ILE 892 -10.624 -8.101 -0.825 323 HG23 ILE 892 HG23 ILE 892 -10.667 -7.422 -2.450 324 HD11 ILE 892 HD1 ILE 892 -11.881 -8.767 0.932 325 HD12 ILE 892 HD2 ILE 892 -13.475 -8.614 1.682 326 HD13 ILE 892 HD3 ILE 892 -13.257 -9.743 0.324 327 H CYS 893 HN CYS 893 -14.157 -9.098 -3.916 328 HA CYS 893 HA CYS 893 -16.860 -8.835 -4.272 329 HB2 CYS 893 HB1 CYS 893 -15.326 -11.344 -3.454 330 HB3 CYS 893 HB2 CYS 893 -16.952 -11.287 -4.141 331 H MET 894 HN MET 894 -15.338 -9.951 -1.131 332 HA MET 894 HA MET 894 -17.876 -10.706 -0.016 333 HB2 MET 894 HB1 MET 894 -15.375 -9.926 1.520 334 HB3 MET 894 HB2 MET 894 -16.738 -10.868 2.115 335 HG2 MET 894 HG1 MET 894 -16.253 -12.637 0.451 336 HG3 MET 894 HG2 MET 894 -14.850 -11.722 -0.115 337 HE1 MET 894 HE1 MET 894 -13.136 -14.723 1.643 338 HE2 MET 894 HE2 MET 894 -14.628 -14.728 0.675 339 HE3 MET 894 HE3 MET 894 -13.242 -13.732 0.171 340 H ASN 895 HN ASN 895 -16.454 -7.585 -0.401 341 HA ASN 895 HA ASN 895 -18.172 -6.242 1.596 342 HB2 ASN 895 HB1 ASN 895 -16.441 -4.856 1.687 343 HB3 ASN 895 HB2 ASN 895 -15.598 -5.756 0.441 344 HD21 ASN 895 HD21 ASN 895 -16.352 -5.186 -1.919 345 HD22 ASN 895 HD22 ASN 895 -16.560 -3.458 -2.186 346 H ASN 896 HN ASN 896 -18.421 -7.217 -1.664 347 HA ASN 896 HA ASN 896 -19.569 -5.051 -2.981 348 HB2 ASN 896 HB1 ASN 896 -18.802 -7.159 -4.059 349 HB3 ASN 896 HB2 ASN 896 -20.178 -8.005 -3.341 350 HD21 ASN 896 HD21 ASN 896 -21.278 -8.639 -5.199 351 HD22 ASN 896 HD22 ASN 896 -21.893 -7.472 -6.341 352 H SER 897 HN SER 897 -21.484 -4.144 -3.193 353 HA SER 897 HA SER 897 -23.623 -4.285 -1.378 354 HB2 SER 897 HB1 SER 897 -23.530 -3.475 -4.309 355 HB3 SER 897 HB2 SER 897 -24.920 -3.201 -3.257 356 HG SER 897 HG1 SER 897 -23.516 -1.373 -3.316 357 H ASP 898 HN ASP 898 -23.355 -5.879 -4.529 358 HA ASP 898 HA ASP 898 -26.020 -7.080 -4.278 359 HB2 ASP 898 HB1 ASP 898 -24.058 -7.511 -6.528 360 HB3 ASP 898 HB2 ASP 898 -25.799 -7.728 -6.557 361 H LYS 899 HN LYS 899 -26.196 -8.673 -2.972 362 HA LYS 899 HA LYS 899 -24.332 -10.636 -2.121 363 HB2 LYS 899 HB1 LYS 899 -27.294 -10.653 -2.113 364 HB3 LYS 899 HB2 LYS 899 -26.225 -11.744 -1.191 365 HG2 LYS 899 HG1 LYS 899 -26.445 -8.765 -0.833 366 HG3 LYS 899 HG2 LYS 899 -27.237 -9.992 0.172 367 HD2 LYS 899 HD1 LYS 899 -25.323 -9.545 1.441 368 HD3 LYS 899 HD2 LYS 899 -24.773 -10.914 0.415 369 HE2 LYS 899 HE1 LYS 899 -23.079 -9.532 -0.113 370 HE3 LYS 899 HE2 LYS 899 -24.334 -9.031 -1.275 371 HZ1 LYS 899 HZ1 LYS 899 -23.227 -7.133 -0.163 372 HZ2 LYS 899 HZ2 LYS 899 -24.839 -7.135 0.112 373 HZ3 LYS 899 HZ3 LYS 899 -23.801 -7.621 1.293 374 H ARG 900 HN ARG 900 -26.159 -10.593 -5.044 375 HA ARG 900 HA ARG 900 -25.993 -13.424 -5.754 376 HB2 ARG 900 HB1 ARG 900 -26.427 -10.843 -7.313 377 HB3 ARG 900 HB2 ARG 900 -26.316 -12.418 -8.101 378 HG2 ARG 900 HG1 ARG 900 -28.221 -13.247 -6.734 379 HG3 ARG 900 HG2 ARG 900 -28.357 -11.655 -5.961 380 HD2 ARG 900 HD1 ARG 900 -28.798 -10.623 -8.190 381 HD3 ARG 900 HD2 ARG 900 -28.635 -12.206 -8.947 382 HE ARG 900 HE ARG 900 -30.720 -12.865 -8.148 383 HH11 ARG 900 HH11 ARG 900 -30.014 -9.724 -6.751 384 HH12 ARG 900 HH12 ARG 900 -31.649 -9.514 -6.188 385 HH21 ARG 900 HH21 ARG 900 -32.776 -12.523 -7.405 386 HH22 ARG 900 HH22 ARG 900 -33.164 -11.058 -6.553 387 H PHE 901 HN PHE 901 -23.712 -10.781 -5.900 388 HA PHE 901 HA PHE 901 -21.754 -12.587 -7.213 389 HB2 PHE 901 HB1 PHE 901 -21.732 -9.621 -7.693 390 HB3 PHE 901 HB2 PHE 901 -20.893 -10.886 -8.585 391 HD1 PHE 901 HD1 PHE 901 -21.889 -11.710 -10.612 392 HD2 PHE 901 HD2 PHE 901 -24.286 -9.430 -7.865 393 HE1 PHE 901 HE1 PHE 901 -23.728 -11.673 -12.264 394 HE2 PHE 901 HE2 PHE 901 -26.124 -9.367 -9.530 395 HZ PHE 901 HZ PHE 901 -25.856 -10.502 -11.724 396 H ALA 902 HN ALA 902 -22.258 -11.436 -4.388 397 HA ALA 902 HA ALA 902 -19.797 -10.094 -3.739 398 HB1 ALA 902 HB1 ALA 902 -22.004 -9.426 -2.787 399 HB2 ALA 902 HB2 ALA 902 -22.092 -11.000 -1.952 400 HB3 ALA 902 HB3 ALA 902 -20.833 -9.823 -1.524 401 H ASP 903 HN ASP 903 -19.235 -12.666 -4.676 402 HA ASP 903 HA ASP 903 -17.289 -13.357 -2.650 403 HB2 ASP 903 HB1 ASP 903 -19.508 -15.255 -3.249 404 HB3 ASP 903 HB2 ASP 903 -17.884 -15.922 -3.182 405 H CYS 904 HN CYS 904 -15.442 -14.214 -3.377 406 HA CYS 904 HA CYS 904 -14.644 -13.789 -6.019 407 HB2 CYS 904 HB1 CYS 904 -13.502 -15.600 -3.836 408 HB3 CYS 904 HB2 CYS 904 -12.635 -15.035 -5.266 409 H SER 905 HN SER 905 -16.595 -16.299 -4.871 410 HA SER 905 HA SER 905 -15.857 -18.302 -6.966 411 HB2 SER 905 HB1 SER 905 -17.807 -18.509 -4.648 412 HB3 SER 905 HB2 SER 905 -17.430 -19.779 -5.826 413 HG SER 905 HG1 SER 905 -15.627 -18.572 -3.968 414 H LYS 906 HN LYS 906 -18.081 -15.701 -6.442 415 HA LYS 906 HA LYS 906 -20.285 -16.819 -8.060 416 HB2 LYS 906 HB1 LYS 906 -19.666 -14.064 -6.954 417 HB3 LYS 906 HB2 LYS 906 -21.139 -14.458 -7.839 418 HG2 LYS 906 HG1 LYS 906 -20.338 -15.620 -5.166 419 HG3 LYS 906 HG2 LYS 906 -21.518 -14.341 -5.467 420 HD2 LYS 906 HD1 LYS 906 -22.942 -16.100 -5.233 421 HD3 LYS 906 HD2 LYS 906 -22.693 -16.186 -6.979 422 HE2 LYS 906 HE1 LYS 906 -20.930 -17.952 -6.582 423 HE3 LYS 906 HE2 LYS 906 -21.223 -17.820 -4.846 424 HZ1 LYS 906 HZ1 LYS 906 -22.462 -19.670 -5.816 425 HZ2 LYS 906 HZ2 LYS 906 -23.509 -18.564 -5.237 426 HZ3 LYS 906 HZ3 LYS 906 -23.249 -18.681 -6.846 427 H SER 907 HN SER 907 -21.187 -15.127 -9.669 428 HA SER 907 HA SER 907 -19.346 -15.154 -11.965 429 HB2 SER 907 HB1 SER 907 -21.611 -16.208 -11.989 430 HB3 SER 907 HB2 SER 907 -22.325 -14.589 -11.880 431 HG SER 907 HG1 SER 907 -22.105 -15.458 -14.053 432 H GLN 908 HN GLN 908 -20.632 -13.177 -13.493 433 HA GLN 908 HA GLN 908 -20.064 -10.521 -12.316 434 HB2 GLN 908 HB1 GLN 908 -17.918 -11.614 -13.055 435 HB3 GLN 908 HB2 GLN 908 -18.548 -11.687 -14.700 436 HG2 GLN 908 HG1 GLN 908 -18.494 -9.298 -14.915 437 HG3 GLN 908 HG2 GLN 908 -18.280 -9.069 -13.195 438 HE21 GLN 908 HE21 GLN 908 -16.602 -9.249 -16.126 439 HE22 GLN 908 HE22 GLN 908 -14.994 -9.551 -15.481 440 H GLU 909 HN GLU 909 -20.864 -8.720 -13.812 441 HA GLU 909 HA GLU 909 -23.297 -9.437 -15.198 442 HB2 GLU 909 HB1 GLU 909 -21.597 -6.940 -15.432 443 HB3 GLU 909 HB2 GLU 909 -23.219 -7.100 -16.075 444 HG2 GLU 909 HG1 GLU 909 -22.369 -7.045 -13.175 445 HG3 GLU 909 HG2 GLU 909 -23.209 -5.780 -14.048 446 H MET 910 HN MET 910 -20.001 -8.762 -16.351 447 HA MET 910 HA MET 910 -20.562 -10.125 -18.943 448 HB2 MET 910 HB1 MET 910 -19.243 -7.379 -18.721 449 HB3 MET 910 HB2 MET 910 -19.377 -8.348 -20.187 450 HG2 MET 910 HG1 MET 910 -21.844 -8.126 -20.100 451 HG3 MET 910 HG2 MET 910 -21.691 -7.123 -18.648 452 HE1 MET 910 HE1 MET 910 -22.801 -4.500 -21.310 453 HE2 MET 910 HE2 MET 910 -23.330 -6.191 -21.169 454 HE3 MET 910 HE3 MET 910 -23.114 -5.201 -19.706 455 H SER 911 HN SER 911 -18.677 -11.296 -19.676 456 HA SER 911 HA SER 911 -16.391 -11.537 -17.904 457 HB2 SER 911 HB1 SER 911 -15.340 -12.527 -20.093 458 HB3 SER 911 HB2 SER 911 -16.499 -13.402 -19.124 459 HG SER 911 HG1 SER 911 -17.018 -13.454 -21.386 460 H ASN 912 HN ASN 912 -14.249 -10.946 -18.328 461 HA ASN 912 HA ASN 912 -14.278 -8.130 -18.478 462 HB2 ASN 912 HB1 ASN 912 -12.611 -9.332 -17.114 463 HB3 ASN 912 HB2 ASN 912 -11.759 -9.827 -18.591 464 HD21 ASN 912 HD21 ASN 912 -12.824 -6.996 -16.687 465 HD22 ASN 912 HD22 ASN 912 -11.740 -5.854 -17.471 466 H GLU 913 HN GLU 913 -13.384 -10.396 -21.018 467 HA GLU 913 HA GLU 913 -12.307 -8.490 -22.890 468 HB2 GLU 913 HB1 GLU 913 -11.943 -10.919 -22.968 469 HB3 GLU 913 HB2 GLU 913 -13.658 -11.183 -23.327 470 HG2 GLU 913 HG1 GLU 913 -13.438 -10.122 -25.492 471 HG3 GLU 913 HG2 GLU 913 -11.833 -9.502 -25.084 472 H GLU 914 HN GLU 914 -15.640 -9.219 -22.006 473 HA GLU 914 HA GLU 914 -16.754 -7.842 -24.381 474 HB2 GLU 914 HB1 GLU 914 -18.102 -9.087 -21.951 475 HB3 GLU 914 HB2 GLU 914 -18.936 -8.394 -23.332 476 HG2 GLU 914 HG1 GLU 914 -17.141 -10.854 -23.316 477 HG3 GLU 914 HG2 GLU 914 -18.891 -10.829 -23.466 478 H ILE 915 HN ILE 915 -16.399 -7.245 -20.823 479 HA ILE 915 HA ILE 915 -17.658 -4.634 -21.107 480 HB ILE 915 HB ILE 915 -17.960 -5.393 -19.001 481 HG12 ILE 915 HG11 ILE 915 -16.828 -3.833 -17.500 482 HG13 ILE 915 HG12 ILE 915 -15.598 -3.478 -18.705 483 HG21 ILE 915 HG21 ILE 915 -16.366 -7.189 -18.747 484 HG22 ILE 915 HG22 ILE 915 -15.015 -6.031 -18.624 485 HG23 ILE 915 HG23 ILE 915 -16.268 -6.138 -17.355 486 HD11 ILE 915 HD1 ILE 915 -17.481 -2.620 -20.202 487 HD12 ILE 915 HD2 ILE 915 -18.583 -2.862 -18.869 488 HD13 ILE 915 HD3 ILE 915 -17.221 -1.710 -18.738 489 H ASN 916 HN ASN 916 -14.205 -5.538 -20.701 490 HA ASN 916 HA ASN 916 -13.255 -2.923 -20.879 491 HB2 ASN 916 HB1 ASN 916 -11.084 -3.779 -21.086 492 HB3 ASN 916 HB2 ASN 916 -11.970 -4.947 -20.141 493 HD21 ASN 916 HD21 ASN 916 -10.454 -6.596 -20.571 494 HD22 ASN 916 HD22 ASN 916 -10.167 -7.209 -22.192 495 H GLU 917 HN GLU 917 -14.229 -4.898 -23.574 496 HA GLU 917 HA GLU 917 -13.407 -3.252 -25.755 497 HB2 GLU 917 HB1 GLU 917 -15.393 -5.383 -25.201 498 HB3 GLU 917 HB2 GLU 917 -15.793 -4.357 -26.557 499 HG2 GLU 917 HG1 GLU 917 -13.130 -5.809 -26.205 500 HG3 GLU 917 HG2 GLU 917 -14.481 -6.414 -27.161 501 H GLU 918 HN GLU 918 -16.159 -2.874 -23.551 502 HA GLU 918 HA GLU 918 -17.682 -0.992 -25.111 503 HB2 GLU 918 HB1 GLU 918 -18.409 -2.398 -23.031 504 HB3 GLU 918 HB2 GLU 918 -17.630 -1.151 -22.064 505 HG2 GLU 918 HG1 GLU 918 -20.009 -0.736 -22.188 506 HG3 GLU 918 HG2 GLU 918 -19.134 0.565 -22.964 507 H LEU 919 HN LEU 919 -15.097 -0.624 -22.704 508 HA LEU 919 HA LEU 919 -15.082 2.324 -22.910 509 HB2 LEU 919 HB1 LEU 919 -13.120 0.452 -21.535 510 HB3 LEU 919 HB2 LEU 919 -13.207 2.196 -21.394 511 HG LEU 919 HG LEU 919 -15.785 1.426 -20.661 512 HD11 LEU 919 HD11 LEU 919 -13.809 -0.672 -19.703 513 HD12 LEU 919 HD12 LEU 919 -15.329 -0.325 -18.854 514 HD13 LEU 919 HD13 LEU 919 -15.357 -0.902 -20.526 515 HD21 LEU 919 HD21 LEU 919 -14.941 1.924 -18.339 516 HD22 LEU 919 HD22 LEU 919 -13.290 1.938 -19.018 517 HD23 LEU 919 HD23 LEU 919 -14.471 3.129 -19.564 518 H GLY 920 HN GLY 920 -13.178 -0.438 -24.038 519 HA2 GLY 920 HA1 GLY 920 -12.008 -0.540 -26.116 520 HA3 GLY 920 HA2 GLY 920 -11.853 1.219 -26.146 521 H ILE 921 HN ILE 921 -11.081 -1.220 -23.648 522 HA ILE 921 HA ILE 921 -8.241 -0.269 -23.487 523 HB ILE 921 HB ILE 921 -8.385 -0.192 -21.095 524 HG12 ILE 921 HG11 ILE 921 -11.305 -1.013 -21.376 525 HG13 ILE 921 HG12 ILE 921 -9.982 -1.977 -20.700 526 HG21 ILE 921 HG21 ILE 921 -10.703 1.433 -22.187 527 HG22 ILE 921 HG22 ILE 921 -9.659 1.804 -20.800 528 HG23 ILE 921 HG23 ILE 921 -8.984 1.820 -22.430 529 HD11 ILE 921 HD1 ILE 921 -11.220 -1.154 -18.882 530 HD12 ILE 921 HD2 ILE 921 -9.686 -0.265 -18.904 531 HD13 ILE 921 HD3 ILE 921 -11.179 0.515 -19.492 532 H GLY 922 HN GLY 922 -7.309 -1.817 -21.476 533 HA2 GLY 922 HA1 GLY 922 -7.779 -4.642 -22.025 534 HA3 GLY 922 HA2 GLY 922 -6.169 -4.018 -22.413 535 H GLN 923 HN GLN 923 -7.608 -5.662 -20.256 536 HA GLN 923 HA GLN 923 -5.737 -5.126 -18.099 537 HB2 GLN 923 HB1 GLN 923 -7.330 -4.730 -16.319 538 HB3 GLN 923 HB2 GLN 923 -7.570 -3.554 -17.605 539 HG2 GLN 923 HG1 GLN 923 -9.390 -5.273 -18.461 540 HG3 GLN 923 HG2 GLN 923 -9.327 -5.890 -16.808 541 HE21 GLN 923 HE21 GLN 923 -8.881 -2.769 -15.923 542 HE22 GLN 923 HE22 GLN 923 -10.515 -2.198 -16.128 543 H ASP 924 HN ASP 924 -6.361 -6.711 -16.148 544 HA ASP 924 HA ASP 924 -6.349 -8.763 -15.293 545 HB2 ASP 924 HB1 ASP 924 -8.299 -9.400 -17.516 546 HB3 ASP 924 HB2 ASP 924 -7.790 -10.550 -16.307 547 H GLU 925 HN GLU 925 -5.079 -8.297 -18.237 548 HA GLU 925 HA GLU 925 -3.498 -10.632 -18.770 549 HB2 GLU 925 HB1 GLU 925 -2.071 -9.090 -19.963 550 HB3 GLU 925 HB2 GLU 925 -3.777 -8.635 -20.182 551 HG2 GLU 925 HG1 GLU 925 -3.302 -6.972 -18.222 552 HG3 GLU 925 HG2 GLU 925 -1.616 -7.186 -18.687 553 H ALA 926 HN ALA 926 -3.134 -8.079 -16.557 554 HA ALA 926 HA ALA 926 -2.119 -7.690 -14.560 555 HB1 ALA 926 HB1 ALA 926 -1.020 -10.505 -14.722 556 HB2 ALA 926 HB2 ALA 926 -1.163 -9.500 -13.267 557 HB3 ALA 926 HB3 ALA 926 -2.633 -10.088 -14.078 558 H ASP 927 HN ASP 927 0.023 -9.361 -16.782 559 HA ASP 927 HA ASP 927 2.461 -8.193 -15.852 560 HB2 ASP 927 HB1 ASP 927 2.118 -10.327 -17.209 561 HB3 ASP 927 HB2 ASP 927 1.897 -9.306 -18.628 562 H ALA 928 HN ALA 928 0.067 -6.723 -17.505 563 HA ALA 928 HA ALA 928 -0.278 -4.836 -18.766 564 HB1 ALA 928 HB1 ALA 928 0.094 -4.079 -16.457 565 HB2 ALA 928 HB2 ALA 928 1.816 -3.823 -16.810 566 HB3 ALA 928 HB3 ALA 928 0.581 -2.849 -17.637 567 H1 ALA 1 HT1 ALA 1 -8.768 2.124 -6.580 568 H2 ALA 1 HT2 ALA 1 -7.169 2.463 -6.579 569 H3 ALA 1 HT3 ALA 1 -7.869 1.825 -5.227 570 HA ALA 1 HA ALA 1 -6.528 0.220 -6.536 571 HB1 ALA 1 HB1 ALA 1 -9.508 -0.429 -6.335 572 HB2 ALA 1 HB2 ALA 1 -8.178 -1.600 -6.448 573 HB3 ALA 1 HB3 ALA 1 -8.333 -0.573 -5.010 574 H ARG 2 HN ARG 2 -6.293 -0.954 -8.568 575 HA ARG 2 HA ARG 2 -6.733 0.477 -10.917 576 HB2 ARG 2 HB1 ARG 2 -5.161 -1.429 -10.803 577 HB3 ARG 2 HB2 ARG 2 -6.491 -2.548 -10.575 578 HG2 ARG 2 HG1 ARG 2 -5.718 -2.677 -12.877 579 HG3 ARG 2 HG2 ARG 2 -7.347 -2.082 -12.851 580 HD2 ARG 2 HD1 ARG 2 -5.587 0.214 -12.772 581 HD3 ARG 2 HD2 ARG 2 -4.978 -0.874 -13.993 582 HE ARG 2 HE ARG 2 -7.601 0.539 -13.974 583 HH11 ARG 2 HH11 ARG 2 -5.582 -1.670 -15.815 584 HH12 ARG 2 HH12 ARG 2 -6.374 -1.247 -17.306 585 HH21 ARG 2 HH21 ARG 2 -8.529 1.004 -15.816 586 HH22 ARG 2 HH22 ARG 2 -8.025 0.239 -17.307 587 H THR 3 HN THR 3 -8.538 1.077 -11.940 588 HA THR 3 HA THR 3 -10.266 -0.928 -13.052 589 HB THR 3 HB THR 3 -11.322 -0.656 -10.754 590 HG1 THR 3 HG1 THR 3 -12.870 -1.252 -12.013 591 HG21 THR 3 HG21 THR 3 -12.054 2.170 -11.615 592 HG22 THR 3 HG22 THR 3 -12.554 1.316 -10.150 593 HG23 THR 3 HG23 THR 3 -10.859 1.754 -10.364 594 H MLZ 4 HN MLZ 4 -12.433 0.921 -13.625 595 HA MLZ 4 HA MLZ 4 -11.366 3.034 -15.318 596 HB2 MLZ 4 HB1 MLZ 4 -11.834 1.992 -17.409 597 HB3 MLZ 4 HB2 MLZ 4 -10.892 0.813 -16.547 598 HG2 MLZ 4 HG1 MLZ 4 -13.954 0.729 -16.700 599 HG3 MLZ 4 HG2 MLZ 4 -12.867 -0.060 -17.827 600 HD2 MLZ 4 HD1 MLZ 4 -11.884 -1.327 -15.947 601 HD3 MLZ 4 HD2 MLZ 4 -13.130 -0.686 -14.887 602 HE2 MLZ 4 HE1 MLZ 4 -14.898 -1.759 -16.145 603 HE3 MLZ 4 HE2 MLZ 4 -13.800 -2.156 -17.473 604 HZ MLZ 4 HZ1 MLZ 4 -13.391 -3.270 -14.739 605 HCM1 MLZ 4 HC1 MLZ 4 -14.420 -5.289 -15.593 606 HCM2 MLZ 4 HC2 MLZ 4 -15.573 -3.943 -15.675 607 HCM3 MLZ 4 HC3 MLZ 4 -14.679 -4.459 -17.123 608 HZ2 MLZ 4 HZ2 MLZ 4 -12.638 -3.717 -16.120 609 H GLN 5 HN GLN 5 -13.272 3.759 -16.841 610 HA GLN 5 HA GLN 5 -15.817 3.860 -15.290 611 HB2 GLN 5 HB1 GLN 5 -15.769 6.326 -15.735 612 HB3 GLN 5 HB2 GLN 5 -14.778 5.711 -14.422 613 HG2 GLN 5 HG1 GLN 5 -13.581 6.278 -17.172 614 HG3 GLN 5 HG2 GLN 5 -13.827 7.557 -16.006 615 HE21 GLN 5 HE21 GLN 5 -11.303 7.339 -16.776 616 HE22 GLN 5 HE22 GLN 5 -10.343 6.558 -15.528 617 H THR 6 HN THR 6 -17.130 2.819 -16.729 618 HA THR 6 HA THR 6 -16.931 3.041 -19.518 619 HB THR 6 HB THR 6 -19.396 2.201 -17.999 620 HG1 THR 6 HG1 THR 6 -17.155 0.699 -18.840 621 HG21 THR 6 HG21 THR 6 -19.620 0.604 -19.903 622 HG22 THR 6 HG22 THR 6 -19.757 2.285 -20.440 623 HG23 THR 6 HG23 THR 6 -18.245 1.391 -20.713 624 H ALA 7 HN ALA 7 -18.964 4.915 -17.286 625 HA ALA 7 HA ALA 7 -20.485 6.570 -17.580 626 HB1 ALA 7 HB1 ALA 7 -18.434 7.455 -19.625 627 HB2 ALA 7 HB2 ALA 7 -19.570 8.497 -18.738 628 HB3 ALA 7 HB3 ALA 7 -18.285 7.637 -17.860 629 H ARG 8 HN ARG 8 -21.343 4.358 -18.967 630 HA ARG 8 HA ARG 8 -23.173 5.404 -20.956 631 HB2 ARG 8 HB1 ARG 8 -20.930 4.647 -22.099 632 HB3 ARG 8 HB2 ARG 8 -21.489 3.002 -21.787 633 HG2 ARG 8 HG1 ARG 8 -23.601 3.517 -23.032 634 HG3 ARG 8 HG2 ARG 8 -23.012 5.158 -23.339 635 HD2 ARG 8 HD1 ARG 8 -21.744 2.569 -24.295 636 HD3 ARG 8 HD2 ARG 8 -22.674 3.688 -25.287 637 HE ARG 8 HE ARG 8 -20.893 5.410 -24.819 638 HH11 ARG 8 HH11 ARG 8 -19.973 2.005 -24.823 639 HH12 ARG 8 HH12 ARG 8 -18.271 2.389 -24.845 640 HH21 ARG 8 HH21 ARG 8 -18.705 5.793 -24.997 641 HH22 ARG 8 HH22 ARG 8 -17.601 4.449 -25.070 642 H TYR 9 HN TYR 9 -24.986 4.501 -20.680 643 HA TYR 9 HA TYR 9 -25.628 2.494 -18.708 644 HB2 TYR 9 HB1 TYR 9 -27.957 2.814 -19.537 645 HB3 TYR 9 HB2 TYR 9 -27.148 4.276 -19.023 646 HD1 TYR 9 HD1 TYR 9 -26.758 6.118 -20.533 647 HD2 TYR 9 HD2 TYR 9 -28.337 2.379 -21.999 648 HE1 TYR 9 HE1 TYR 9 -27.304 7.203 -22.706 649 HE2 TYR 9 HE2 TYR 9 -28.895 3.474 -24.173 650 HH TYR 9 HH TYR 9 -28.193 6.934 -24.797 Start of MODEL 14 1 H1 GLY 850 HT1 GLY 850 5.118 2.319 -8.196 2 H2 GLY 850 HT2 GLY 850 4.105 2.333 -6.911 3 H3 GLY 850 HT3 GLY 850 4.111 3.592 -7.963 4 HA2 GLY 850 HA1 GLY 850 2.172 2.228 -8.349 5 HA3 GLY 850 HA2 GLY 850 3.274 2.198 -9.737 6 H SER 851 HN SER 851 1.996 0.202 -10.153 7 HA SER 851 HA SER 851 1.700 -2.029 -10.289 8 HB2 SER 851 HB1 SER 851 4.182 -1.870 -10.719 9 HB3 SER 851 HB2 SER 851 4.437 -2.368 -9.041 10 HG SER 851 HG1 SER 851 3.356 -3.814 -11.216 11 H ARG 852 HN ARG 852 2.294 -4.206 -8.792 12 HA ARG 852 HA ARG 852 1.463 -5.551 -7.163 13 HB2 ARG 852 HB1 ARG 852 2.075 -3.278 -5.253 14 HB3 ARG 852 HB2 ARG 852 2.021 -5.005 -4.896 15 HG2 ARG 852 HG1 ARG 852 4.085 -3.704 -6.709 16 HG3 ARG 852 HG2 ARG 852 4.326 -4.080 -5.009 17 HD2 ARG 852 HD1 ARG 852 3.554 -6.167 -7.069 18 HD3 ARG 852 HD2 ARG 852 5.238 -5.772 -6.664 19 HE ARG 852 HE ARG 852 3.925 -6.330 -4.233 20 HH11 ARG 852 HH11 ARG 852 4.814 -8.141 -7.097 21 HH12 ARG 852 HH12 ARG 852 4.915 -9.648 -6.225 22 HH21 ARG 852 HH21 ARG 852 4.068 -8.284 -3.182 23 HH22 ARG 852 HH22 ARG 852 4.506 -9.717 -4.065 24 H ARG 853 HN ARG 853 -0.492 -3.451 -8.244 25 HA ARG 853 HA ARG 853 -2.705 -2.977 -8.187 26 HB2 ARG 853 HB1 ARG 853 -2.953 -5.469 -6.458 27 HB3 ARG 853 HB2 ARG 853 -4.275 -4.663 -7.285 28 HG2 ARG 853 HG1 ARG 853 -1.908 -5.982 -8.688 29 HG3 ARG 853 HG2 ARG 853 -3.499 -6.694 -8.453 30 HD2 ARG 853 HD1 ARG 853 -4.512 -4.797 -9.756 31 HD3 ARG 853 HD2 ARG 853 -2.892 -4.185 -10.069 32 HE ARG 853 HE ARG 853 -4.002 -6.818 -11.025 33 HH11 ARG 853 HH11 ARG 853 -1.794 -4.112 -11.664 34 HH12 ARG 853 HH12 ARG 853 -1.362 -4.825 -13.217 35 HH21 ARG 853 HH21 ARG 853 -3.188 -7.626 -12.953 36 HH22 ARG 853 HH22 ARG 853 -2.066 -6.605 -13.871 37 H ALA 854 HN ALA 854 -4.689 -2.654 -6.809 38 HA ALA 854 HA ALA 854 -5.715 -1.046 -5.712 39 HB1 ALA 854 HB1 ALA 854 -5.236 -2.365 -3.714 40 HB2 ALA 854 HB2 ALA 854 -3.748 -1.424 -3.444 41 HB3 ALA 854 HB3 ALA 854 -5.331 -0.623 -3.384 42 H SER 855 HN SER 855 -5.813 1.154 -5.176 43 HA SER 855 HA SER 855 -3.627 2.994 -5.335 44 HB2 SER 855 HB1 SER 855 -4.058 3.999 -7.496 45 HB3 SER 855 HB2 SER 855 -3.580 2.322 -7.669 46 HG SER 855 HG1 SER 855 -5.378 2.918 -8.999 47 H VAL 856 HN VAL 856 -4.481 5.237 -5.816 48 HA VAL 856 HA VAL 856 -6.609 5.922 -3.997 49 HB VAL 856 HB VAL 856 -6.283 8.231 -4.773 50 HG11 VAL 856 HG11 VAL 856 -4.903 7.346 -2.997 51 HG12 VAL 856 HG12 VAL 856 -3.694 6.764 -4.170 52 HG13 VAL 856 HG13 VAL 856 -3.999 8.503 -3.981 53 HG21 VAL 856 HG21 VAL 856 -4.552 8.819 -6.371 54 HG22 VAL 856 HG22 VAL 856 -4.206 7.112 -6.703 55 HG23 VAL 856 HG23 VAL 856 -5.776 7.817 -7.159 56 H GLY 857 HN GLY 857 -8.376 7.329 -4.465 57 HA2 GLY 857 HA1 GLY 857 -9.706 7.123 -7.141 58 HA3 GLY 857 HA2 GLY 857 -10.601 6.778 -5.652 59 H SER 858 HN SER 858 -8.289 9.279 -6.777 60 HA SER 858 HA SER 858 -9.242 11.221 -4.974 61 HB2 SER 858 HB1 SER 858 -7.520 11.572 -7.444 62 HB3 SER 858 HB2 SER 858 -7.540 12.687 -6.061 63 HG SER 858 HG1 SER 858 -6.610 11.103 -4.780 64 H GLU 859 HN GLU 859 -10.784 10.462 -7.525 65 HA GLU 859 HA GLU 859 -12.417 12.889 -7.590 66 HB2 GLU 859 HB1 GLU 859 -10.669 13.293 -9.335 67 HB3 GLU 859 HB2 GLU 859 -11.310 11.899 -10.234 68 HG2 GLU 859 HG1 GLU 859 -13.367 13.037 -10.675 69 HG3 GLU 859 HG2 GLU 859 -13.027 14.258 -9.442 70 H PHE 860 HN PHE 860 -14.429 12.642 -8.672 71 HA PHE 860 HA PHE 860 -15.577 9.981 -8.124 72 HB2 PHE 860 HB1 PHE 860 -16.908 12.630 -8.793 73 HB3 PHE 860 HB2 PHE 860 -17.734 11.158 -8.314 74 HD1 PHE 860 HD1 PHE 860 -17.456 10.234 -5.999 75 HD2 PHE 860 HD2 PHE 860 -15.849 14.070 -7.131 76 HE1 PHE 860 HE1 PHE 860 -17.183 10.824 -3.602 77 HE2 PHE 860 HE2 PHE 860 -15.578 14.660 -4.734 78 HZ PHE 860 HZ PHE 860 -16.241 13.038 -2.967 79 H THR 861 HN THR 861 -15.685 12.278 -10.915 80 HA THR 861 HA THR 861 -16.274 11.991 -13.111 81 HB THR 861 HB THR 861 -15.302 9.184 -12.794 82 HG1 THR 861 HG1 THR 861 -13.319 10.037 -13.308 83 HG21 THR 861 HG21 THR 861 -15.641 10.941 -15.242 84 HG22 THR 861 HG22 THR 861 -14.454 9.624 -15.192 85 HG23 THR 861 HG23 THR 861 -16.152 9.245 -15.002 86 H GLU 862 HN GLU 862 -17.660 10.081 -14.603 87 HA GLU 862 HA GLU 862 -20.314 9.912 -13.354 88 HB2 GLU 862 HB1 GLU 862 -19.224 8.860 -15.992 89 HB3 GLU 862 HB2 GLU 862 -20.902 8.707 -15.451 90 HG2 GLU 862 HG1 GLU 862 -21.093 11.177 -15.315 91 HG3 GLU 862 HG2 GLU 862 -19.426 11.344 -15.859 92 H SER 863 HN SER 863 -21.485 7.790 -13.248 93 HA SER 863 HA SER 863 -20.390 5.982 -11.451 94 HB2 SER 863 HB1 SER 863 -22.575 5.476 -13.486 95 HB3 SER 863 HB2 SER 863 -22.234 4.481 -12.053 96 HG SER 863 HG1 SER 863 -23.882 6.139 -11.739 97 H ALA 864 HN ALA 864 -19.385 3.986 -11.495 98 HA ALA 864 HA ALA 864 -17.829 3.526 -14.015 99 HB1 ALA 864 HB1 ALA 864 -15.805 3.683 -12.597 100 HB2 ALA 864 HB2 ALA 864 -16.753 5.177 -12.507 101 HB3 ALA 864 HB3 ALA 864 -16.821 3.995 -11.179 102 H TRP 865 HN TRP 865 -16.190 1.599 -13.582 103 HA TRP 865 HA TRP 865 -17.544 -0.580 -12.017 104 HB2 TRP 865 HB1 TRP 865 -15.263 -0.643 -13.974 105 HB3 TRP 865 HB2 TRP 865 -15.852 -2.028 -13.074 106 HD1 TRP 865 HD1 TRP 865 -17.161 0.471 -15.710 107 HE1 TRP 865 HE1 TRP 865 -19.007 -0.615 -17.093 108 HE3 TRP 865 HE3 TRP 865 -17.423 -3.943 -13.251 109 HZ2 TRP 865 HZ2 TRP 865 -20.224 -3.287 -17.287 110 HZ3 TRP 865 HZ3 TRP 865 -18.926 -5.784 -14.020 111 HH2 TRP 865 HH2 TRP 865 -20.350 -5.465 -16.007 112 H VAL 866 HN VAL 866 -16.046 -1.951 -10.763 113 HA VAL 866 HA VAL 866 -13.533 -0.768 -9.806 114 HB VAL 866 HB VAL 866 -15.098 0.027 -8.137 115 HG11 VAL 866 HG11 VAL 866 -16.352 -1.455 -6.673 116 HG12 VAL 866 HG12 VAL 866 -16.844 -1.752 -8.343 117 HG13 VAL 866 HG13 VAL 866 -15.757 -2.889 -7.533 118 HG21 VAL 866 HG21 VAL 866 -14.053 -0.737 -6.139 119 HG22 VAL 866 HG22 VAL 866 -13.446 -2.194 -6.931 120 HG23 VAL 866 HG23 VAL 866 -12.827 -0.593 -7.412 121 H ARG 867 HN ARG 867 -11.999 -2.308 -9.315 122 HA ARG 867 HA ARG 867 -12.525 -5.089 -10.138 123 HB2 ARG 867 HB1 ARG 867 -10.340 -3.459 -10.389 124 HB3 ARG 867 HB2 ARG 867 -9.924 -4.295 -8.919 125 HG2 ARG 867 HG1 ARG 867 -10.097 -6.490 -10.107 126 HG3 ARG 867 HG2 ARG 867 -10.639 -5.664 -11.565 127 HD2 ARG 867 HD1 ARG 867 -8.478 -5.783 -12.135 128 HD3 ARG 867 HD2 ARG 867 -8.352 -4.280 -11.239 129 HE ARG 867 HE ARG 867 -7.128 -6.842 -10.651 130 HH11 ARG 867 HH11 ARG 867 -7.968 -3.841 -9.085 131 HH12 ARG 867 HH12 ARG 867 -7.177 -4.284 -7.591 132 HH21 ARG 867 HH21 ARG 867 -6.132 -7.350 -8.828 133 HH22 ARG 867 HH22 ARG 867 -6.028 -6.203 -7.511 134 H CYS 868 HN CYS 868 -12.422 -6.911 -8.773 135 HA CYS 868 HA CYS 868 -12.217 -6.551 -5.866 136 HB2 CYS 868 HB1 CYS 868 -13.611 -8.356 -6.650 137 HB3 CYS 868 HB2 CYS 868 -12.272 -9.038 -7.585 138 H ASP 869 HN ASP 869 -10.344 -5.885 -5.077 139 HA ASP 869 HA ASP 869 -7.734 -6.323 -6.181 140 HB2 ASP 869 HB1 ASP 869 -8.790 -5.518 -3.460 141 HB3 ASP 869 HB2 ASP 869 -7.074 -5.735 -3.731 142 H ASP 870 HN ASP 870 -9.738 -8.572 -4.543 143 HA ASP 870 HA ASP 870 -7.432 -10.310 -3.800 144 HB2 ASP 870 HB1 ASP 870 -10.304 -10.168 -2.901 145 HB3 ASP 870 HB2 ASP 870 -9.455 -11.684 -2.799 146 H CYS 871 HN CYS 871 -9.704 -9.906 -6.320 147 HA CYS 871 HA CYS 871 -8.861 -12.509 -7.522 148 HB2 CYS 871 HB1 CYS 871 -11.494 -11.001 -7.907 149 HB3 CYS 871 HB2 CYS 871 -10.952 -12.379 -8.885 150 H PHE 872 HN PHE 872 -10.539 -10.144 -9.152 151 HA PHE 872 HA PHE 872 -8.930 -8.460 -10.579 152 HB2 PHE 872 HB1 PHE 872 -8.482 -9.491 -12.688 153 HB3 PHE 872 HB2 PHE 872 -7.681 -10.438 -11.460 154 HD1 PHE 872 HD1 PHE 872 -10.230 -10.401 -14.092 155 HD2 PHE 872 HD2 PHE 872 -8.597 -12.726 -10.844 156 HE1 PHE 872 HE1 PHE 872 -11.392 -12.420 -14.950 157 HE2 PHE 872 HE2 PHE 872 -9.768 -14.740 -11.702 158 HZ PHE 872 HZ PHE 872 -11.170 -14.590 -13.752 159 H LYS 873 HN LYS 873 -11.675 -10.562 -10.409 160 HA LYS 873 HA LYS 873 -13.506 -9.976 -12.285 161 HB2 LYS 873 HB1 LYS 873 -13.615 -11.324 -10.109 162 HB3 LYS 873 HB2 LYS 873 -14.257 -9.844 -9.362 163 HG2 LYS 873 HG1 LYS 873 -16.238 -9.937 -10.657 164 HG3 LYS 873 HG2 LYS 873 -15.431 -10.834 -11.949 165 HD2 LYS 873 HD1 LYS 873 -16.839 -12.426 -10.989 166 HD3 LYS 873 HD2 LYS 873 -15.211 -12.787 -10.422 167 HE2 LYS 873 HE1 LYS 873 -15.963 -11.160 -8.406 168 HE3 LYS 873 HE2 LYS 873 -17.585 -11.612 -8.932 169 HZ1 LYS 873 HZ1 LYS 873 -16.900 -13.961 -8.629 170 HZ2 LYS 873 HZ2 LYS 873 -15.450 -13.473 -8.040 171 HZ3 LYS 873 HZ3 LYS 873 -16.819 -13.116 -7.216 172 H TRP 874 HN TRP 874 -15.251 -8.464 -12.554 173 HA TRP 874 HA TRP 874 -14.740 -5.753 -11.420 174 HB2 TRP 874 HB1 TRP 874 -15.828 -6.472 -14.155 175 HB3 TRP 874 HB2 TRP 874 -15.464 -4.855 -13.568 176 HD1 TRP 874 HD1 TRP 874 -13.757 -7.785 -15.226 177 HE1 TRP 874 HE1 TRP 874 -11.218 -7.339 -15.410 178 HE3 TRP 874 HE3 TRP 874 -13.423 -3.471 -12.486 179 HZ2 TRP 874 HZ2 TRP 874 -9.375 -5.406 -14.663 180 HZ3 TRP 874 HZ3 TRP 874 -11.192 -2.405 -12.179 181 HH2 TRP 874 HH2 TRP 874 -9.204 -3.231 -13.345 182 H ARG 875 HN ARG 875 -16.444 -4.394 -10.940 183 HA ARG 875 HA ARG 875 -19.224 -5.302 -11.326 184 HB2 ARG 875 HB1 ARG 875 -17.967 -4.722 -8.617 185 HB3 ARG 875 HB2 ARG 875 -19.686 -4.485 -8.879 186 HG2 ARG 875 HG1 ARG 875 -18.175 -7.114 -9.123 187 HG3 ARG 875 HG2 ARG 875 -19.309 -6.645 -7.873 188 HD2 ARG 875 HD1 ARG 875 -19.885 -7.349 -10.755 189 HD3 ARG 875 HD2 ARG 875 -20.487 -8.116 -9.312 190 HE ARG 875 HE ARG 875 -21.858 -6.026 -8.885 191 HH11 ARG 875 HH11 ARG 875 -20.851 -6.579 -12.226 192 HH12 ARG 875 HH12 ARG 875 -22.237 -5.649 -12.806 193 HH21 ARG 875 HH21 ARG 875 -23.522 -4.900 -9.798 194 HH22 ARG 875 HH22 ARG 875 -23.633 -4.824 -11.566 195 H ARG 876 HN ARG 876 -20.649 -3.752 -11.727 196 HA ARG 876 HA ARG 876 -19.689 -1.001 -12.138 197 HB2 ARG 876 HB1 ARG 876 -21.276 -2.575 -13.625 198 HB3 ARG 876 HB2 ARG 876 -22.531 -1.770 -12.688 199 HG2 ARG 876 HG1 ARG 876 -20.315 -0.383 -14.274 200 HG3 ARG 876 HG2 ARG 876 -21.931 -0.705 -14.903 201 HD2 ARG 876 HD1 ARG 876 -22.924 0.791 -13.216 202 HD3 ARG 876 HD2 ARG 876 -21.343 0.996 -12.465 203 HE ARG 876 HE ARG 876 -20.682 2.486 -14.066 204 HH11 ARG 876 HH11 ARG 876 -23.627 1.027 -15.290 205 HH12 ARG 876 HH12 ARG 876 -23.767 2.196 -16.572 206 HH21 ARG 876 HH21 ARG 876 -20.959 3.974 -15.661 207 HH22 ARG 876 HH22 ARG 876 -22.258 3.797 -16.803 208 H ILE 877 HN ILE 877 -19.930 0.590 -10.854 209 HA ILE 877 HA ILE 877 -21.747 0.548 -8.488 210 HB ILE 877 HB ILE 877 -19.883 1.534 -7.199 211 HG12 ILE 877 HG11 ILE 877 -18.118 0.979 -9.623 212 HG13 ILE 877 HG12 ILE 877 -18.661 2.572 -9.145 213 HG21 ILE 877 HG21 ILE 877 -20.337 -0.943 -7.264 214 HG22 ILE 877 HG22 ILE 877 -19.037 -1.099 -8.461 215 HG23 ILE 877 HG23 ILE 877 -18.686 -0.523 -6.815 216 HD11 ILE 877 HD1 ILE 877 -16.341 2.023 -8.447 217 HD12 ILE 877 HD2 ILE 877 -17.404 2.580 -7.159 218 HD13 ILE 877 HD3 ILE 877 -17.005 0.863 -7.281 219 HA PRO 878 HA PRO 878 -22.266 4.942 -9.553 220 HB2 PRO 878 HB1 PRO 878 -22.854 6.072 -7.133 221 HB3 PRO 878 HB2 PRO 878 -24.020 5.021 -7.996 222 HG2 PRO 878 HG1 PRO 878 -22.100 4.241 -5.774 223 HG3 PRO 878 HG2 PRO 878 -23.855 3.893 -5.887 224 HD2 PRO 878 HD1 PRO 878 -21.962 2.078 -6.638 225 HD3 PRO 878 HD2 PRO 878 -23.513 2.220 -7.512 226 H ALA 879 HN ALA 879 -21.030 6.753 -9.545 227 HA ALA 879 HA ALA 879 -18.289 6.670 -9.033 228 HB1 ALA 879 HB1 ALA 879 -18.475 9.153 -9.380 229 HB2 ALA 879 HB2 ALA 879 -19.392 8.222 -10.574 230 HB3 ALA 879 HB3 ALA 879 -20.232 9.026 -9.227 231 H SER 880 HN SER 880 -20.787 7.442 -6.712 232 HA SER 880 HA SER 880 -19.282 8.894 -4.759 233 HB2 SER 880 HB1 SER 880 -21.747 8.668 -4.754 234 HB3 SER 880 HB2 SER 880 -21.589 6.936 -4.422 235 HG SER 880 HG1 SER 880 -20.896 9.129 -2.741 236 H VAL 881 HN VAL 881 -19.342 5.463 -5.605 237 HA VAL 881 HA VAL 881 -17.692 4.693 -3.267 238 HB VAL 881 HB VAL 881 -18.831 3.100 -5.593 239 HG11 VAL 881 HG11 VAL 881 -18.146 1.058 -4.492 240 HG12 VAL 881 HG12 VAL 881 -16.703 2.031 -4.779 241 HG13 VAL 881 HG13 VAL 881 -17.429 1.966 -3.151 242 HG21 VAL 881 HG21 VAL 881 -19.562 3.107 -2.642 243 HG22 VAL 881 HG22 VAL 881 -20.530 3.800 -3.959 244 HG23 VAL 881 HG23 VAL 881 -20.266 2.056 -3.892 245 H VAL 882 HN VAL 882 -17.399 5.128 -6.794 246 HA VAL 882 HA VAL 882 -14.704 4.175 -6.732 247 HB VAL 882 HB VAL 882 -16.357 4.494 -8.780 248 HG11 VAL 882 HG11 VAL 882 -15.759 6.244 -10.300 249 HG12 VAL 882 HG12 VAL 882 -16.144 7.023 -8.758 250 HG13 VAL 882 HG13 VAL 882 -14.458 6.825 -9.250 251 HG21 VAL 882 HG21 VAL 882 -14.271 3.172 -8.788 252 HG22 VAL 882 HG22 VAL 882 -14.441 4.098 -10.282 253 HG23 VAL 882 HG23 VAL 882 -13.321 4.653 -9.021 254 H GLY 883 HN GLY 883 -16.032 7.185 -5.925 255 HA2 GLY 883 HA1 GLY 883 -13.478 8.673 -5.842 256 HA3 GLY 883 HA2 GLY 883 -15.079 9.285 -5.441 257 H SER 884 HN SER 884 -14.610 6.327 -3.907 258 HA SER 884 HA SER 884 -13.594 7.542 -1.360 259 HB2 SER 884 HB1 SER 884 -16.071 7.378 -1.436 260 HB3 SER 884 HB2 SER 884 -15.936 5.627 -1.660 261 HG SER 884 HG1 SER 884 -14.953 5.489 0.389 262 H ILE 885 HN ILE 885 -13.711 4.695 -3.444 263 HA ILE 885 HA ILE 885 -12.101 2.967 -1.736 264 HB ILE 885 HB ILE 885 -13.140 2.988 -4.555 265 HG12 ILE 885 HG11 ILE 885 -14.008 0.833 -4.029 266 HG13 ILE 885 HG12 ILE 885 -13.002 0.682 -2.578 267 HG21 ILE 885 HG21 ILE 885 -10.864 2.328 -5.018 268 HG22 ILE 885 HG22 ILE 885 -10.891 1.139 -3.681 269 HG23 ILE 885 HG23 ILE 885 -11.931 0.927 -5.118 270 HD11 ILE 885 HD1 ILE 885 -14.345 2.261 -1.369 271 HD12 ILE 885 HD2 ILE 885 -15.247 2.690 -2.840 272 HD13 ILE 885 HD3 ILE 885 -15.424 1.080 -2.132 273 H ASP 886 HN ASP 886 -9.973 2.997 -1.407 274 HA ASP 886 HA ASP 886 -8.147 4.710 -3.010 275 HB2 ASP 886 HB1 ASP 886 -8.874 4.974 -0.079 276 HB3 ASP 886 HB2 ASP 886 -7.288 5.465 -0.636 277 H GLU 887 HN GLU 887 -5.866 4.579 -2.203 278 HA GLU 887 HA GLU 887 -4.821 2.065 -2.779 279 HB2 GLU 887 HB1 GLU 887 -2.708 3.019 -1.704 280 HB3 GLU 887 HB2 GLU 887 -3.408 3.907 -3.075 281 HG2 GLU 887 HG1 GLU 887 -4.281 5.605 -1.553 282 HG3 GLU 887 HG2 GLU 887 -3.809 4.653 -0.150 283 H SER 888 HN SER 888 -5.433 3.398 0.395 284 HA SER 888 HA SER 888 -4.180 1.219 1.880 285 HB2 SER 888 HB1 SER 888 -4.936 2.488 3.827 286 HB3 SER 888 HB2 SER 888 -4.140 3.532 2.625 287 HG SER 888 HG1 SER 888 -6.110 4.442 3.449 288 H SER 889 HN SER 889 -7.188 1.506 0.343 289 HA SER 889 HA SER 889 -8.607 -0.405 2.129 290 HB2 SER 889 HB1 SER 889 -9.758 1.653 1.153 291 HB3 SER 889 HB2 SER 889 -9.595 0.887 -0.439 292 HG SER 889 HG1 SER 889 -11.137 0.086 1.794 293 H ARG 890 HN ARG 890 -9.712 -2.198 1.017 294 HA ARG 890 HA ARG 890 -8.802 -2.915 -1.687 295 HB2 ARG 890 HB1 ARG 890 -8.784 -4.921 0.606 296 HB3 ARG 890 HB2 ARG 890 -9.026 -5.384 -1.079 297 HG2 ARG 890 HG1 ARG 890 -6.851 -4.225 -1.648 298 HG3 ARG 890 HG2 ARG 890 -6.549 -4.085 0.097 299 HD2 ARG 890 HD1 ARG 890 -6.707 -6.543 0.325 300 HD3 ARG 890 HD2 ARG 890 -7.135 -6.685 -1.389 301 HE ARG 890 HE ARG 890 -4.568 -5.361 -0.842 302 HH11 ARG 890 HH11 ARG 890 -6.066 -8.479 -1.609 303 HH12 ARG 890 HH12 ARG 890 -4.566 -9.101 -2.236 304 HH21 ARG 890 HH21 ARG 890 -2.720 -6.271 -1.653 305 HH22 ARG 890 HH22 ARG 890 -2.734 -7.910 -2.230 306 H TRP 891 HN TRP 891 -10.575 -2.686 -2.827 307 HA TRP 891 HA TRP 891 -13.244 -3.391 -1.727 308 HB2 TRP 891 HB1 TRP 891 -12.880 -1.460 -3.328 309 HB3 TRP 891 HB2 TRP 891 -12.550 -2.655 -4.582 310 HD1 TRP 891 HD1 TRP 891 -15.204 -0.885 -2.751 311 HE1 TRP 891 HE1 TRP 891 -17.531 -1.466 -3.590 312 HE3 TRP 891 HE3 TRP 891 -14.012 -5.038 -5.505 313 HZ2 TRP 891 HZ2 TRP 891 -18.785 -3.692 -4.988 314 HZ3 TRP 891 HZ3 TRP 891 -15.831 -6.418 -6.512 315 HH2 TRP 891 HH2 TRP 891 -18.193 -5.765 -6.224 316 H ILE 892 HN ILE 892 -14.042 -5.420 -1.904 317 HA ILE 892 HA ILE 892 -12.970 -7.284 -3.933 318 HB ILE 892 HB ILE 892 -12.616 -9.044 -2.304 319 HG12 ILE 892 HG11 ILE 892 -13.096 -7.081 -0.046 320 HG13 ILE 892 HG12 ILE 892 -14.385 -8.106 -0.672 321 HG21 ILE 892 HG21 ILE 892 -10.595 -8.247 -1.221 322 HG22 ILE 892 HG22 ILE 892 -10.712 -7.507 -2.823 323 HG23 ILE 892 HG23 ILE 892 -11.105 -6.569 -1.369 324 HD11 ILE 892 HD1 ILE 892 -13.284 -10.123 -0.164 325 HD12 ILE 892 HD2 ILE 892 -11.819 -9.265 0.411 326 HD13 ILE 892 HD3 ILE 892 -13.347 -9.104 1.293 327 H CYS 893 HN CYS 893 -14.301 -9.279 -4.175 328 HA CYS 893 HA CYS 893 -16.989 -8.849 -4.486 329 HB2 CYS 893 HB1 CYS 893 -15.815 -11.546 -3.763 330 HB3 CYS 893 HB2 CYS 893 -17.264 -11.184 -4.713 331 H MET 894 HN MET 894 -15.489 -10.178 -1.428 332 HA MET 894 HA MET 894 -18.028 -10.847 -0.257 333 HB2 MET 894 HB1 MET 894 -15.827 -11.780 0.434 334 HB3 MET 894 HB2 MET 894 -15.385 -10.204 1.097 335 HG2 MET 894 HG1 MET 894 -16.047 -11.665 2.876 336 HG3 MET 894 HG2 MET 894 -17.211 -10.358 2.743 337 HE1 MET 894 HE1 MET 894 -19.403 -13.305 4.065 338 HE2 MET 894 HE2 MET 894 -17.722 -12.918 4.491 339 HE3 MET 894 HE3 MET 894 -18.911 -11.612 4.289 340 H ASN 895 HN ASN 895 -16.420 -7.783 -0.559 341 HA ASN 895 HA ASN 895 -18.083 -6.416 1.461 342 HB2 ASN 895 HB1 ASN 895 -16.297 -5.109 1.578 343 HB3 ASN 895 HB2 ASN 895 -15.500 -6.021 0.310 344 HD21 ASN 895 HD21 ASN 895 -16.277 -5.366 -2.032 345 HD22 ASN 895 HD22 ASN 895 -16.374 -3.621 -2.258 346 H ASN 896 HN ASN 896 -18.428 -7.298 -1.801 347 HA ASN 896 HA ASN 896 -19.509 -5.063 -3.058 348 HB2 ASN 896 HB1 ASN 896 -18.830 -7.187 -4.160 349 HB3 ASN 896 HB2 ASN 896 -20.257 -7.978 -3.463 350 HD21 ASN 896 HD21 ASN 896 -20.491 -8.564 -5.773 351 HD22 ASN 896 HD22 ASN 896 -21.540 -7.474 -6.667 352 H SER 897 HN SER 897 -21.346 -4.045 -3.153 353 HA SER 897 HA SER 897 -23.558 -4.244 -1.367 354 HB2 SER 897 HB1 SER 897 -23.232 -3.055 -4.152 355 HB3 SER 897 HB2 SER 897 -24.691 -2.874 -3.185 356 HG SER 897 HG1 SER 897 -23.240 -1.105 -2.881 357 H ASP 898 HN ASP 898 -23.120 -5.499 -4.641 358 HA ASP 898 HA ASP 898 -25.870 -6.493 -4.817 359 HB2 ASP 898 HB1 ASP 898 -23.600 -6.963 -6.758 360 HB3 ASP 898 HB2 ASP 898 -25.313 -7.189 -7.063 361 H LYS 899 HN LYS 899 -26.325 -8.115 -3.580 362 HA LYS 899 HA LYS 899 -24.760 -10.348 -2.815 363 HB2 LYS 899 HB1 LYS 899 -27.794 -10.091 -3.009 364 HB3 LYS 899 HB2 LYS 899 -26.925 -11.337 -2.116 365 HG2 LYS 899 HG1 LYS 899 -26.408 -8.418 -1.482 366 HG3 LYS 899 HG2 LYS 899 -27.848 -9.214 -0.857 367 HD2 LYS 899 HD1 LYS 899 -25.108 -10.444 -0.510 368 HD3 LYS 899 HD2 LYS 899 -25.760 -9.237 0.629 369 HE2 LYS 899 HE1 LYS 899 -27.738 -10.672 1.019 370 HE3 LYS 899 HE2 LYS 899 -27.112 -11.869 -0.116 371 HZ1 LYS 899 HZ1 LYS 899 -25.779 -11.066 2.420 372 HZ2 LYS 899 HZ2 LYS 899 -26.584 -12.464 2.183 373 HZ3 LYS 899 HZ3 LYS 899 -25.197 -12.179 1.373 374 H ARG 900 HN ARG 900 -26.246 -9.767 -5.796 375 HA ARG 900 HA ARG 900 -26.506 -12.376 -6.995 376 HB2 ARG 900 HB1 ARG 900 -25.769 -9.627 -8.109 377 HB3 ARG 900 HB2 ARG 900 -26.082 -11.037 -9.120 378 HG2 ARG 900 HG1 ARG 900 -28.389 -11.141 -8.479 379 HG3 ARG 900 HG2 ARG 900 -28.153 -10.027 -7.132 380 HD2 ARG 900 HD1 ARG 900 -29.272 -8.848 -8.900 381 HD3 ARG 900 HD2 ARG 900 -27.651 -8.189 -8.673 382 HE ARG 900 HE ARG 900 -28.133 -10.218 -10.818 383 HH11 ARG 900 HH11 ARG 900 -27.376 -6.830 -10.120 384 HH12 ARG 900 HH12 ARG 900 -26.870 -6.575 -11.790 385 HH21 ARG 900 HH21 ARG 900 -27.562 -9.648 -12.937 386 HH22 ARG 900 HH22 ARG 900 -26.981 -8.009 -13.221 387 H PHE 901 HN PHE 901 -23.701 -10.331 -6.330 388 HA PHE 901 HA PHE 901 -21.893 -12.442 -7.378 389 HB2 PHE 901 HB1 PHE 901 -21.558 -9.503 -7.998 390 HB3 PHE 901 HB2 PHE 901 -20.622 -10.824 -8.667 391 HD1 PHE 901 HD1 PHE 901 -23.170 -8.512 -9.353 392 HD2 PHE 901 HD2 PHE 901 -22.102 -12.625 -10.068 393 HE1 PHE 901 HE1 PHE 901 -24.716 -8.581 -11.268 394 HE2 PHE 901 HE2 PHE 901 -23.621 -12.676 -12.027 395 HZ PHE 901 HZ PHE 901 -24.938 -10.656 -12.631 396 H ALA 902 HN ALA 902 -22.538 -11.339 -4.608 397 HA ALA 902 HA ALA 902 -20.086 -10.030 -3.801 398 HB1 ALA 902 HB1 ALA 902 -21.226 -9.699 -1.643 399 HB2 ALA 902 HB2 ALA 902 -22.280 -9.210 -2.976 400 HB3 ALA 902 HB3 ALA 902 -22.546 -10.771 -2.156 401 H ASP 903 HN ASP 903 -19.470 -12.488 -4.681 402 HA ASP 903 HA ASP 903 -17.956 -13.502 -2.375 403 HB2 ASP 903 HB1 ASP 903 -19.676 -15.297 -4.086 404 HB3 ASP 903 HB2 ASP 903 -18.396 -15.876 -3.033 405 H CYS 904 HN CYS 904 -15.938 -14.206 -2.901 406 HA CYS 904 HA CYS 904 -14.817 -13.624 -5.428 407 HB2 CYS 904 HB1 CYS 904 -13.918 -15.307 -3.056 408 HB3 CYS 904 HB2 CYS 904 -12.902 -14.962 -4.460 409 H SER 905 HN SER 905 -16.728 -16.314 -4.473 410 HA SER 905 HA SER 905 -15.816 -18.129 -6.618 411 HB2 SER 905 HB1 SER 905 -18.106 -18.422 -4.646 412 HB3 SER 905 HB2 SER 905 -17.466 -19.677 -5.721 413 HG SER 905 HG1 SER 905 -15.524 -19.640 -4.572 414 H LYS 906 HN LYS 906 -18.185 -15.610 -6.240 415 HA LYS 906 HA LYS 906 -20.190 -16.688 -8.076 416 HB2 LYS 906 HB1 LYS 906 -19.725 -14.108 -6.588 417 HB3 LYS 906 HB2 LYS 906 -20.834 -14.089 -7.930 418 HG2 LYS 906 HG1 LYS 906 -21.136 -15.898 -5.512 419 HG3 LYS 906 HG2 LYS 906 -21.894 -14.314 -5.744 420 HD2 LYS 906 HD1 LYS 906 -23.630 -15.588 -6.398 421 HD3 LYS 906 HD2 LYS 906 -22.842 -15.453 -7.969 422 HE2 LYS 906 HE1 LYS 906 -21.781 -17.694 -7.597 423 HE3 LYS 906 HE2 LYS 906 -22.504 -17.762 -5.988 424 HZ1 LYS 906 HZ1 LYS 906 -23.822 -18.999 -7.609 425 HZ2 LYS 906 HZ2 LYS 906 -24.699 -17.749 -7.040 426 HZ3 LYS 906 HZ3 LYS 906 -24.041 -17.673 -8.534 427 H SER 907 HN SER 907 -21.012 -15.067 -9.752 428 HA SER 907 HA SER 907 -18.950 -14.868 -11.875 429 HB2 SER 907 HB1 SER 907 -21.092 -16.148 -12.174 430 HB3 SER 907 HB2 SER 907 -21.958 -14.605 -12.091 431 HG SER 907 HG1 SER 907 -20.164 -15.583 -14.057 432 H GLN 908 HN GLN 908 -20.444 -12.942 -13.377 433 HA GLN 908 HA GLN 908 -20.561 -10.375 -12.016 434 HB2 GLN 908 HB1 GLN 908 -18.723 -9.294 -13.135 435 HB3 GLN 908 HB2 GLN 908 -18.088 -10.731 -12.345 436 HG2 GLN 908 HG1 GLN 908 -18.575 -11.828 -14.766 437 HG3 GLN 908 HG2 GLN 908 -18.506 -10.168 -15.261 438 HE21 GLN 908 HE21 GLN 908 -16.379 -9.223 -15.510 439 HE22 GLN 908 HE22 GLN 908 -14.921 -10.106 -15.049 440 H GLU 909 HN GLU 909 -21.199 -8.593 -13.658 441 HA GLU 909 HA GLU 909 -23.220 -9.667 -15.433 442 HB2 GLU 909 HB1 GLU 909 -22.235 -6.834 -14.949 443 HB3 GLU 909 HB2 GLU 909 -23.592 -7.245 -16.015 444 HG2 GLU 909 HG1 GLU 909 -24.727 -8.408 -14.130 445 HG3 GLU 909 HG2 GLU 909 -23.412 -7.911 -13.061 446 H MET 910 HN MET 910 -19.922 -8.687 -16.042 447 HA MET 910 HA MET 910 -20.129 -9.625 -18.815 448 HB2 MET 910 HB1 MET 910 -19.128 -6.817 -18.193 449 HB3 MET 910 HB2 MET 910 -18.782 -7.698 -19.674 450 HG2 MET 910 HG1 MET 910 -21.588 -6.965 -18.779 451 HG3 MET 910 HG2 MET 910 -20.598 -6.008 -19.872 452 HE1 MET 910 HE1 MET 910 -23.347 -7.478 -22.243 453 HE2 MET 910 HE2 MET 910 -23.545 -7.021 -20.536 454 HE3 MET 910 HE3 MET 910 -22.570 -6.003 -21.622 455 H SER 911 HN SER 911 -18.380 -10.807 -19.265 456 HA SER 911 HA SER 911 -16.374 -11.378 -17.305 457 HB2 SER 911 HB1 SER 911 -15.979 -11.935 -20.231 458 HB3 SER 911 HB2 SER 911 -15.445 -12.885 -18.852 459 HG SER 911 HG1 SER 911 -17.552 -13.561 -18.483 460 H ASN 912 HN ASN 912 -13.961 -11.167 -17.680 461 HA ASN 912 HA ASN 912 -13.405 -8.349 -17.934 462 HB2 ASN 912 HB1 ASN 912 -12.196 -9.701 -16.330 463 HB3 ASN 912 HB2 ASN 912 -11.620 -10.811 -17.584 464 HD21 ASN 912 HD21 ASN 912 -11.515 -7.256 -17.857 465 HD22 ASN 912 HD22 ASN 912 -9.756 -7.205 -17.765 466 H GLU 913 HN GLU 913 -13.157 -10.924 -20.299 467 HA GLU 913 HA GLU 913 -11.823 -9.289 -22.322 468 HB2 GLU 913 HB1 GLU 913 -11.670 -11.774 -22.067 469 HB3 GLU 913 HB2 GLU 913 -13.354 -11.907 -22.588 470 HG2 GLU 913 HG1 GLU 913 -12.791 -11.152 -24.812 471 HG3 GLU 913 HG2 GLU 913 -11.213 -10.560 -24.275 472 H GLU 914 HN GLU 914 -14.868 -9.004 -21.050 473 HA GLU 914 HA GLU 914 -16.066 -7.857 -23.548 474 HB2 GLU 914 HB1 GLU 914 -17.469 -8.888 -21.061 475 HB3 GLU 914 HB2 GLU 914 -18.249 -8.179 -22.459 476 HG2 GLU 914 HG1 GLU 914 -16.699 -10.804 -22.357 477 HG3 GLU 914 HG2 GLU 914 -18.444 -10.626 -22.399 478 H ILE 915 HN ILE 915 -15.812 -7.350 -19.955 479 HA ILE 915 HA ILE 915 -16.527 -4.582 -20.252 480 HB ILE 915 HB ILE 915 -17.149 -5.771 -18.334 481 HG12 ILE 915 HG11 ILE 915 -16.878 -4.083 -16.717 482 HG13 ILE 915 HG12 ILE 915 -15.280 -3.640 -17.252 483 HG21 ILE 915 HG21 ILE 915 -15.516 -6.135 -16.431 484 HG22 ILE 915 HG22 ILE 915 -15.409 -7.258 -17.760 485 HG23 ILE 915 HG23 ILE 915 -14.203 -5.964 -17.623 486 HD11 ILE 915 HD1 ILE 915 -16.785 -1.902 -17.956 487 HD12 ILE 915 HD2 ILE 915 -16.276 -2.728 -19.410 488 HD13 ILE 915 HD3 ILE 915 -17.881 -3.077 -18.746 489 H ASN 916 HN ASN 916 -13.908 -5.903 -21.197 490 HA ASN 916 HA ASN 916 -12.394 -3.322 -20.925 491 HB2 ASN 916 HB1 ASN 916 -10.417 -4.335 -21.853 492 HB3 ASN 916 HB2 ASN 916 -10.983 -5.314 -20.522 493 HD21 ASN 916 HD21 ASN 916 -9.170 -6.456 -22.101 494 HD22 ASN 916 HD22 ASN 916 -9.941 -7.631 -23.163 495 H GLU 917 HN GLU 917 -13.835 -5.413 -23.407 496 HA GLU 917 HA GLU 917 -13.468 -3.639 -25.609 497 HB2 GLU 917 HB1 GLU 917 -15.164 -6.014 -24.989 498 HB3 GLU 917 HB2 GLU 917 -15.641 -4.991 -26.342 499 HG2 GLU 917 HG1 GLU 917 -13.295 -5.190 -27.248 500 HG3 GLU 917 HG2 GLU 917 -12.918 -6.312 -25.940 501 H GLU 918 HN GLU 918 -16.048 -3.741 -23.186 502 HA GLU 918 HA GLU 918 -17.937 -2.104 -24.442 503 HB2 GLU 918 HB1 GLU 918 -18.106 -3.360 -22.188 504 HB3 GLU 918 HB2 GLU 918 -17.297 -1.963 -21.470 505 HG2 GLU 918 HG1 GLU 918 -19.723 -1.857 -21.159 506 HG3 GLU 918 HG2 GLU 918 -19.123 -0.492 -22.097 507 H LEU 919 HN LEU 919 -14.996 -1.091 -22.776 508 HA LEU 919 HA LEU 919 -15.635 1.776 -23.226 509 HB2 LEU 919 HB1 LEU 919 -13.207 0.684 -21.777 510 HB3 LEU 919 HB2 LEU 919 -13.844 2.315 -21.785 511 HG LEU 919 HG LEU 919 -16.021 0.910 -20.823 512 HD11 LEU 919 HD11 LEU 919 -15.222 -0.635 -19.139 513 HD12 LEU 919 HD12 LEU 919 -14.712 -1.189 -20.731 514 HD13 LEU 919 HD13 LEU 919 -13.534 -0.401 -19.670 515 HD21 LEU 919 HD21 LEU 919 -15.201 2.938 -19.861 516 HD22 LEU 919 HD22 LEU 919 -15.287 1.697 -18.575 517 HD23 LEU 919 HD23 LEU 919 -13.715 2.168 -19.310 518 H GLY 920 HN GLY 920 -13.546 -0.799 -24.335 519 HA2 GLY 920 HA1 GLY 920 -12.584 -0.856 -26.527 520 HA3 GLY 920 HA2 GLY 920 -12.480 0.906 -26.554 521 H ILE 921 HN ILE 921 -11.495 -1.118 -23.835 522 HA ILE 921 HA ILE 921 -8.645 -0.274 -24.142 523 HB ILE 921 HB ILE 921 -8.489 -0.424 -21.708 524 HG12 ILE 921 HG11 ILE 921 -11.507 -0.845 -21.680 525 HG13 ILE 921 HG12 ILE 921 -10.306 -2.097 -21.362 526 HG21 ILE 921 HG21 ILE 921 -9.596 1.660 -21.203 527 HG22 ILE 921 HG22 ILE 921 -9.012 1.710 -22.868 528 HG23 ILE 921 HG23 ILE 921 -10.739 1.444 -22.545 529 HD11 ILE 921 HD1 ILE 921 -9.452 -0.804 -19.423 530 HD12 ILE 921 HD2 ILE 921 -10.767 0.378 -19.668 531 HD13 ILE 921 HD3 ILE 921 -11.150 -1.302 -19.260 532 H GLY 922 HN GLY 922 -7.131 -1.766 -22.970 533 HA2 GLY 922 HA1 GLY 922 -7.575 -4.575 -23.868 534 HA3 GLY 922 HA2 GLY 922 -6.048 -3.838 -23.400 535 H GLN 923 HN GLN 923 -6.842 -2.777 -20.874 536 HA GLN 923 HA GLN 923 -6.501 -3.171 -18.848 537 HB2 GLN 923 HB1 GLN 923 -8.831 -3.903 -18.916 538 HB3 GLN 923 HB2 GLN 923 -8.276 -5.590 -18.984 539 HG2 GLN 923 HG1 GLN 923 -8.920 -5.043 -16.761 540 HG3 GLN 923 HG2 GLN 923 -7.185 -5.293 -16.816 541 HE21 GLN 923 HE21 GLN 923 -9.718 -2.901 -16.119 542 HE22 GLN 923 HE22 GLN 923 -8.595 -1.598 -15.770 543 H ASP 924 HN ASP 924 -5.277 -4.020 -17.339 544 HA ASP 924 HA ASP 924 -2.954 -5.420 -18.392 545 HB2 ASP 924 HB1 ASP 924 -2.950 -3.484 -16.764 546 HB3 ASP 924 HB2 ASP 924 -3.511 -4.592 -15.517 547 H GLU 925 HN GLU 925 -5.536 -6.356 -16.162 548 HA GLU 925 HA GLU 925 -4.447 -8.902 -15.347 549 HB2 GLU 925 HB1 GLU 925 -7.340 -7.984 -15.605 550 HB3 GLU 925 HB2 GLU 925 -6.826 -9.428 -14.760 551 HG2 GLU 925 HG1 GLU 925 -6.056 -6.579 -13.967 552 HG3 GLU 925 HG2 GLU 925 -7.428 -7.460 -13.328 553 H ALA 926 HN ALA 926 -6.482 -7.960 -18.078 554 HA ALA 926 HA ALA 926 -6.769 -10.616 -19.243 555 HB1 ALA 926 HB1 ALA 926 -8.365 -8.765 -19.648 556 HB2 ALA 926 HB2 ALA 926 -7.061 -7.847 -20.435 557 HB3 ALA 926 HB3 ALA 926 -7.645 -9.363 -21.154 558 H ASP 927 HN ASP 927 -4.631 -7.849 -19.844 559 HA ASP 927 HA ASP 927 -2.888 -7.462 -21.149 560 HB2 ASP 927 HB1 ASP 927 -1.881 -9.316 -19.744 561 HB3 ASP 927 HB2 ASP 927 -2.174 -10.407 -21.095 562 H ALA 928 HN ALA 928 -5.521 -8.426 -22.247 563 HA ALA 928 HA ALA 928 -5.214 -9.527 -24.842 564 HB1 ALA 928 HB1 ALA 928 -7.329 -7.625 -23.748 565 HB2 ALA 928 HB2 ALA 928 -7.478 -8.605 -25.220 566 HB3 ALA 928 HB3 ALA 928 -7.353 -9.405 -23.643 567 H1 ALA 1 HT1 ALA 1 -9.473 2.851 -7.299 568 H2 ALA 1 HT2 ALA 1 -7.921 3.359 -7.437 569 H3 ALA 1 HT3 ALA 1 -8.443 2.775 -6.006 570 HA ALA 1 HA ALA 1 -7.079 1.155 -7.083 571 HB1 ALA 1 HB1 ALA 1 -8.936 0.277 -5.692 572 HB2 ALA 1 HB2 ALA 1 -10.017 0.307 -7.104 573 HB3 ALA 1 HB3 ALA 1 -8.619 -0.784 -7.068 574 H ARG 2 HN ARG 2 -6.614 -0.190 -8.932 575 HA ARG 2 HA ARG 2 -6.877 1.053 -11.477 576 HB2 ARG 2 HB1 ARG 2 -5.082 -0.514 -10.959 577 HB3 ARG 2 HB2 ARG 2 -6.232 -1.812 -10.672 578 HG2 ARG 2 HG1 ARG 2 -5.168 -2.186 -12.762 579 HG3 ARG 2 HG2 ARG 2 -6.847 -1.827 -13.099 580 HD2 ARG 2 HD1 ARG 2 -4.617 0.238 -13.274 581 HD3 ARG 2 HD2 ARG 2 -5.051 -0.820 -14.620 582 HE ARG 2 HE ARG 2 -7.467 0.320 -14.093 583 HH11 ARG 2 HH11 ARG 2 -4.302 1.693 -14.737 584 HH12 ARG 2 HH12 ARG 2 -4.969 3.117 -15.483 585 HH21 ARG 2 HH21 ARG 2 -8.252 2.215 -15.046 586 HH22 ARG 2 HH22 ARG 2 -7.118 3.389 -15.652 587 H THR 3 HN THR 3 -8.834 1.469 -12.349 588 HA THR 3 HA THR 3 -10.411 -0.781 -13.297 589 HB THR 3 HB THR 3 -11.244 -0.369 -10.917 590 HG1 THR 3 HG1 THR 3 -12.678 -1.306 -12.267 591 HG21 THR 3 HG21 THR 3 -11.034 2.189 -11.010 592 HG22 THR 3 HG22 THR 3 -12.519 2.179 -11.986 593 HG23 THR 3 HG23 THR 3 -12.532 1.529 -10.341 594 H MLZ 4 HN MLZ 4 -12.782 0.730 -13.869 595 HA MLZ 4 HA MLZ 4 -11.975 2.530 -16.073 596 HB2 MLZ 4 HB1 MLZ 4 -12.859 1.014 -17.737 597 HB3 MLZ 4 HB2 MLZ 4 -11.661 0.150 -16.838 598 HG2 MLZ 4 HG1 MLZ 4 -14.651 -0.092 -16.231 599 HG3 MLZ 4 HG2 MLZ 4 -13.871 -1.023 -17.493 600 HD2 MLZ 4 HD1 MLZ 4 -13.007 -1.214 -14.625 601 HD3 MLZ 4 HD2 MLZ 4 -14.168 -2.283 -15.377 602 HE2 MLZ 4 HE1 MLZ 4 -11.417 -1.848 -16.591 603 HE3 MLZ 4 HE2 MLZ 4 -11.673 -2.997 -15.244 604 HZ MLZ 4 HZ1 MLZ 4 -13.211 -3.128 -17.807 605 HCM1 MLZ 4 HC1 MLZ 4 -11.877 -4.964 -18.435 606 HCM2 MLZ 4 HC2 MLZ 4 -10.829 -3.574 -18.158 607 HCM3 MLZ 4 HC3 MLZ 4 -10.974 -4.852 -16.909 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.270 -4.199 -16.576 609 H GLN 5 HN GLN 5 -14.014 3.363 -17.265 610 HA GLN 5 HA GLN 5 -16.471 3.250 -15.629 611 HB2 GLN 5 HB1 GLN 5 -16.712 5.591 -15.354 612 HB3 GLN 5 HB2 GLN 5 -15.193 5.046 -14.678 613 HG2 GLN 5 HG1 GLN 5 -14.388 6.913 -15.641 614 HG3 GLN 5 HG2 GLN 5 -14.185 5.852 -17.019 615 HE21 GLN 5 HE21 GLN 5 -14.175 7.951 -18.246 616 HE22 GLN 5 HE22 GLN 5 -15.723 8.687 -18.634 617 H THR 6 HN THR 6 -17.895 2.446 -16.974 618 HA THR 6 HA THR 6 -17.778 2.776 -19.823 619 HB THR 6 HB THR 6 -20.085 1.580 -19.637 620 HG1 THR 6 HG1 THR 6 -20.456 2.017 -17.453 621 HG21 THR 6 HG21 THR 6 -17.529 0.314 -18.581 622 HG22 THR 6 HG22 THR 6 -18.982 -0.576 -19.116 623 HG23 THR 6 HG23 THR 6 -18.074 0.402 -20.270 624 H ALA 7 HN ALA 7 -18.728 4.116 -21.154 625 HA ALA 7 HA ALA 7 -21.065 5.761 -20.346 626 HB1 ALA 7 HB1 ALA 7 -18.436 6.856 -21.431 627 HB2 ALA 7 HB2 ALA 7 -19.890 7.804 -21.040 628 HB3 ALA 7 HB3 ALA 7 -18.993 6.990 -19.746 629 H ARG 8 HN ARG 8 -20.557 3.487 -22.376 630 HA ARG 8 HA ARG 8 -20.899 4.674 -24.980 631 HB2 ARG 8 HB1 ARG 8 -19.533 2.567 -24.394 632 HB3 ARG 8 HB2 ARG 8 -21.067 1.740 -24.138 633 HG2 ARG 8 HG1 ARG 8 -21.680 2.098 -26.498 634 HG3 ARG 8 HG2 ARG 8 -20.288 3.171 -26.718 635 HD2 ARG 8 HD1 ARG 8 -19.678 1.155 -27.734 636 HD3 ARG 8 HD2 ARG 8 -18.796 1.188 -26.217 637 HE ARG 8 HE ARG 8 -20.557 -0.351 -25.277 638 HH11 ARG 8 HH11 ARG 8 -20.462 -0.280 -28.810 639 HH12 ARG 8 HH12 ARG 8 -20.897 -1.962 -28.906 640 HH21 ARG 8 HH21 ARG 8 -21.000 -2.461 -25.505 641 HH22 ARG 8 HH22 ARG 8 -21.290 -3.137 -27.092 642 H TYR 9 HN TYR 9 -22.507 3.929 -26.159 643 HA TYR 9 HA TYR 9 -25.169 4.779 -25.452 644 HB2 TYR 9 HB1 TYR 9 -25.715 3.944 -27.813 645 HB3 TYR 9 HB2 TYR 9 -24.552 5.241 -27.635 646 HD1 TYR 9 HD1 TYR 9 -24.820 1.548 -28.224 647 HD2 TYR 9 HD2 TYR 9 -22.350 5.074 -28.510 648 HE1 TYR 9 HE1 TYR 9 -23.088 0.240 -29.451 649 HE2 TYR 9 HE2 TYR 9 -20.623 3.765 -29.737 650 HH TYR 9 HH TYR 9 -20.098 1.729 -30.704 Start of MODEL 15 1 H1 GLY 850 HT1 GLY 850 -5.563 -14.837 -2.696 2 H2 GLY 850 HT2 GLY 850 -6.557 -13.924 -3.643 3 H3 GLY 850 HT3 GLY 850 -6.752 -13.913 -2.024 4 HA2 GLY 850 HA1 GLY 850 -5.707 -11.888 -2.659 5 HA3 GLY 850 HA2 GLY 850 -4.586 -12.883 -1.713 6 H SER 851 HN SER 851 -5.493 -11.874 -4.987 7 HA SER 851 HA SER 851 -3.207 -13.081 -6.326 8 HB2 SER 851 HB1 SER 851 -5.203 -10.971 -7.229 9 HB3 SER 851 HB2 SER 851 -3.991 -11.743 -8.269 10 HG SER 851 HG1 SER 851 -6.138 -13.002 -6.886 11 H ARG 852 HN ARG 852 -1.570 -11.911 -7.534 12 HA ARG 852 HA ARG 852 -0.070 -10.107 -5.879 13 HB2 ARG 852 HB1 ARG 852 0.362 -11.768 -8.222 14 HB3 ARG 852 HB2 ARG 852 0.931 -10.158 -8.591 15 HG2 ARG 852 HG1 ARG 852 2.780 -11.315 -7.759 16 HG3 ARG 852 HG2 ARG 852 2.320 -10.218 -6.463 17 HD2 ARG 852 HD1 ARG 852 1.510 -13.164 -6.584 18 HD3 ARG 852 HD2 ARG 852 2.991 -12.603 -5.829 19 HE ARG 852 HE ARG 852 1.687 -11.310 -4.213 20 HH11 ARG 852 HH11 ARG 852 -0.045 -13.969 -5.746 21 HH12 ARG 852 HH12 ARG 852 -1.329 -13.882 -4.549 22 HH21 ARG 852 HH21 ARG 852 0.015 -11.362 -2.729 23 HH22 ARG 852 HH22 ARG 852 -1.292 -12.502 -2.974 24 H ARG 853 HN ARG 853 -2.351 -9.394 -8.321 25 HA ARG 853 HA ARG 853 -3.119 -7.550 -9.378 26 HB2 ARG 853 HB1 ARG 853 -1.950 -5.747 -7.277 27 HB3 ARG 853 HB2 ARG 853 -3.504 -5.656 -8.116 28 HG2 ARG 853 HG1 ARG 853 -4.205 -7.741 -6.829 29 HG3 ARG 853 HG2 ARG 853 -2.732 -7.543 -5.857 30 HD2 ARG 853 HD1 ARG 853 -5.026 -5.628 -6.118 31 HD3 ARG 853 HD2 ARG 853 -4.604 -6.581 -4.691 32 HE ARG 853 HE ARG 853 -2.468 -5.231 -4.606 33 HH11 ARG 853 HH11 ARG 853 -5.362 -3.659 -5.899 34 HH12 ARG 853 HH12 ARG 853 -4.509 -2.126 -6.062 35 HH21 ARG 853 HH21 ARG 853 -1.573 -3.181 -4.729 36 HH22 ARG 853 HH22 ARG 853 -2.549 -1.880 -5.400 37 H ALA 854 HN ALA 854 -2.622 -5.249 -10.217 38 HA ALA 854 HA ALA 854 0.158 -4.578 -10.687 39 HB1 ALA 854 HB1 ALA 854 0.054 -4.681 -13.150 40 HB2 ALA 854 HB2 ALA 854 -0.121 -6.299 -12.445 41 HB3 ALA 854 HB3 ALA 854 -1.552 -5.443 -13.066 42 H SER 855 HN SER 855 0.431 -2.571 -11.744 43 HA SER 855 HA SER 855 0.131 -0.343 -11.929 44 HB2 SER 855 HB1 SER 855 -1.475 0.426 -13.467 45 HB3 SER 855 HB2 SER 855 -0.966 -1.185 -13.958 46 HG SER 855 HG1 SER 855 -2.885 -1.855 -12.600 47 H VAL 856 HN VAL 856 -1.908 1.445 -11.845 48 HA VAL 856 HA VAL 856 -3.134 1.388 -9.161 49 HB VAL 856 HB VAL 856 -2.087 3.552 -8.525 50 HG11 VAL 856 HG11 VAL 856 -1.244 1.419 -7.626 51 HG12 VAL 856 HG12 VAL 856 0.009 1.400 -8.892 52 HG13 VAL 856 HG13 VAL 856 -0.027 2.704 -7.687 53 HG21 VAL 856 HG21 VAL 856 -0.127 3.071 -10.801 54 HG22 VAL 856 HG22 VAL 856 -1.355 4.358 -10.739 55 HG23 VAL 856 HG23 VAL 856 -0.035 4.339 -9.564 56 H GLY 857 HN GLY 857 -4.352 3.378 -8.691 57 HA2 GLY 857 HA1 GLY 857 -5.223 5.454 -9.194 58 HA3 GLY 857 HA2 GLY 857 -4.901 5.232 -10.897 59 H SER 858 HN SER 858 -7.250 5.922 -8.980 60 HA SER 858 HA SER 858 -9.282 5.205 -10.953 61 HB2 SER 858 HB1 SER 858 -10.905 4.422 -9.290 62 HB3 SER 858 HB2 SER 858 -9.476 3.379 -9.354 63 HG SER 858 HG1 SER 858 -10.276 5.174 -7.329 64 H GLU 859 HN GLU 859 -11.065 6.675 -10.964 65 HA GLU 859 HA GLU 859 -11.172 8.918 -9.089 66 HB2 GLU 859 HB1 GLU 859 -9.397 9.523 -10.787 67 HB3 GLU 859 HB2 GLU 859 -10.662 9.478 -12.031 68 HG2 GLU 859 HG1 GLU 859 -11.784 11.365 -11.053 69 HG3 GLU 859 HG2 GLU 859 -10.842 11.224 -9.563 70 H PHE 860 HN PHE 860 -13.025 10.368 -9.627 71 HA PHE 860 HA PHE 860 -15.305 8.795 -9.356 72 HB2 PHE 860 HB1 PHE 860 -15.029 11.752 -9.983 73 HB3 PHE 860 HB2 PHE 860 -16.562 10.981 -9.635 74 HD1 PHE 860 HD1 PHE 860 -17.260 10.468 -7.414 75 HD2 PHE 860 HD2 PHE 860 -13.257 11.900 -8.153 76 HE1 PHE 860 HE1 PHE 860 -16.956 10.877 -4.984 77 HE2 PHE 860 HE2 PHE 860 -12.950 12.282 -5.721 78 HZ PHE 860 HZ PHE 860 -14.798 11.781 -4.133 79 H THR 861 HN THR 861 -14.793 11.016 -12.132 80 HA THR 861 HA THR 861 -15.817 11.121 -14.211 81 HB THR 861 HB THR 861 -15.569 8.145 -14.146 82 HG1 THR 861 HG1 THR 861 -13.657 9.129 -13.537 83 HG21 THR 861 HG21 THR 861 -15.709 10.132 -16.428 84 HG22 THR 861 HG22 THR 861 -14.790 8.625 -16.602 85 HG23 THR 861 HG23 THR 861 -16.506 8.539 -16.274 86 H GLU 862 HN GLU 862 -17.747 9.393 -15.499 87 HA GLU 862 HA GLU 862 -20.210 9.597 -13.870 88 HB2 GLU 862 HB1 GLU 862 -19.638 8.482 -16.641 89 HB3 GLU 862 HB2 GLU 862 -21.230 8.477 -15.863 90 HG2 GLU 862 HG1 GLU 862 -21.159 10.943 -15.654 91 HG3 GLU 862 HG2 GLU 862 -19.602 10.982 -16.477 92 H SER 863 HN SER 863 -21.542 7.529 -13.631 93 HA SER 863 HA SER 863 -20.418 5.778 -11.860 94 HB2 SER 863 HB1 SER 863 -22.711 5.196 -13.743 95 HB3 SER 863 HB2 SER 863 -22.314 4.292 -12.260 96 HG SER 863 HG1 SER 863 -23.893 6.000 -11.942 97 H ALA 864 HN ALA 864 -19.447 3.791 -11.782 98 HA ALA 864 HA ALA 864 -17.911 3.165 -14.279 99 HB1 ALA 864 HB1 ALA 864 -16.843 4.983 -12.994 100 HB2 ALA 864 HB2 ALA 864 -16.956 4.011 -11.510 101 HB3 ALA 864 HB3 ALA 864 -15.888 3.495 -12.820 102 H TRP 865 HN TRP 865 -16.172 1.363 -13.659 103 HA TRP 865 HA TRP 865 -17.554 -0.741 -12.050 104 HB2 TRP 865 HB1 TRP 865 -15.285 -0.893 -14.010 105 HB3 TRP 865 HB2 TRP 865 -15.889 -2.254 -13.079 106 HD1 TRP 865 HD1 TRP 865 -17.229 0.273 -15.675 107 HE1 TRP 865 HE1 TRP 865 -19.042 -0.795 -17.076 108 HE3 TRP 865 HE3 TRP 865 -17.432 -4.186 -13.290 109 HZ2 TRP 865 HZ2 TRP 865 -20.287 -3.479 -17.284 110 HZ3 TRP 865 HZ3 TRP 865 -18.907 -6.047 -14.109 111 HH2 TRP 865 HH2 TRP 865 -20.343 -5.705 -16.061 112 H VAL 866 HN VAL 866 -16.072 -2.137 -10.777 113 HA VAL 866 HA VAL 866 -13.561 -0.939 -9.801 114 HB VAL 866 HB VAL 866 -15.211 -0.127 -8.218 115 HG11 VAL 866 HG11 VAL 866 -16.884 -1.972 -8.346 116 HG12 VAL 866 HG12 VAL 866 -15.757 -3.042 -7.497 117 HG13 VAL 866 HG13 VAL 866 -16.404 -1.605 -6.687 118 HG21 VAL 866 HG21 VAL 866 -14.124 -0.776 -6.181 119 HG22 VAL 866 HG22 VAL 866 -13.470 -2.243 -6.917 120 HG23 VAL 866 HG23 VAL 866 -12.908 -0.642 -7.466 121 H ARG 867 HN ARG 867 -12.032 -2.462 -9.173 122 HA ARG 867 HA ARG 867 -12.553 -5.279 -9.939 123 HB2 ARG 867 HB1 ARG 867 -10.365 -3.620 -10.340 124 HB3 ARG 867 HB2 ARG 867 -9.896 -4.480 -8.901 125 HG2 ARG 867 HG1 ARG 867 -10.287 -6.650 -10.083 126 HG3 ARG 867 HG2 ARG 867 -10.719 -5.774 -11.558 127 HD2 ARG 867 HD1 ARG 867 -8.549 -6.247 -12.010 128 HD3 ARG 867 HD2 ARG 867 -8.358 -4.648 -11.295 129 HE ARG 867 HE ARG 867 -7.577 -7.288 -10.180 130 HH11 ARG 867 HH11 ARG 867 -7.722 -3.839 -9.448 131 HH12 ARG 867 HH12 ARG 867 -7.161 -4.146 -7.800 132 HH21 ARG 867 HH21 ARG 867 -6.816 -7.457 -8.086 133 HH22 ARG 867 HH22 ARG 867 -6.639 -5.983 -7.147 134 H CYS 868 HN CYS 868 -12.379 -7.017 -8.531 135 HA CYS 868 HA CYS 868 -12.178 -6.626 -5.659 136 HB2 CYS 868 HB1 CYS 868 -13.539 -8.413 -6.607 137 HB3 CYS 868 HB2 CYS 868 -12.118 -9.104 -7.404 138 H ASP 869 HN ASP 869 -10.357 -6.167 -4.658 139 HA ASP 869 HA ASP 869 -7.698 -6.832 -5.714 140 HB2 ASP 869 HB1 ASP 869 -8.679 -5.471 -3.205 141 HB3 ASP 869 HB2 ASP 869 -6.992 -5.880 -3.425 142 H ASP 870 HN ASP 870 -9.889 -8.860 -4.229 143 HA ASP 870 HA ASP 870 -7.763 -10.391 -2.824 144 HB2 ASP 870 HB1 ASP 870 -9.988 -10.035 -1.726 145 HB3 ASP 870 HB2 ASP 870 -10.721 -11.047 -2.966 146 H CYS 871 HN CYS 871 -10.259 -10.846 -5.376 147 HA CYS 871 HA CYS 871 -8.420 -12.723 -6.747 148 HB2 CYS 871 HB1 CYS 871 -10.152 -13.839 -7.756 149 HB3 CYS 871 HB2 CYS 871 -10.530 -13.743 -6.053 150 H PHE 872 HN PHE 872 -10.924 -11.200 -8.480 151 HA PHE 872 HA PHE 872 -9.336 -9.063 -9.707 152 HB2 PHE 872 HB1 PHE 872 -9.043 -10.043 -11.859 153 HB3 PHE 872 HB2 PHE 872 -8.341 -11.140 -10.689 154 HD1 PHE 872 HD1 PHE 872 -9.405 -13.348 -10.213 155 HD2 PHE 872 HD2 PHE 872 -11.061 -10.647 -13.135 156 HE1 PHE 872 HE1 PHE 872 -10.847 -15.172 -11.086 157 HE2 PHE 872 HE2 PHE 872 -12.505 -12.473 -14.007 158 HZ PHE 872 HZ PHE 872 -12.399 -14.737 -12.981 159 H LYS 873 HN LYS 873 -12.356 -10.696 -9.383 160 HA LYS 873 HA LYS 873 -13.798 -10.017 -11.630 161 HB2 LYS 873 HB1 LYS 873 -14.758 -10.203 -8.771 162 HB3 LYS 873 HB2 LYS 873 -15.827 -9.889 -10.150 163 HG2 LYS 873 HG1 LYS 873 -14.592 -11.934 -11.243 164 HG3 LYS 873 HG2 LYS 873 -14.293 -12.370 -9.528 165 HD2 LYS 873 HD1 LYS 873 -16.967 -11.761 -10.779 166 HD3 LYS 873 HD2 LYS 873 -16.350 -13.403 -10.516 167 HE2 LYS 873 HE1 LYS 873 -16.468 -11.405 -8.256 168 HE3 LYS 873 HE2 LYS 873 -17.941 -12.303 -8.693 169 HZ1 LYS 873 HZ1 LYS 873 -16.744 -13.417 -6.937 170 HZ2 LYS 873 HZ2 LYS 873 -16.680 -14.355 -8.284 171 HZ3 LYS 873 HZ3 LYS 873 -15.360 -13.483 -7.825 172 H TRP 874 HN TRP 874 -14.965 -8.495 -12.437 173 HA TRP 874 HA TRP 874 -14.688 -5.725 -11.380 174 HB2 TRP 874 HB1 TRP 874 -15.739 -6.593 -14.066 175 HB3 TRP 874 HB2 TRP 874 -15.397 -4.952 -13.546 176 HD1 TRP 874 HD1 TRP 874 -13.701 -7.914 -15.054 177 HE1 TRP 874 HE1 TRP 874 -11.179 -7.478 -15.372 178 HE3 TRP 874 HE3 TRP 874 -13.294 -3.560 -12.425 179 HZ2 TRP 874 HZ2 TRP 874 -9.298 -5.522 -14.674 180 HZ3 TRP 874 HZ3 TRP 874 -11.020 -2.526 -12.139 181 HH2 TRP 874 HH2 TRP 874 -9.090 -3.361 -13.316 182 H ARG 875 HN ARG 875 -16.417 -4.446 -10.872 183 HA ARG 875 HA ARG 875 -19.207 -5.389 -11.270 184 HB2 ARG 875 HB1 ARG 875 -17.923 -4.718 -8.583 185 HB3 ARG 875 HB2 ARG 875 -19.649 -4.517 -8.829 186 HG2 ARG 875 HG1 ARG 875 -18.093 -7.122 -9.037 187 HG3 ARG 875 HG2 ARG 875 -19.230 -6.658 -7.787 188 HD2 ARG 875 HD1 ARG 875 -19.822 -7.329 -10.683 189 HD3 ARG 875 HD2 ARG 875 -20.353 -8.169 -9.257 190 HE ARG 875 HE ARG 875 -21.686 -5.979 -8.739 191 HH11 ARG 875 HH11 ARG 875 -21.222 -7.150 -12.018 192 HH12 ARG 875 HH12 ARG 875 -22.691 -6.342 -12.553 193 HH21 ARG 875 HH21 ARG 875 -23.515 -5.062 -9.540 194 HH22 ARG 875 HH22 ARG 875 -23.882 -5.229 -11.259 195 H ARG 876 HN ARG 876 -20.636 -3.874 -11.770 196 HA ARG 876 HA ARG 876 -19.723 -1.127 -12.196 197 HB2 ARG 876 HB1 ARG 876 -21.328 -2.715 -13.631 198 HB3 ARG 876 HB2 ARG 876 -22.578 -1.953 -12.659 199 HG2 ARG 876 HG1 ARG 876 -20.497 -0.592 -14.424 200 HG3 ARG 876 HG2 ARG 876 -22.188 -0.835 -14.839 201 HD2 ARG 876 HD1 ARG 876 -21.152 0.954 -12.611 202 HD3 ARG 876 HD2 ARG 876 -21.612 1.483 -14.205 203 HE ARG 876 HE ARG 876 -23.507 0.229 -12.224 204 HH11 ARG 876 HH11 ARG 876 -23.016 2.536 -14.804 205 HH12 ARG 876 HH12 ARG 876 -24.625 3.184 -14.659 206 HH21 ARG 876 HH21 ARG 876 -25.533 1.118 -12.060 207 HH22 ARG 876 HH22 ARG 876 -25.993 2.439 -13.088 208 H ILE 877 HN ILE 877 -19.918 0.473 -10.878 209 HA ILE 877 HA ILE 877 -21.860 0.541 -8.612 210 HB ILE 877 HB ILE 877 -20.077 1.407 -7.190 211 HG12 ILE 877 HG11 ILE 877 -18.192 1.018 -9.553 212 HG13 ILE 877 HG12 ILE 877 -18.721 2.564 -8.920 213 HG21 ILE 877 HG21 ILE 877 -19.048 -1.137 -8.483 214 HG22 ILE 877 HG22 ILE 877 -18.920 -0.646 -6.777 215 HG23 ILE 877 HG23 ILE 877 -20.490 -1.091 -7.444 216 HD11 ILE 877 HD1 ILE 877 -17.576 2.261 -6.853 217 HD12 ILE 877 HD2 ILE 877 -17.139 0.594 -7.244 218 HD13 ILE 877 HD3 ILE 877 -16.454 1.928 -8.174 219 HA PRO 878 HA PRO 878 -22.263 4.891 -9.857 220 HB2 PRO 878 HB1 PRO 878 -22.831 6.174 -7.505 221 HB3 PRO 878 HB2 PRO 878 -24.012 5.108 -8.327 222 HG2 PRO 878 HG1 PRO 878 -22.133 4.391 -6.052 223 HG3 PRO 878 HG2 PRO 878 -23.896 4.086 -6.160 224 HD2 PRO 878 HD1 PRO 878 -22.075 2.174 -6.794 225 HD3 PRO 878 HD2 PRO 878 -23.589 2.341 -7.725 226 H ALA 879 HN ALA 879 -20.993 6.690 -9.981 227 HA ALA 879 HA ALA 879 -18.252 6.520 -9.484 228 HB1 ALA 879 HB1 ALA 879 -19.251 8.000 -11.153 229 HB2 ALA 879 HB2 ALA 879 -20.065 8.951 -9.885 230 HB3 ALA 879 HB3 ALA 879 -18.300 8.983 -10.026 231 H SER 880 HN SER 880 -20.712 7.698 -7.268 232 HA SER 880 HA SER 880 -19.116 9.158 -5.419 233 HB2 SER 880 HB1 SER 880 -21.544 7.417 -4.826 234 HB3 SER 880 HB2 SER 880 -20.925 8.758 -3.841 235 HG SER 880 HG1 SER 880 -22.673 9.427 -5.159 236 H VAL 881 HN VAL 881 -19.410 5.687 -5.968 237 HA VAL 881 HA VAL 881 -17.830 5.075 -3.527 238 HB VAL 881 HB VAL 881 -19.123 3.225 -5.563 239 HG11 VAL 881 HG11 VAL 881 -17.740 2.498 -2.946 240 HG12 VAL 881 HG12 VAL 881 -18.595 1.382 -4.029 241 HG13 VAL 881 HG13 VAL 881 -17.099 2.146 -4.566 242 HG21 VAL 881 HG21 VAL 881 -20.763 4.335 -4.086 243 HG22 VAL 881 HG22 VAL 881 -20.635 2.613 -3.719 244 HG23 VAL 881 HG23 VAL 881 -19.847 3.805 -2.663 245 H VAL 882 HN VAL 882 -17.536 5.095 -7.082 246 HA VAL 882 HA VAL 882 -14.977 3.822 -6.962 247 HB VAL 882 HB VAL 882 -16.546 4.197 -9.023 248 HG11 VAL 882 HG11 VAL 882 -14.489 6.372 -9.532 249 HG12 VAL 882 HG12 VAL 882 -15.780 5.841 -10.613 250 HG13 VAL 882 HG13 VAL 882 -16.169 6.694 -9.112 251 HG21 VAL 882 HG21 VAL 882 -13.501 4.187 -9.310 252 HG22 VAL 882 HG22 VAL 882 -14.495 2.764 -8.964 253 HG23 VAL 882 HG23 VAL 882 -14.675 3.605 -10.506 254 H GLY 883 HN GLY 883 -15.860 7.075 -6.383 255 HA2 GLY 883 HA1 GLY 883 -13.089 8.142 -6.453 256 HA3 GLY 883 HA2 GLY 883 -14.559 9.007 -6.025 257 H SER 884 HN SER 884 -15.222 6.673 -4.105 258 HA SER 884 HA SER 884 -13.743 7.615 -1.727 259 HB2 SER 884 HB1 SER 884 -16.164 7.179 -1.607 260 HB3 SER 884 HB2 SER 884 -15.892 5.487 -2.068 261 HG SER 884 HG1 SER 884 -16.077 5.821 0.227 262 H ILE 885 HN ILE 885 -14.054 4.691 -3.726 263 HA ILE 885 HA ILE 885 -11.976 3.124 -2.456 264 HB ILE 885 HB ILE 885 -13.615 3.018 -4.984 265 HG12 ILE 885 HG11 ILE 885 -14.266 0.839 -4.216 266 HG13 ILE 885 HG12 ILE 885 -13.034 0.823 -2.950 267 HG21 ILE 885 HG21 ILE 885 -11.198 1.234 -4.525 268 HG22 ILE 885 HG22 ILE 885 -12.474 0.988 -5.740 269 HG23 ILE 885 HG23 ILE 885 -11.434 2.397 -5.862 270 HD11 ILE 885 HD1 ILE 885 -15.422 1.159 -2.189 271 HD12 ILE 885 HD2 ILE 885 -14.261 2.374 -1.608 272 HD13 ILE 885 HD3 ILE 885 -15.374 2.750 -2.941 273 H ASP 886 HN ASP 886 -9.894 2.798 -3.130 274 HA ASP 886 HA ASP 886 -8.578 4.213 -5.273 275 HB2 ASP 886 HB1 ASP 886 -8.835 5.886 -3.236 276 HB3 ASP 886 HB2 ASP 886 -7.633 4.878 -2.470 277 H GLU 887 HN GLU 887 -6.045 3.819 -4.852 278 HA GLU 887 HA GLU 887 -5.570 0.985 -4.264 279 HB2 GLU 887 HB1 GLU 887 -3.830 3.387 -4.944 280 HB3 GLU 887 HB2 GLU 887 -3.112 1.833 -4.521 281 HG2 GLU 887 HG1 GLU 887 -5.171 2.203 -6.739 282 HG3 GLU 887 HG2 GLU 887 -3.428 2.176 -6.995 283 H SER 888 HN SER 888 -5.650 3.851 -2.395 284 HA SER 888 HA SER 888 -4.202 2.731 -0.088 285 HB2 SER 888 HB1 SER 888 -4.854 4.731 1.059 286 HB3 SER 888 HB2 SER 888 -4.276 5.146 -0.571 287 HG SER 888 HG1 SER 888 -6.220 6.253 -0.019 288 H SER 889 HN SER 889 -7.021 1.854 -1.509 289 HA SER 889 HA SER 889 -8.161 0.715 0.992 290 HB2 SER 889 HB1 SER 889 -9.575 2.588 0.158 291 HB3 SER 889 HB2 SER 889 -9.751 1.738 -1.392 292 HG SER 889 HG1 SER 889 -11.473 1.390 0.206 293 H ARG 890 HN ARG 890 -9.558 -1.204 0.447 294 HA ARG 890 HA ARG 890 -8.692 -2.765 -1.942 295 HB2 ARG 890 HB1 ARG 890 -8.514 -3.774 0.917 296 HB3 ARG 890 HB2 ARG 890 -8.504 -4.818 -0.513 297 HG2 ARG 890 HG1 ARG 890 -6.502 -3.614 -1.380 298 HG3 ARG 890 HG2 ARG 890 -6.449 -2.650 0.102 299 HD2 ARG 890 HD1 ARG 890 -6.227 -5.687 -0.049 300 HD3 ARG 890 HD2 ARG 890 -4.863 -4.589 0.108 301 HE ARG 890 HE ARG 890 -6.743 -5.410 2.198 302 HH11 ARG 890 HH11 ARG 890 -4.353 -2.967 1.408 303 HH12 ARG 890 HH12 ARG 890 -4.121 -2.532 3.079 304 HH21 ARG 890 HH21 ARG 890 -6.398 -4.798 4.299 305 HH22 ARG 890 HH22 ARG 890 -5.250 -3.545 4.665 306 H TRP 891 HN TRP 891 -10.597 -2.479 -2.916 307 HA TRP 891 HA TRP 891 -13.157 -3.224 -1.643 308 HB2 TRP 891 HB1 TRP 891 -12.899 -1.392 -3.363 309 HB3 TRP 891 HB2 TRP 891 -12.581 -2.642 -4.560 310 HD1 TRP 891 HD1 TRP 891 -15.246 -0.799 -2.805 311 HE1 TRP 891 HE1 TRP 891 -17.554 -1.454 -3.601 312 HE3 TRP 891 HE3 TRP 891 -13.985 -5.078 -5.329 313 HZ2 TRP 891 HZ2 TRP 891 -18.781 -3.758 -4.897 314 HZ3 TRP 891 HZ3 TRP 891 -15.793 -6.506 -6.317 315 HH2 TRP 891 HH2 TRP 891 -18.158 -5.871 -6.060 316 H ILE 892 HN ILE 892 -14.036 -5.276 -1.763 317 HA ILE 892 HA ILE 892 -12.935 -7.247 -3.687 318 HB ILE 892 HB ILE 892 -12.635 -8.914 -1.984 319 HG12 ILE 892 HG11 ILE 892 -13.160 -6.858 0.183 320 HG13 ILE 892 HG12 ILE 892 -14.412 -7.946 -0.413 321 HG21 ILE 892 HG21 ILE 892 -10.706 -7.422 -2.520 322 HG22 ILE 892 HG22 ILE 892 -11.117 -6.409 -1.124 323 HG23 ILE 892 HG23 ILE 892 -10.617 -8.077 -0.880 324 HD11 ILE 892 HD1 ILE 892 -11.844 -8.965 0.802 325 HD12 ILE 892 HD2 ILE 892 -13.420 -8.847 1.603 326 HD13 ILE 892 HD3 ILE 892 -13.234 -9.913 0.192 327 H CYS 893 HN CYS 893 -14.268 -9.214 -3.913 328 HA CYS 893 HA CYS 893 -16.979 -8.862 -4.197 329 HB2 CYS 893 HB1 CYS 893 -15.603 -11.480 -3.461 330 HB3 CYS 893 HB2 CYS 893 -17.188 -11.261 -4.220 331 H MET 894 HN MET 894 -15.391 -10.090 -1.136 332 HA MET 894 HA MET 894 -17.952 -10.725 0.048 333 HB2 MET 894 HB1 MET 894 -15.286 -10.299 1.437 334 HB3 MET 894 HB2 MET 894 -16.721 -11.051 2.131 335 HG2 MET 894 HG1 MET 894 -16.650 -12.784 0.330 336 HG3 MET 894 HG2 MET 894 -15.113 -12.120 -0.222 337 HE1 MET 894 HE1 MET 894 -13.483 -11.454 2.449 338 HE2 MET 894 HE2 MET 894 -12.638 -12.999 2.657 339 HE3 MET 894 HE3 MET 894 -12.841 -12.316 1.030 340 H ASN 895 HN ASN 895 -16.428 -7.695 -0.375 341 HA ASN 895 HA ASN 895 -17.940 -6.335 1.784 342 HB2 ASN 895 HB1 ASN 895 -16.186 -4.977 1.768 343 HB3 ASN 895 HB2 ASN 895 -15.441 -5.889 0.473 344 HD21 ASN 895 HD21 ASN 895 -16.330 -5.278 -1.843 345 HD22 ASN 895 HD22 ASN 895 -16.489 -3.540 -2.078 346 H ASN 896 HN ASN 896 -18.429 -7.260 -1.455 347 HA ASN 896 HA ASN 896 -19.577 -5.018 -2.651 348 HB2 ASN 896 HB1 ASN 896 -18.818 -7.142 -3.760 349 HB3 ASN 896 HB2 ASN 896 -20.268 -7.938 -3.134 350 HD21 ASN 896 HD21 ASN 896 -20.319 -8.402 -5.527 351 HD22 ASN 896 HD22 ASN 896 -21.328 -7.281 -6.431 352 H SER 897 HN SER 897 -21.472 -4.080 -2.724 353 HA SER 897 HA SER 897 -23.702 -4.472 -0.972 354 HB2 SER 897 HB1 SER 897 -23.366 -3.134 -3.688 355 HB3 SER 897 HB2 SER 897 -24.869 -3.095 -2.774 356 HG SER 897 HG1 SER 897 -23.543 -1.252 -2.335 357 H ASP 898 HN ASP 898 -23.097 -5.571 -4.274 358 HA ASP 898 HA ASP 898 -25.797 -6.639 -4.612 359 HB2 ASP 898 HB1 ASP 898 -23.444 -7.013 -6.464 360 HB3 ASP 898 HB2 ASP 898 -25.140 -7.218 -6.851 361 H LYS 899 HN LYS 899 -26.266 -8.333 -3.459 362 HA LYS 899 HA LYS 899 -24.662 -10.512 -2.664 363 HB2 LYS 899 HB1 LYS 899 -27.685 -10.399 -3.071 364 HB3 LYS 899 HB2 LYS 899 -26.820 -11.627 -2.153 365 HG2 LYS 899 HG1 LYS 899 -26.495 -8.708 -1.401 366 HG3 LYS 899 HG2 LYS 899 -27.934 -9.589 -0.907 367 HD2 LYS 899 HD1 LYS 899 -25.170 -10.701 -0.392 368 HD3 LYS 899 HD2 LYS 899 -25.962 -9.562 0.728 369 HE2 LYS 899 HE1 LYS 899 -27.892 -11.097 0.931 370 HE3 LYS 899 HE2 LYS 899 -27.126 -12.230 -0.185 371 HZ1 LYS 899 HZ1 LYS 899 -26.025 -11.439 2.464 372 HZ2 LYS 899 HZ2 LYS 899 -26.740 -12.865 2.132 373 HZ3 LYS 899 HZ3 LYS 899 -25.313 -12.492 1.435 374 H ARG 900 HN ARG 900 -26.055 -9.959 -5.736 375 HA ARG 900 HA ARG 900 -26.042 -12.594 -6.923 376 HB2 ARG 900 HB1 ARG 900 -25.672 -9.768 -7.999 377 HB3 ARG 900 HB2 ARG 900 -25.676 -11.189 -9.045 378 HG2 ARG 900 HG1 ARG 900 -27.975 -11.729 -8.404 379 HG3 ARG 900 HG2 ARG 900 -27.979 -10.444 -7.190 380 HD2 ARG 900 HD1 ARG 900 -29.180 -9.658 -9.123 381 HD3 ARG 900 HD2 ARG 900 -27.681 -8.743 -8.953 382 HE ARG 900 HE ARG 900 -27.796 -11.083 -10.816 383 HH11 ARG 900 HH11 ARG 900 -27.524 -7.557 -10.589 384 HH12 ARG 900 HH12 ARG 900 -26.928 -7.480 -12.248 385 HH21 ARG 900 HH21 ARG 900 -27.149 -10.744 -12.957 386 HH22 ARG 900 HH22 ARG 900 -26.792 -9.092 -13.456 387 H PHE 901 HN PHE 901 -23.436 -10.366 -6.136 388 HA PHE 901 HA PHE 901 -21.472 -12.311 -7.226 389 HB2 PHE 901 HB1 PHE 901 -21.025 -9.350 -7.507 390 HB3 PHE 901 HB2 PHE 901 -20.205 -10.647 -8.344 391 HD1 PHE 901 HD1 PHE 901 -20.959 -11.339 -10.537 392 HD2 PHE 901 HD2 PHE 901 -23.339 -8.673 -8.115 393 HE1 PHE 901 HE1 PHE 901 -22.531 -10.969 -12.432 394 HE2 PHE 901 HE2 PHE 901 -24.813 -8.213 -10.053 395 HZ PHE 901 HZ PHE 901 -24.418 -9.388 -12.212 396 H ALA 902 HN ALA 902 -22.344 -11.325 -4.423 397 HA ALA 902 HA ALA 902 -19.978 -10.021 -3.443 398 HB1 ALA 902 HB1 ALA 902 -21.207 -9.812 -1.331 399 HB2 ALA 902 HB2 ALA 902 -22.220 -9.330 -2.692 400 HB3 ALA 902 HB3 ALA 902 -22.457 -10.926 -1.929 401 H ASP 903 HN ASP 903 -19.380 -12.606 -4.391 402 HA ASP 903 HA ASP 903 -17.659 -13.455 -2.195 403 HB2 ASP 903 HB1 ASP 903 -19.686 -15.315 -3.436 404 HB3 ASP 903 HB2 ASP 903 -18.195 -15.902 -2.705 405 H CYS 904 HN CYS 904 -15.706 -14.290 -2.931 406 HA CYS 904 HA CYS 904 -14.923 -13.910 -5.616 407 HB2 CYS 904 HB1 CYS 904 -13.723 -15.600 -3.393 408 HB3 CYS 904 HB2 CYS 904 -12.915 -15.175 -4.903 409 H SER 905 HN SER 905 -16.865 -16.377 -4.319 410 HA SER 905 HA SER 905 -16.230 -18.481 -6.313 411 HB2 SER 905 HB1 SER 905 -18.320 -18.388 -4.111 412 HB3 SER 905 HB2 SER 905 -17.998 -19.751 -5.196 413 HG SER 905 HG1 SER 905 -16.197 -18.608 -3.291 414 H LYS 906 HN LYS 906 -18.480 -15.817 -5.883 415 HA LYS 906 HA LYS 906 -20.472 -16.774 -7.840 416 HB2 LYS 906 HB1 LYS 906 -19.816 -14.105 -6.558 417 HB3 LYS 906 HB2 LYS 906 -21.069 -14.285 -7.785 418 HG2 LYS 906 HG1 LYS 906 -21.129 -15.541 -5.025 419 HG3 LYS 906 HG2 LYS 906 -21.999 -14.114 -5.585 420 HD2 LYS 906 HD1 LYS 906 -23.664 -15.656 -5.761 421 HD3 LYS 906 HD2 LYS 906 -23.003 -15.776 -7.395 422 HE2 LYS 906 HE1 LYS 906 -21.649 -17.771 -6.635 423 HE3 LYS 906 HE2 LYS 906 -22.346 -17.600 -5.023 424 HZ1 LYS 906 HZ1 LYS 906 -23.905 -18.170 -7.492 425 HZ2 LYS 906 HZ2 LYS 906 -23.541 -19.258 -6.332 426 HZ3 LYS 906 HZ3 LYS 906 -24.542 -18.017 -5.994 427 H SER 907 HN SER 907 -20.917 -14.929 -9.660 428 HA SER 907 HA SER 907 -18.431 -14.226 -11.033 429 HB2 SER 907 HB1 SER 907 -18.846 -16.651 -11.454 430 HB3 SER 907 HB2 SER 907 -20.266 -16.134 -12.405 431 HG SER 907 HG1 SER 907 -18.331 -16.390 -13.693 432 H GLN 908 HN GLN 908 -18.604 -13.310 -12.863 433 HA GLN 908 HA GLN 908 -19.697 -10.805 -12.474 434 HB2 GLN 908 HB1 GLN 908 -17.439 -11.714 -13.309 435 HB3 GLN 908 HB2 GLN 908 -18.152 -11.748 -14.918 436 HG2 GLN 908 HG1 GLN 908 -18.319 -9.359 -14.981 437 HG3 GLN 908 HG2 GLN 908 -18.103 -9.216 -13.242 438 HE21 GLN 908 HE21 GLN 908 -16.459 -9.092 -16.208 439 HE22 GLN 908 HE22 GLN 908 -14.834 -9.449 -15.633 440 H GLU 909 HN GLU 909 -20.457 -9.241 -14.099 441 HA GLU 909 HA GLU 909 -22.927 -10.255 -15.330 442 HB2 GLU 909 HB1 GLU 909 -22.732 -8.367 -13.712 443 HB3 GLU 909 HB2 GLU 909 -21.943 -7.399 -14.955 444 HG2 GLU 909 HG1 GLU 909 -23.933 -7.141 -16.167 445 HG3 GLU 909 HG2 GLU 909 -24.603 -8.668 -15.585 446 H MET 910 HN MET 910 -19.863 -8.861 -16.377 447 HA MET 910 HA MET 910 -20.389 -9.829 -19.127 448 HB2 MET 910 HB1 MET 910 -19.293 -7.051 -18.497 449 HB3 MET 910 HB2 MET 910 -19.162 -7.840 -20.058 450 HG2 MET 910 HG1 MET 910 -21.818 -7.200 -18.728 451 HG3 MET 910 HG2 MET 910 -21.000 -6.156 -19.887 452 HE1 MET 910 HE1 MET 910 -23.255 -6.093 -21.282 453 HE2 MET 910 HE2 MET 910 -24.082 -7.544 -21.887 454 HE3 MET 910 HE3 MET 910 -24.016 -7.225 -20.140 455 H SER 911 HN SER 911 -18.548 -10.886 -19.937 456 HA SER 911 HA SER 911 -16.350 -11.431 -18.144 457 HB2 SER 911 HB1 SER 911 -16.191 -11.872 -21.113 458 HB3 SER 911 HB2 SER 911 -15.453 -12.805 -19.816 459 HG SER 911 HG1 SER 911 -17.275 -13.890 -20.704 460 H ASN 912 HN ASN 912 -14.022 -11.070 -18.692 461 HA ASN 912 HA ASN 912 -13.679 -8.213 -18.745 462 HB2 ASN 912 HB1 ASN 912 -11.508 -10.367 -18.872 463 HB3 ASN 912 HB2 ASN 912 -11.267 -8.674 -18.429 464 HD21 ASN 912 HD21 ASN 912 -10.166 -9.987 -16.620 465 HD22 ASN 912 HD22 ASN 912 -11.198 -10.275 -15.230 466 H GLU 913 HN GLU 913 -13.497 -10.405 -21.401 467 HA GLU 913 HA GLU 913 -12.152 -8.541 -23.213 468 HB2 GLU 913 HB1 GLU 913 -12.303 -10.919 -23.711 469 HB3 GLU 913 HB2 GLU 913 -14.074 -10.851 -23.685 470 HG2 GLU 913 HG1 GLU 913 -14.109 -9.429 -25.663 471 HG3 GLU 913 HG2 GLU 913 -12.353 -9.250 -25.615 472 H GLU 914 HN GLU 914 -15.531 -9.096 -22.185 473 HA GLU 914 HA GLU 914 -16.657 -7.183 -24.101 474 HB2 GLU 914 HB1 GLU 914 -17.878 -8.573 -21.689 475 HB3 GLU 914 HB2 GLU 914 -18.763 -7.598 -22.852 476 HG2 GLU 914 HG1 GLU 914 -17.341 -10.244 -23.343 477 HG3 GLU 914 HG2 GLU 914 -19.075 -9.973 -23.285 478 H ILE 915 HN ILE 915 -16.099 -7.189 -20.514 479 HA ILE 915 HA ILE 915 -16.667 -4.368 -20.463 480 HB ILE 915 HB ILE 915 -17.386 -5.702 -18.716 481 HG12 ILE 915 HG11 ILE 915 -17.015 -4.221 -16.911 482 HG13 ILE 915 HG12 ILE 915 -15.411 -3.793 -17.422 483 HG21 ILE 915 HG21 ILE 915 -14.480 -6.155 -17.958 484 HG22 ILE 915 HG22 ILE 915 -15.832 -6.390 -16.825 485 HG23 ILE 915 HG23 ILE 915 -15.745 -7.356 -18.283 486 HD11 ILE 915 HD1 ILE 915 -16.386 -2.632 -19.463 487 HD12 ILE 915 HD2 ILE 915 -17.998 -2.958 -18.798 488 HD13 ILE 915 HD3 ILE 915 -16.821 -1.925 -17.930 489 H ASN 916 HN ASN 916 -14.315 -5.539 -21.809 490 HA ASN 916 HA ASN 916 -12.778 -3.021 -21.315 491 HB2 ASN 916 HB1 ASN 916 -10.707 -3.766 -21.814 492 HB3 ASN 916 HB2 ASN 916 -11.366 -5.065 -20.869 493 HD21 ASN 916 HD21 ASN 916 -10.332 -6.856 -21.631 494 HD22 ASN 916 HD22 ASN 916 -10.061 -7.241 -23.328 495 H GLU 917 HN GLU 917 -14.171 -5.050 -23.867 496 HA GLU 917 HA GLU 917 -13.829 -3.196 -26.012 497 HB2 GLU 917 HB1 GLU 917 -15.707 -5.428 -25.363 498 HB3 GLU 917 HB2 GLU 917 -16.113 -4.386 -26.697 499 HG2 GLU 917 HG1 GLU 917 -13.484 -5.912 -26.392 500 HG3 GLU 917 HG2 GLU 917 -14.851 -6.445 -27.363 501 H GLU 918 HN GLU 918 -16.308 -3.334 -23.471 502 HA GLU 918 HA GLU 918 -18.145 -1.496 -24.471 503 HB2 GLU 918 HB1 GLU 918 -18.237 -2.950 -22.329 504 HB3 GLU 918 HB2 GLU 918 -17.310 -1.659 -21.561 505 HG2 GLU 918 HG1 GLU 918 -19.521 -1.312 -20.918 506 HG3 GLU 918 HG2 GLU 918 -19.221 -0.076 -22.120 507 H LEU 919 HN LEU 919 -15.047 -0.797 -22.982 508 HA LEU 919 HA LEU 919 -15.563 2.136 -23.122 509 HB2 LEU 919 HB1 LEU 919 -13.245 0.809 -21.701 510 HB3 LEU 919 HB2 LEU 919 -13.814 2.460 -21.576 511 HG LEU 919 HG LEU 919 -16.082 1.083 -20.786 512 HD11 LEU 919 HD11 LEU 919 -14.938 -1.102 -20.841 513 HD12 LEU 919 HD12 LEU 919 -13.664 -0.476 -19.784 514 HD13 LEU 919 HD13 LEU 919 -15.328 -0.627 -19.185 515 HD21 LEU 919 HD21 LEU 919 -13.734 2.012 -19.093 516 HD22 LEU 919 HD22 LEU 919 -15.131 2.965 -19.595 517 HD23 LEU 919 HD23 LEU 919 -15.354 1.614 -18.453 518 H GLY 920 HN GLY 920 -13.492 -0.434 -24.325 519 HA2 GLY 920 HA1 GLY 920 -12.339 -0.449 -26.387 520 HA3 GLY 920 HA2 GLY 920 -12.376 1.316 -26.459 521 H ILE 921 HN ILE 921 -11.267 -0.969 -23.930 522 HA ILE 921 HA ILE 921 -8.597 0.382 -23.855 523 HB ILE 921 HB ILE 921 -8.643 0.251 -21.438 524 HG12 ILE 921 HG11 ILE 921 -11.526 -0.721 -21.673 525 HG13 ILE 921 HG12 ILE 921 -10.136 -1.708 -21.206 526 HG21 ILE 921 HG21 ILE 921 -10.122 2.116 -21.030 527 HG22 ILE 921 HG22 ILE 921 -9.420 2.283 -22.641 528 HG23 ILE 921 HG23 ILE 921 -11.099 1.729 -22.462 529 HD11 ILE 921 HD1 ILE 921 -11.288 -1.083 -19.211 530 HD12 ILE 921 HD2 ILE 921 -9.721 -0.249 -19.252 531 HD13 ILE 921 HD3 ILE 921 -11.219 0.639 -19.634 532 H GLY 922 HN GLY 922 -6.975 -0.806 -22.584 533 HA2 GLY 922 HA1 GLY 922 -6.886 -3.653 -23.511 534 HA3 GLY 922 HA2 GLY 922 -5.510 -2.575 -23.329 535 H GLN 923 HN GLN 923 -8.081 -4.180 -21.394 536 HA GLN 923 HA GLN 923 -6.392 -4.219 -18.988 537 HB2 GLN 923 HB1 GLN 923 -9.175 -4.433 -19.409 538 HB3 GLN 923 HB2 GLN 923 -8.686 -6.042 -18.908 539 HG2 GLN 923 HG1 GLN 923 -9.180 -5.012 -16.910 540 HG3 GLN 923 HG2 GLN 923 -7.436 -4.896 -16.958 541 HE21 GLN 923 HE21 GLN 923 -9.796 -3.137 -15.745 542 HE22 GLN 923 HE22 GLN 923 -9.285 -1.527 -16.235 543 H ASP 924 HN ASP 924 -6.266 -6.457 -17.842 544 HA ASP 924 HA ASP 924 -4.327 -8.002 -19.235 545 HB2 ASP 924 HB1 ASP 924 -4.603 -7.659 -16.743 546 HB3 ASP 924 HB2 ASP 924 -5.963 -8.776 -16.782 547 H GLU 925 HN GLU 925 -7.754 -8.442 -18.907 548 HA GLU 925 HA GLU 925 -9.339 -9.656 -19.866 549 HB2 GLU 925 HB1 GLU 925 -8.011 -8.823 -21.845 550 HB3 GLU 925 HB2 GLU 925 -7.348 -10.446 -22.004 551 HG2 GLU 925 HG1 GLU 925 -9.619 -11.381 -22.247 552 HG3 GLU 925 HG2 GLU 925 -10.312 -9.779 -21.978 553 H ALA 926 HN ALA 926 -6.469 -11.688 -20.147 554 HA ALA 926 HA ALA 926 -7.728 -13.966 -18.749 555 HB1 ALA 926 HB1 ALA 926 -7.032 -14.164 -21.711 556 HB2 ALA 926 HB2 ALA 926 -7.534 -15.509 -20.661 557 HB3 ALA 926 HB3 ALA 926 -8.669 -14.197 -21.020 558 H ASP 927 HN ASP 927 -4.989 -13.038 -20.852 559 HA ASP 927 HA ASP 927 -2.868 -13.693 -21.016 560 HB2 ASP 927 HB1 ASP 927 -2.836 -12.502 -18.780 561 HB3 ASP 927 HB2 ASP 927 -2.823 -14.086 -18.011 562 H ALA 928 HN ALA 928 -5.069 -15.832 -20.831 563 HA ALA 928 HA ALA 928 -3.850 -18.313 -20.084 564 HB1 ALA 928 HB1 ALA 928 -6.183 -17.722 -21.957 565 HB2 ALA 928 HB2 ALA 928 -5.787 -19.300 -21.249 566 HB3 ALA 928 HB3 ALA 928 -6.283 -17.963 -20.195 567 H1 ALA 1 HT1 ALA 1 -8.401 0.188 -5.072 568 H2 ALA 1 HT2 ALA 1 -6.949 -0.380 -5.614 569 H3 ALA 1 HT3 ALA 1 -7.900 -1.337 -4.684 570 HA ALA 1 HA ALA 1 -7.983 -2.081 -6.904 571 HB1 ALA 1 HB1 ALA 1 -10.014 -2.411 -5.579 572 HB2 ALA 1 HB2 ALA 1 -10.594 -0.790 -6.004 573 HB3 ALA 1 HB3 ALA 1 -10.433 -2.039 -7.255 574 H ARG 2 HN ARG 2 -6.682 -0.936 -8.439 575 HA ARG 2 HA ARG 2 -7.636 1.350 -9.900 576 HB2 ARG 2 HB1 ARG 2 -5.905 0.960 -11.380 577 HB3 ARG 2 HB2 ARG 2 -5.305 0.173 -9.936 578 HG2 ARG 2 HG1 ARG 2 -4.853 -1.523 -11.400 579 HG3 ARG 2 HG2 ARG 2 -6.521 -1.979 -11.090 580 HD2 ARG 2 HD1 ARG 2 -7.053 -0.361 -13.126 581 HD3 ARG 2 HD2 ARG 2 -5.351 -0.541 -13.499 582 HE ARG 2 HE ARG 2 -7.469 -2.631 -13.484 583 HH11 ARG 2 HH11 ARG 2 -4.142 -1.890 -14.339 584 HH12 ARG 2 HH12 ARG 2 -3.930 -3.404 -15.174 585 HH21 ARG 2 HH21 ARG 2 -6.962 -4.696 -14.267 586 HH22 ARG 2 HH22 ARG 2 -5.446 -4.943 -15.072 587 H THR 3 HN THR 3 -8.831 1.490 -11.907 588 HA THR 3 HA THR 3 -10.149 -0.853 -13.008 589 HB THR 3 HB THR 3 -11.295 -0.550 -10.723 590 HG1 THR 3 HG1 THR 3 -12.566 -1.545 -12.168 591 HG21 THR 3 HG21 THR 3 -11.190 2.015 -10.769 592 HG22 THR 3 HG22 THR 3 -12.598 1.936 -11.861 593 HG23 THR 3 HG23 THR 3 -12.690 1.268 -10.224 594 H MLZ 4 HN MLZ 4 -12.450 0.110 -13.983 595 HA MLZ 4 HA MLZ 4 -11.658 2.169 -15.974 596 HB2 MLZ 4 HB1 MLZ 4 -12.593 0.816 -17.686 597 HB3 MLZ 4 HB2 MLZ 4 -11.513 -0.214 -16.798 598 HG2 MLZ 4 HG1 MLZ 4 -14.543 -0.194 -16.351 599 HG3 MLZ 4 HG2 MLZ 4 -13.774 -1.142 -17.608 600 HD2 MLZ 4 HD1 MLZ 4 -13.085 -1.511 -14.702 601 HD3 MLZ 4 HD2 MLZ 4 -14.328 -2.429 -15.533 602 HE2 MLZ 4 HE1 MLZ 4 -11.579 -2.293 -16.763 603 HE3 MLZ 4 HE2 MLZ 4 -11.819 -3.308 -15.315 604 HZ MLZ 4 HZ1 MLZ 4 -13.465 -3.550 -17.793 605 HCM1 MLZ 4 HC1 MLZ 4 -12.222 -5.501 -18.333 606 HCM2 MLZ 4 HC2 MLZ 4 -11.142 -4.108 -18.223 607 HCM3 MLZ 4 HC3 MLZ 4 -11.240 -5.278 -16.878 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.516 -4.549 -16.490 609 H GLN 5 HN GLN 5 -13.341 3.442 -16.895 610 HA GLN 5 HA GLN 5 -15.714 3.802 -15.103 611 HB2 GLN 5 HB1 GLN 5 -13.960 5.972 -16.316 612 HB3 GLN 5 HB2 GLN 5 -15.403 6.189 -15.335 613 HG2 GLN 5 HG1 GLN 5 -13.592 6.576 -13.870 614 HG3 GLN 5 HG2 GLN 5 -14.230 5.006 -13.431 615 HE21 GLN 5 HE21 GLN 5 -12.243 4.307 -12.452 616 HE22 GLN 5 HE22 GLN 5 -10.856 3.905 -13.472 617 H THR 6 HN THR 6 -17.249 2.830 -16.405 618 HA THR 6 HA THR 6 -17.443 3.050 -19.197 619 HB THR 6 HB THR 6 -19.978 2.466 -18.615 620 HG1 THR 6 HG1 THR 6 -19.715 2.777 -16.377 621 HG21 THR 6 HG21 THR 6 -17.632 0.573 -18.240 622 HG22 THR 6 HG22 THR 6 -19.322 0.129 -18.615 623 HG23 THR 6 HG23 THR 6 -18.369 1.031 -19.791 624 H ALA 7 HN ALA 7 -18.236 4.447 -20.587 625 HA ALA 7 HA ALA 7 -19.677 6.879 -19.677 626 HB1 ALA 7 HB1 ALA 7 -18.439 6.131 -22.361 627 HB2 ALA 7 HB2 ALA 7 -19.097 7.717 -21.907 628 HB3 ALA 7 HB3 ALA 7 -17.658 7.092 -21.082 629 H ARG 8 HN ARG 8 -20.404 3.851 -21.167 630 HA ARG 8 HA ARG 8 -22.775 4.724 -22.672 631 HB2 ARG 8 HB1 ARG 8 -21.552 1.983 -22.131 632 HB3 ARG 8 HB2 ARG 8 -22.974 2.264 -23.147 633 HG2 ARG 8 HG1 ARG 8 -21.681 3.649 -24.692 634 HG3 ARG 8 HG2 ARG 8 -20.227 3.480 -23.684 635 HD2 ARG 8 HD1 ARG 8 -20.229 1.065 -24.014 636 HD3 ARG 8 HD2 ARG 8 -21.715 1.160 -24.982 637 HE ARG 8 HE ARG 8 -19.818 2.864 -26.193 638 HH11 ARG 8 HH11 ARG 8 -20.074 -0.594 -25.586 639 HH12 ARG 8 HH12 ARG 8 -19.166 -0.987 -27.030 640 HH21 ARG 8 HH21 ARG 8 -18.613 2.269 -27.967 641 HH22 ARG 8 HH22 ARG 8 -18.328 0.587 -28.302 642 H TYR 9 HN TYR 9 -23.516 5.732 -20.589 643 HA TYR 9 HA TYR 9 -25.618 4.042 -19.376 644 HB2 TYR 9 HB1 TYR 9 -23.633 3.777 -17.927 645 HB3 TYR 9 HB2 TYR 9 -23.537 5.519 -17.725 646 HD1 TYR 9 HD1 TYR 9 -24.453 6.387 -15.737 647 HD2 TYR 9 HD2 TYR 9 -26.054 2.729 -17.372 648 HE1 TYR 9 HE1 TYR 9 -25.923 6.141 -13.742 649 HE2 TYR 9 HE2 TYR 9 -27.536 2.491 -15.378 650 HH TYR 9 HH TYR 9 -27.606 4.900 -12.745 Start of MODEL 16 1 H1 GLY 850 HT1 GLY 850 -3.285 -3.673 -3.096 2 H2 GLY 850 HT2 GLY 850 -4.315 -4.736 -2.398 3 H3 GLY 850 HT3 GLY 850 -4.402 -4.459 -4.006 4 HA2 GLY 850 HA1 GLY 850 -2.161 -5.763 -2.579 5 HA3 GLY 850 HA2 GLY 850 -3.344 -6.580 -3.618 6 H SER 851 HN SER 851 -0.232 -5.507 -3.589 7 HA SER 851 HA SER 851 0.002 -3.861 -5.820 8 HB2 SER 851 HB1 SER 851 2.135 -5.718 -4.707 9 HB3 SER 851 HB2 SER 851 2.405 -4.225 -5.630 10 HG SER 851 HG1 SER 851 2.601 -3.879 -3.368 11 H ARG 852 HN ARG 852 -0.506 -7.153 -5.956 12 HA ARG 852 HA ARG 852 0.588 -7.663 -8.665 13 HB2 ARG 852 HB1 ARG 852 -1.169 -9.235 -6.740 14 HB3 ARG 852 HB2 ARG 852 -1.026 -9.713 -8.424 15 HG2 ARG 852 HG1 ARG 852 0.513 -11.000 -7.119 16 HG3 ARG 852 HG2 ARG 852 1.394 -9.963 -8.239 17 HD2 ARG 852 HD1 ARG 852 1.962 -8.417 -6.388 18 HD3 ARG 852 HD2 ARG 852 0.975 -9.371 -5.279 19 HE ARG 852 HE ARG 852 2.627 -10.996 -5.145 20 HH11 ARG 852 HH11 ARG 852 3.589 -8.780 -7.693 21 HH12 ARG 852 HH12 ARG 852 5.193 -9.452 -7.785 22 HH21 ARG 852 HH21 ARG 852 4.683 -11.796 -5.326 23 HH22 ARG 852 HH22 ARG 852 5.788 -11.112 -6.481 24 H ARG 853 HN ARG 853 -2.416 -6.424 -7.371 25 HA ARG 853 HA ARG 853 -3.554 -6.144 -10.139 26 HB2 ARG 853 HB1 ARG 853 -4.911 -6.102 -7.414 27 HB3 ARG 853 HB2 ARG 853 -5.690 -5.778 -8.944 28 HG2 ARG 853 HG1 ARG 853 -4.444 -8.445 -8.103 29 HG3 ARG 853 HG2 ARG 853 -6.155 -8.038 -8.093 30 HD2 ARG 853 HD1 ARG 853 -5.838 -9.356 -9.999 31 HD3 ARG 853 HD2 ARG 853 -6.049 -7.687 -10.569 32 HE ARG 853 HE ARG 853 -3.256 -8.280 -10.259 33 HH11 ARG 853 HH11 ARG 853 -5.783 -9.205 -12.522 34 HH12 ARG 853 HH12 ARG 853 -4.669 -9.059 -13.877 35 HH21 ARG 853 HH21 ARG 853 -1.973 -8.203 -11.982 36 HH22 ARG 853 HH22 ARG 853 -2.600 -8.629 -13.572 37 H ALA 854 HN ALA 854 -2.249 -4.319 -7.607 38 HA ALA 854 HA ALA 854 -1.383 -2.146 -7.722 39 HB1 ALA 854 HB1 ALA 854 -2.050 -2.309 -10.669 40 HB2 ALA 854 HB2 ALA 854 -0.805 -1.314 -9.882 41 HB3 ALA 854 HB3 ALA 854 -0.638 -3.071 -9.902 42 H SER 855 HN SER 855 -2.115 0.024 -9.334 43 HA SER 855 HA SER 855 -4.836 0.814 -8.361 44 HB2 SER 855 HB1 SER 855 -3.950 2.915 -7.545 45 HB3 SER 855 HB2 SER 855 -3.230 1.548 -6.707 46 HG SER 855 HG1 SER 855 -1.795 3.325 -7.483 47 H VAL 856 HN VAL 856 -5.238 3.200 -9.099 48 HA VAL 856 HA VAL 856 -4.293 3.910 -11.756 49 HB VAL 856 HB VAL 856 -6.030 2.135 -12.195 50 HG11 VAL 856 HG11 VAL 856 -7.656 2.657 -10.429 51 HG12 VAL 856 HG12 VAL 856 -7.996 4.228 -11.181 52 HG13 VAL 856 HG13 VAL 856 -8.415 2.751 -12.032 53 HG21 VAL 856 HG21 VAL 856 -6.818 4.826 -13.357 54 HG22 VAL 856 HG22 VAL 856 -5.401 3.876 -13.876 55 HG23 VAL 856 HG23 VAL 856 -7.031 3.225 -14.060 56 H GLY 857 HN GLY 857 -4.995 5.990 -12.455 57 HA2 GLY 857 HA1 GLY 857 -6.254 7.786 -10.414 58 HA3 GLY 857 HA2 GLY 857 -5.186 8.303 -11.719 59 H SER 858 HN SER 858 -8.237 6.355 -11.435 60 HA SER 858 HA SER 858 -9.196 7.081 -14.053 61 HB2 SER 858 HB1 SER 858 -11.213 5.817 -13.323 62 HB3 SER 858 HB2 SER 858 -9.702 4.913 -13.143 63 HG SER 858 HG1 SER 858 -11.169 4.825 -11.296 64 H GLU 859 HN GLU 859 -11.301 7.964 -14.439 65 HA GLU 859 HA GLU 859 -11.833 10.481 -12.962 66 HB2 GLU 859 HB1 GLU 859 -12.984 9.390 -15.563 67 HB3 GLU 859 HB2 GLU 859 -13.389 10.942 -14.853 68 HG2 GLU 859 HG1 GLU 859 -10.673 10.077 -15.920 69 HG3 GLU 859 HG2 GLU 859 -11.792 11.201 -16.675 70 H PHE 860 HN PHE 860 -13.897 11.036 -12.213 71 HA PHE 860 HA PHE 860 -15.163 8.920 -10.753 72 HB2 PHE 860 HB1 PHE 860 -16.062 11.799 -11.108 73 HB3 PHE 860 HB2 PHE 860 -16.596 10.689 -9.862 74 HD1 PHE 860 HD1 PHE 860 -14.604 9.601 -8.396 75 HD2 PHE 860 HD2 PHE 860 -14.330 13.308 -10.592 76 HE1 PHE 860 HE1 PHE 860 -12.686 10.309 -6.979 77 HE2 PHE 860 HE2 PHE 860 -12.430 14.013 -9.162 78 HZ PHE 860 HZ PHE 860 -11.605 12.514 -7.355 79 H THR 861 HN THR 861 -16.432 10.967 -13.383 80 HA THR 861 HA THR 861 -18.373 10.996 -14.549 81 HB THR 861 HB THR 861 -17.202 9.246 -15.744 82 HG1 THR 861 HG1 THR 861 -19.093 9.901 -16.601 83 HG21 THR 861 HG21 THR 861 -18.804 7.285 -14.066 84 HG22 THR 861 HG22 THR 861 -18.070 6.901 -15.637 85 HG23 THR 861 HG23 THR 861 -17.049 7.373 -14.274 86 H GLU 862 HN GLU 862 -20.516 8.998 -14.623 87 HA GLU 862 HA GLU 862 -21.917 9.722 -12.078 88 HB2 GLU 862 HB1 GLU 862 -23.010 8.632 -14.694 89 HB3 GLU 862 HB2 GLU 862 -23.962 9.040 -13.253 90 HG2 GLU 862 HG1 GLU 862 -23.092 11.383 -13.381 91 HG3 GLU 862 HG2 GLU 862 -22.218 10.958 -14.849 92 H SER 863 HN SER 863 -21.001 6.911 -13.960 93 HA SER 863 HA SER 863 -20.980 5.187 -11.601 94 HB2 SER 863 HB1 SER 863 -22.766 4.493 -13.961 95 HB3 SER 863 HB2 SER 863 -22.235 3.345 -12.718 96 HG SER 863 HG1 SER 863 -23.763 5.699 -12.272 97 H ALA 864 HN ALA 864 -19.494 3.635 -11.699 98 HA ALA 864 HA ALA 864 -17.810 3.354 -14.171 99 HB1 ALA 864 HB1 ALA 864 -16.889 5.094 -12.653 100 HB2 ALA 864 HB2 ALA 864 -16.884 3.921 -11.319 101 HB3 ALA 864 HB3 ALA 864 -15.823 3.679 -12.716 102 H TRP 865 HN TRP 865 -15.932 1.594 -13.429 103 HA TRP 865 HA TRP 865 -17.289 -0.689 -12.023 104 HB2 TRP 865 HB1 TRP 865 -15.028 -0.790 -14.022 105 HB3 TRP 865 HB2 TRP 865 -15.650 -2.140 -13.101 106 HD1 TRP 865 HD1 TRP 865 -16.909 0.325 -15.784 107 HE1 TRP 865 HE1 TRP 865 -18.630 -0.834 -17.259 108 HE3 TRP 865 HE3 TRP 865 -17.220 -4.090 -13.265 109 HZ2 TRP 865 HZ2 TRP 865 -20.098 -3.379 -17.254 110 HZ3 TRP 865 HZ3 TRP 865 -18.730 -5.935 -14.075 111 HH2 TRP 865 HH2 TRP 865 -20.192 -5.569 -16.004 112 H VAL 866 HN VAL 866 -15.815 -2.048 -10.787 113 HA VAL 866 HA VAL 866 -13.282 -0.858 -9.852 114 HB VAL 866 HB VAL 866 -14.889 -0.044 -8.223 115 HG11 VAL 866 HG11 VAL 866 -16.127 -1.511 -6.731 116 HG12 VAL 866 HG12 VAL 866 -16.602 -1.856 -8.398 117 HG13 VAL 866 HG13 VAL 866 -15.502 -2.955 -7.548 118 HG21 VAL 866 HG21 VAL 866 -13.196 -2.220 -6.962 119 HG22 VAL 866 HG22 VAL 866 -12.604 -0.616 -7.472 120 HG23 VAL 866 HG23 VAL 866 -13.828 -0.755 -6.198 121 H ARG 867 HN ARG 867 -11.745 -2.386 -9.311 122 HA ARG 867 HA ARG 867 -12.383 -5.203 -9.964 123 HB2 ARG 867 HB1 ARG 867 -10.360 -3.669 -10.836 124 HB3 ARG 867 HB2 ARG 867 -9.602 -4.294 -9.402 125 HG2 ARG 867 HG1 ARG 867 -10.224 -6.635 -10.240 126 HG3 ARG 867 HG2 ARG 867 -10.649 -5.870 -11.790 127 HD2 ARG 867 HD1 ARG 867 -8.335 -4.912 -11.886 128 HD3 ARG 867 HD2 ARG 867 -7.926 -5.911 -10.457 129 HE ARG 867 HE ARG 867 -9.043 -7.764 -11.994 130 HH11 ARG 867 HH11 ARG 867 -6.590 -5.447 -13.043 131 HH12 ARG 867 HH12 ARG 867 -6.262 -6.411 -14.484 132 HH21 ARG 867 HH21 ARG 867 -8.555 -8.804 -13.914 133 HH22 ARG 867 HH22 ARG 867 -7.282 -8.119 -14.921 134 H CYS 868 HN CYS 868 -11.906 -6.932 -8.578 135 HA CYS 868 HA CYS 868 -11.810 -6.468 -5.731 136 HB2 CYS 868 HB1 CYS 868 -13.030 -8.310 -6.775 137 HB3 CYS 868 HB2 CYS 868 -11.521 -8.982 -7.402 138 H ASP 869 HN ASP 869 -10.093 -6.055 -4.519 139 HA ASP 869 HA ASP 869 -7.320 -6.404 -5.326 140 HB2 ASP 869 HB1 ASP 869 -8.757 -5.572 -2.789 141 HB3 ASP 869 HB2 ASP 869 -7.036 -5.897 -2.760 142 H ASP 870 HN ASP 870 -9.514 -8.805 -4.273 143 HA ASP 870 HA ASP 870 -7.337 -10.358 -2.927 144 HB2 ASP 870 HB1 ASP 870 -9.330 -9.825 -1.560 145 HB3 ASP 870 HB2 ASP 870 -10.331 -10.754 -2.681 146 H CYS 871 HN CYS 871 -9.785 -10.524 -5.501 147 HA CYS 871 HA CYS 871 -8.128 -12.679 -6.674 148 HB2 CYS 871 HB1 CYS 871 -9.887 -13.730 -7.727 149 HB3 CYS 871 HB2 CYS 871 -10.310 -13.585 -6.040 150 H PHE 872 HN PHE 872 -10.458 -11.189 -8.537 151 HA PHE 872 HA PHE 872 -8.960 -8.983 -9.693 152 HB2 PHE 872 HB1 PHE 872 -8.512 -9.952 -11.869 153 HB3 PHE 872 HB2 PHE 872 -7.647 -10.817 -10.621 154 HD1 PHE 872 HD1 PHE 872 -10.413 -11.033 -13.089 155 HD2 PHE 872 HD2 PHE 872 -8.151 -13.161 -10.095 156 HE1 PHE 872 HE1 PHE 872 -11.376 -13.180 -13.883 157 HE2 PHE 872 HE2 PHE 872 -9.117 -15.305 -10.893 158 HZ PHE 872 HZ PHE 872 -10.732 -15.317 -12.786 159 H LYS 873 HN LYS 873 -11.822 -10.658 -9.384 160 HA LYS 873 HA LYS 873 -13.522 -10.254 -11.496 161 HB2 LYS 873 HB1 LYS 873 -13.934 -11.211 -9.125 162 HB3 LYS 873 HB2 LYS 873 -14.246 -9.550 -8.635 163 HG2 LYS 873 HG1 LYS 873 -16.372 -9.850 -9.210 164 HG3 LYS 873 HG2 LYS 873 -15.886 -9.984 -10.890 165 HD2 LYS 873 HD1 LYS 873 -17.147 -11.931 -10.476 166 HD3 LYS 873 HD2 LYS 873 -15.457 -12.471 -10.462 167 HE2 LYS 873 HE1 LYS 873 -15.509 -12.075 -7.919 168 HE3 LYS 873 HE2 LYS 873 -17.248 -11.819 -8.073 169 HZ1 LYS 873 HZ1 LYS 873 -16.917 -14.030 -7.490 170 HZ2 LYS 873 HZ2 LYS 873 -17.297 -14.122 -9.085 171 HZ3 LYS 873 HZ3 LYS 873 -15.740 -14.311 -8.609 172 H TRP 874 HN TRP 874 -14.973 -8.710 -12.172 173 HA TRP 874 HA TRP 874 -14.500 -5.880 -11.339 174 HB2 TRP 874 HB1 TRP 874 -15.713 -6.901 -13.939 175 HB3 TRP 874 HB2 TRP 874 -15.375 -5.250 -13.506 176 HD1 TRP 874 HD1 TRP 874 -13.706 -8.294 -14.901 177 HE1 TRP 874 HE1 TRP 874 -11.246 -7.795 -15.474 178 HE3 TRP 874 HE3 TRP 874 -13.258 -3.737 -12.624 179 HZ2 TRP 874 HZ2 TRP 874 -9.370 -5.724 -15.015 180 HZ3 TRP 874 HZ3 TRP 874 -11.079 -2.563 -12.679 181 HH2 TRP 874 HH2 TRP 874 -9.138 -3.492 -13.866 182 H ARG 875 HN ARG 875 -16.216 -4.518 -10.908 183 HA ARG 875 HA ARG 875 -18.989 -5.512 -11.098 184 HB2 ARG 875 HB1 ARG 875 -17.636 -4.665 -8.503 185 HB3 ARG 875 HB2 ARG 875 -19.368 -4.494 -8.716 186 HG2 ARG 875 HG1 ARG 875 -17.797 -7.100 -8.783 187 HG3 ARG 875 HG2 ARG 875 -18.899 -6.550 -7.539 188 HD2 ARG 875 HD1 ARG 875 -19.590 -7.512 -10.305 189 HD3 ARG 875 HD2 ARG 875 -20.058 -8.174 -8.760 190 HE ARG 875 HE ARG 875 -21.461 -6.078 -8.411 191 HH11 ARG 875 HH11 ARG 875 -20.714 -6.964 -11.738 192 HH12 ARG 875 HH12 ARG 875 -22.075 -5.991 -12.313 193 HH21 ARG 875 HH21 ARG 875 -23.218 -5.023 -9.320 194 HH22 ARG 875 HH22 ARG 875 -23.364 -5.037 -11.082 195 H ARG 876 HN ARG 876 -20.426 -4.027 -11.622 196 HA ARG 876 HA ARG 876 -19.539 -1.284 -12.223 197 HB2 ARG 876 HB1 ARG 876 -21.152 -3.003 -13.554 198 HB3 ARG 876 HB2 ARG 876 -22.384 -2.132 -12.646 199 HG2 ARG 876 HG1 ARG 876 -20.220 -0.856 -14.387 200 HG3 ARG 876 HG2 ARG 876 -21.849 -1.232 -14.953 201 HD2 ARG 876 HD1 ARG 876 -22.823 0.383 -13.404 202 HD3 ARG 876 HD2 ARG 876 -21.261 0.617 -12.627 203 HE ARG 876 HE ARG 876 -20.487 1.930 -14.351 204 HH11 ARG 876 HH11 ARG 876 -23.573 0.624 -15.460 205 HH12 ARG 876 HH12 ARG 876 -23.672 1.828 -16.733 206 HH21 ARG 876 HH21 ARG 876 -20.836 3.494 -15.895 207 HH22 ARG 876 HH22 ARG 876 -22.238 3.313 -16.955 208 H ILE 877 HN ILE 877 -19.779 0.367 -10.973 209 HA ILE 877 HA ILE 877 -21.594 0.328 -8.601 210 HB ILE 877 HB ILE 877 -19.793 1.421 -7.331 211 HG12 ILE 877 HG11 ILE 877 -17.980 0.861 -9.718 212 HG13 ILE 877 HG12 ILE 877 -18.572 2.450 -9.267 213 HG21 ILE 877 HG21 ILE 877 -18.824 -1.212 -8.492 214 HG22 ILE 877 HG22 ILE 877 -18.524 -0.573 -6.859 215 HG23 ILE 877 HG23 ILE 877 -20.151 -1.070 -7.321 216 HD11 ILE 877 HD1 ILE 877 -17.361 2.468 -7.215 217 HD12 ILE 877 HD2 ILE 877 -16.842 0.787 -7.418 218 HD13 ILE 877 HD3 ILE 877 -16.259 2.037 -8.529 219 HA PRO 878 HA PRO 878 -22.403 4.622 -9.818 220 HB2 PRO 878 HB1 PRO 878 -23.104 5.782 -7.455 221 HB3 PRO 878 HB2 PRO 878 -24.175 4.629 -8.310 222 HG2 PRO 878 HG1 PRO 878 -22.262 4.047 -6.027 223 HG3 PRO 878 HG2 PRO 878 -23.984 3.573 -6.167 224 HD2 PRO 878 HD1 PRO 878 -21.951 1.874 -6.821 225 HD3 PRO 878 HD2 PRO 878 -23.487 1.883 -7.736 226 H ALA 879 HN ALA 879 -21.180 6.513 -9.904 227 HA ALA 879 HA ALA 879 -18.501 6.588 -9.180 228 HB1 ALA 879 HB1 ALA 879 -18.688 9.012 -9.635 229 HB2 ALA 879 HB2 ALA 879 -19.593 8.042 -10.814 230 HB3 ALA 879 HB3 ALA 879 -20.458 8.900 -9.516 231 H SER 880 HN SER 880 -21.168 7.240 -7.007 232 HA SER 880 HA SER 880 -19.780 8.763 -4.989 233 HB2 SER 880 HB1 SER 880 -22.121 6.829 -4.728 234 HB3 SER 880 HB2 SER 880 -21.541 7.918 -3.458 235 HG SER 880 HG1 SER 880 -22.681 8.634 -5.974 236 H VAL 881 HN VAL 881 -19.652 5.356 -5.857 237 HA VAL 881 HA VAL 881 -18.111 4.672 -3.409 238 HB VAL 881 HB VAL 881 -19.037 2.977 -5.754 239 HG11 VAL 881 HG11 VAL 881 -17.633 2.050 -3.215 240 HG12 VAL 881 HG12 VAL 881 -18.296 1.010 -4.492 241 HG13 VAL 881 HG13 VAL 881 -16.911 2.044 -4.842 242 HG21 VAL 881 HG21 VAL 881 -20.505 1.891 -4.107 243 HG22 VAL 881 HG22 VAL 881 -19.912 2.983 -2.837 244 HG23 VAL 881 HG23 VAL 881 -20.855 3.619 -4.196 245 H VAL 882 HN VAL 882 -17.670 5.134 -6.916 246 HA VAL 882 HA VAL 882 -14.925 4.329 -6.769 247 HB VAL 882 HB VAL 882 -16.538 4.667 -8.863 248 HG11 VAL 882 HG11 VAL 882 -15.931 6.469 -10.313 249 HG12 VAL 882 HG12 VAL 882 -16.408 7.210 -8.777 250 HG13 VAL 882 HG13 VAL 882 -14.693 7.065 -9.196 251 HG21 VAL 882 HG21 VAL 882 -14.405 3.417 -8.839 252 HG22 VAL 882 HG22 VAL 882 -14.565 4.387 -10.308 253 HG23 VAL 882 HG23 VAL 882 -13.505 4.937 -8.995 254 H GLY 883 HN GLY 883 -16.437 7.281 -5.920 255 HA2 GLY 883 HA1 GLY 883 -13.968 8.882 -5.732 256 HA3 GLY 883 HA2 GLY 883 -15.582 9.329 -5.177 257 H SER 884 HN SER 884 -15.642 6.605 -3.686 258 HA SER 884 HA SER 884 -14.377 7.523 -1.171 259 HB2 SER 884 HB1 SER 884 -16.706 6.693 -1.166 260 HB3 SER 884 HB2 SER 884 -16.152 5.133 -1.793 261 HG SER 884 HG1 SER 884 -15.600 6.315 0.737 262 H ILE 885 HN ILE 885 -14.214 4.786 -3.445 263 HA ILE 885 HA ILE 885 -12.070 3.361 -2.142 264 HB ILE 885 HB ILE 885 -13.524 3.223 -4.769 265 HG12 ILE 885 HG11 ILE 885 -14.035 0.968 -4.124 266 HG13 ILE 885 HG12 ILE 885 -12.884 0.978 -2.793 267 HG21 ILE 885 HG21 ILE 885 -10.984 1.642 -4.237 268 HG22 ILE 885 HG22 ILE 885 -12.172 1.318 -5.521 269 HG23 ILE 885 HG23 ILE 885 -11.261 2.827 -5.543 270 HD11 ILE 885 HD1 ILE 885 -15.379 2.715 -2.911 271 HD12 ILE 885 HD2 ILE 885 -15.281 1.166 -2.074 272 HD13 ILE 885 HD3 ILE 885 -14.286 2.514 -1.518 273 H ASP 886 HN ASP 886 -9.945 3.561 -2.278 274 HA ASP 886 HA ASP 886 -8.641 5.453 -4.173 275 HB2 ASP 886 HB1 ASP 886 -9.436 6.407 -1.827 276 HB3 ASP 886 HB2 ASP 886 -8.096 5.491 -1.190 277 H GLU 887 HN GLU 887 -6.157 5.477 -3.581 278 HA GLU 887 HA GLU 887 -5.005 2.860 -3.880 279 HB2 GLU 887 HB1 GLU 887 -3.740 5.467 -2.924 280 HB3 GLU 887 HB2 GLU 887 -2.863 4.009 -3.408 281 HG2 GLU 887 HG1 GLU 887 -4.065 4.192 -5.664 282 HG3 GLU 887 HG2 GLU 887 -4.539 5.819 -5.178 283 H SER 888 HN SER 888 -6.099 4.517 -1.002 284 HA SER 888 HA SER 888 -4.541 2.811 0.850 285 HB2 SER 888 HB1 SER 888 -5.740 4.045 2.593 286 HB3 SER 888 HB2 SER 888 -4.944 5.138 1.449 287 HG SER 888 HG1 SER 888 -7.103 5.784 1.926 288 H SER 889 HN SER 889 -7.480 2.536 -0.920 289 HA SER 889 HA SER 889 -8.963 0.953 1.038 290 HB2 SER 889 HB1 SER 889 -9.504 1.437 -1.917 291 HB3 SER 889 HB2 SER 889 -10.639 0.758 -0.742 292 HG SER 889 HG1 SER 889 -10.583 2.736 0.388 293 H ARG 890 HN ARG 890 -9.840 -1.135 0.541 294 HA ARG 890 HA ARG 890 -8.466 -2.845 -1.441 295 HB2 ARG 890 HB1 ARG 890 -8.322 -4.727 0.187 296 HB3 ARG 890 HB2 ARG 890 -7.176 -3.414 0.427 297 HG2 ARG 890 HG1 ARG 890 -8.494 -2.546 2.323 298 HG3 ARG 890 HG2 ARG 890 -9.700 -3.827 2.092 299 HD2 ARG 890 HD1 ARG 890 -7.966 -5.539 2.503 300 HD3 ARG 890 HD2 ARG 890 -6.759 -4.256 2.738 301 HE ARG 890 HE ARG 890 -8.936 -3.768 4.504 302 HH11 ARG 890 HH11 ARG 890 -6.356 -6.117 4.184 303 HH12 ARG 890 HH12 ARG 890 -6.327 -6.454 5.895 304 HH21 ARG 890 HH21 ARG 890 -8.845 -4.245 6.674 305 HH22 ARG 890 HH22 ARG 890 -7.704 -5.417 7.260 306 H TRP 891 HN TRP 891 -10.343 -2.424 -2.642 307 HA TRP 891 HA TRP 891 -12.994 -3.149 -1.585 308 HB2 TRP 891 HB1 TRP 891 -12.634 -1.273 -3.198 309 HB3 TRP 891 HB2 TRP 891 -12.233 -2.475 -4.434 310 HD1 TRP 891 HD1 TRP 891 -14.984 -0.727 -2.754 311 HE1 TRP 891 HE1 TRP 891 -17.283 -1.407 -3.629 312 HE3 TRP 891 HE3 TRP 891 -13.604 -4.905 -5.363 313 HZ2 TRP 891 HZ2 TRP 891 -18.434 -3.745 -4.894 314 HZ3 TRP 891 HZ3 TRP 891 -15.365 -6.424 -6.279 315 HH2 TRP 891 HH2 TRP 891 -17.744 -5.880 -5.976 316 H ILE 892 HN ILE 892 -13.900 -5.167 -1.747 317 HA ILE 892 HA ILE 892 -12.833 -7.136 -3.699 318 HB ILE 892 HB ILE 892 -12.624 -8.853 -2.009 319 HG12 ILE 892 HG11 ILE 892 -13.066 -6.776 0.161 320 HG13 ILE 892 HG12 ILE 892 -14.347 -7.839 -0.427 321 HG21 ILE 892 HG21 ILE 892 -10.625 -7.494 -2.549 322 HG22 ILE 892 HG22 ILE 892 -10.973 -6.436 -1.166 323 HG23 ILE 892 HG23 ILE 892 -10.574 -8.127 -0.900 324 HD11 ILE 892 HD1 ILE 892 -13.360 -8.743 1.595 325 HD12 ILE 892 HD2 ILE 892 -13.211 -9.825 0.189 326 HD13 ILE 892 HD3 ILE 892 -11.795 -8.908 0.789 327 H CYS 893 HN CYS 893 -14.156 -9.073 -3.948 328 HA CYS 893 HA CYS 893 -16.853 -8.685 -4.288 329 HB2 CYS 893 HB1 CYS 893 -15.502 -11.334 -3.630 330 HB3 CYS 893 HB2 CYS 893 -17.046 -11.070 -4.463 331 H MET 894 HN MET 894 -15.338 -9.964 -1.212 332 HA MET 894 HA MET 894 -17.862 -10.730 -0.075 333 HB2 MET 894 HB1 MET 894 -15.628 -11.560 0.653 334 HB3 MET 894 HB2 MET 894 -15.286 -9.971 1.333 335 HG2 MET 894 HG1 MET 894 -15.926 -11.494 3.085 336 HG3 MET 894 HG2 MET 894 -17.090 -10.193 2.946 337 HE1 MET 894 HE1 MET 894 -17.825 -14.628 1.773 338 HE2 MET 894 HE2 MET 894 -16.775 -13.597 0.782 339 HE3 MET 894 HE3 MET 894 -16.321 -13.980 2.462 340 H ASN 895 HN ASN 895 -16.353 -7.617 -0.386 341 HA ASN 895 HA ASN 895 -18.039 -6.267 1.623 342 HB2 ASN 895 HB1 ASN 895 -16.263 -4.938 1.717 343 HB3 ASN 895 HB2 ASN 895 -15.473 -5.820 0.427 344 HD21 ASN 895 HD21 ASN 895 -16.240 -5.162 -1.891 345 HD22 ASN 895 HD22 ASN 895 -16.398 -3.422 -2.108 346 H ASN 896 HN ASN 896 -18.374 -7.195 -1.637 347 HA ASN 896 HA ASN 896 -19.518 -4.987 -2.893 348 HB2 ASN 896 HB1 ASN 896 -18.800 -7.119 -3.992 349 HB3 ASN 896 HB2 ASN 896 -20.227 -7.910 -3.307 350 HD21 ASN 896 HD21 ASN 896 -20.361 -8.422 -5.709 351 HD22 ASN 896 HD22 ASN 896 -21.501 -7.353 -6.513 352 H SER 897 HN SER 897 -21.368 -4.003 -2.933 353 HA SER 897 HA SER 897 -23.538 -4.240 -1.104 354 HB2 SER 897 HB1 SER 897 -23.285 -3.047 -3.896 355 HB3 SER 897 HB2 SER 897 -24.733 -2.893 -2.906 356 HG SER 897 HG1 SER 897 -23.307 -1.097 -2.627 357 H ASP 898 HN ASP 898 -23.148 -5.508 -4.379 358 HA ASP 898 HA ASP 898 -25.893 -6.546 -4.483 359 HB2 ASP 898 HB1 ASP 898 -23.716 -7.029 -6.513 360 HB3 ASP 898 HB2 ASP 898 -25.451 -7.151 -6.742 361 H LYS 899 HN LYS 899 -26.227 -8.187 -3.185 362 HA LYS 899 HA LYS 899 -24.498 -10.273 -2.425 363 HB2 LYS 899 HB1 LYS 899 -27.547 -10.253 -2.508 364 HB3 LYS 899 HB2 LYS 899 -26.554 -11.394 -1.604 365 HG2 LYS 899 HG1 LYS 899 -26.237 -8.421 -1.103 366 HG3 LYS 899 HG2 LYS 899 -27.583 -9.297 -0.387 367 HD2 LYS 899 HD1 LYS 899 -24.744 -10.301 -0.114 368 HD3 LYS 899 HD2 LYS 899 -25.441 -9.101 1.006 369 HE2 LYS 899 HE1 LYS 899 -27.286 -10.664 1.536 370 HE3 LYS 899 HE2 LYS 899 -26.616 -11.855 0.421 371 HZ1 LYS 899 HZ1 LYS 899 -24.623 -11.958 1.835 372 HZ2 LYS 899 HZ2 LYS 899 -25.246 -10.851 2.864 373 HZ3 LYS 899 HZ3 LYS 899 -25.949 -12.314 2.715 374 H ARG 900 HN ARG 900 -26.163 -9.986 -5.376 375 HA ARG 900 HA ARG 900 -26.196 -12.762 -6.288 376 HB2 ARG 900 HB1 ARG 900 -26.190 -10.052 -7.704 377 HB3 ARG 900 HB2 ARG 900 -26.324 -11.579 -8.555 378 HG2 ARG 900 HG1 ARG 900 -28.316 -10.536 -6.486 379 HG3 ARG 900 HG2 ARG 900 -28.500 -10.449 -8.241 380 HD2 ARG 900 HD1 ARG 900 -28.436 -12.939 -8.360 381 HD3 ARG 900 HD2 ARG 900 -28.355 -13.002 -6.586 382 HE ARG 900 HE ARG 900 -30.592 -11.412 -7.279 383 HH11 ARG 900 HH11 ARG 900 -29.681 -14.785 -7.560 384 HH12 ARG 900 HH12 ARG 900 -31.337 -15.329 -7.521 385 HH21 ARG 900 HH21 ARG 900 -32.679 -12.175 -7.238 386 HH22 ARG 900 HH22 ARG 900 -32.984 -13.883 -7.344 387 H PHE 901 HN PHE 901 -23.743 -10.317 -6.076 388 HA PHE 901 HA PHE 901 -21.781 -12.106 -7.405 389 HB2 PHE 901 HB1 PHE 901 -21.833 -9.110 -7.794 390 HB3 PHE 901 HB2 PHE 901 -20.890 -10.294 -8.689 391 HD1 PHE 901 HD1 PHE 901 -24.029 -8.460 -8.457 392 HD2 PHE 901 HD2 PHE 901 -22.033 -11.717 -10.435 393 HE1 PHE 901 HE1 PHE 901 -25.752 -8.432 -10.241 394 HE2 PHE 901 HE2 PHE 901 -23.756 -11.697 -12.220 395 HZ PHE 901 HZ PHE 901 -25.628 -10.060 -12.118 396 H ALA 902 HN ALA 902 -22.302 -11.415 -4.506 397 HA ALA 902 HA ALA 902 -19.913 -9.922 -3.742 398 HB1 ALA 902 HB1 ALA 902 -21.028 -9.715 -1.556 399 HB2 ALA 902 HB2 ALA 902 -22.139 -9.249 -2.845 400 HB3 ALA 902 HB3 ALA 902 -22.292 -10.849 -2.074 401 H ASP 903 HN ASP 903 -19.344 -12.478 -4.736 402 HA ASP 903 HA ASP 903 -17.586 -13.346 -2.561 403 HB2 ASP 903 HB1 ASP 903 -19.322 -15.343 -4.002 404 HB3 ASP 903 HB2 ASP 903 -18.008 -15.721 -2.901 405 H CYS 904 HN CYS 904 -15.612 -14.098 -3.305 406 HA CYS 904 HA CYS 904 -14.771 -13.655 -5.944 407 HB2 CYS 904 HB1 CYS 904 -13.669 -15.501 -3.785 408 HB3 CYS 904 HB2 CYS 904 -12.801 -14.975 -5.228 409 H SER 905 HN SER 905 -16.722 -16.218 -4.755 410 HA SER 905 HA SER 905 -16.127 -18.151 -6.918 411 HB2 SER 905 HB1 SER 905 -18.169 -18.275 -4.674 412 HB3 SER 905 HB2 SER 905 -17.718 -19.592 -5.771 413 HG SER 905 HG1 SER 905 -15.651 -19.607 -4.868 414 H LYS 906 HN LYS 906 -18.418 -15.572 -6.306 415 HA LYS 906 HA LYS 906 -20.625 -16.591 -7.897 416 HB2 LYS 906 HB1 LYS 906 -19.810 -13.926 -6.727 417 HB3 LYS 906 HB2 LYS 906 -21.127 -13.989 -7.876 418 HG2 LYS 906 HG1 LYS 906 -21.087 -15.316 -5.163 419 HG3 LYS 906 HG2 LYS 906 -21.988 -13.900 -5.689 420 HD2 LYS 906 HD1 LYS 906 -23.666 -15.404 -5.839 421 HD3 LYS 906 HD2 LYS 906 -23.010 -15.650 -7.460 422 HE2 LYS 906 HE1 LYS 906 -21.675 -17.601 -6.557 423 HE3 LYS 906 HE2 LYS 906 -22.364 -17.299 -4.962 424 HZ1 LYS 906 HZ1 LYS 906 -23.942 -18.041 -7.372 425 HZ2 LYS 906 HZ2 LYS 906 -23.581 -19.040 -6.135 426 HZ3 LYS 906 HZ3 LYS 906 -24.567 -17.767 -5.887 427 H SER 907 HN SER 907 -21.537 -14.980 -9.593 428 HA SER 907 HA SER 907 -19.836 -15.247 -11.966 429 HB2 SER 907 HB1 SER 907 -22.229 -15.952 -11.856 430 HB3 SER 907 HB2 SER 907 -22.690 -14.243 -11.732 431 HG SER 907 HG1 SER 907 -22.725 -15.144 -13.902 432 H GLN 908 HN GLN 908 -20.741 -13.172 -13.538 433 HA GLN 908 HA GLN 908 -20.091 -10.555 -12.361 434 HB2 GLN 908 HB1 GLN 908 -17.902 -11.650 -12.978 435 HB3 GLN 908 HB2 GLN 908 -18.454 -11.724 -14.658 436 HG2 GLN 908 HG1 GLN 908 -18.464 -9.307 -14.826 437 HG3 GLN 908 HG2 GLN 908 -18.181 -9.125 -13.111 438 HE21 GLN 908 HE21 GLN 908 -16.637 -9.314 -16.137 439 HE22 GLN 908 HE22 GLN 908 -15.010 -9.710 -15.596 440 H GLU 909 HN GLU 909 -20.944 -8.784 -13.727 441 HA GLU 909 HA GLU 909 -23.237 -9.643 -15.276 442 HB2 GLU 909 HB1 GLU 909 -22.038 -6.931 -14.637 443 HB3 GLU 909 HB2 GLU 909 -23.421 -7.114 -15.724 444 HG2 GLU 909 HG1 GLU 909 -24.652 -8.368 -13.952 445 HG3 GLU 909 HG2 GLU 909 -23.327 -8.038 -12.832 446 H MET 910 HN MET 910 -19.990 -8.760 -16.235 447 HA MET 910 HA MET 910 -20.652 -9.573 -19.023 448 HB2 MET 910 HB1 MET 910 -19.059 -7.073 -18.321 449 HB3 MET 910 HB2 MET 910 -19.214 -7.773 -19.933 450 HG2 MET 910 HG1 MET 910 -21.647 -7.292 -19.891 451 HG3 MET 910 HG2 MET 910 -21.462 -6.563 -18.287 452 HE1 MET 910 HE1 MET 910 -22.886 -5.008 -20.590 453 HE2 MET 910 HE2 MET 910 -22.575 -4.318 -18.980 454 HE3 MET 910 HE3 MET 910 -22.144 -3.401 -20.440 455 H SER 911 HN SER 911 -18.910 -10.853 -19.897 456 HA SER 911 HA SER 911 -16.729 -11.582 -18.067 457 HB2 SER 911 HB1 SER 911 -16.661 -12.072 -21.029 458 HB3 SER 911 HB2 SER 911 -15.863 -12.969 -19.749 459 HG SER 911 HG1 SER 911 -17.715 -14.087 -20.529 460 H ASN 912 HN ASN 912 -14.427 -11.286 -18.611 461 HA ASN 912 HA ASN 912 -13.947 -8.488 -18.592 462 HB2 ASN 912 HB1 ASN 912 -11.879 -10.688 -18.997 463 HB3 ASN 912 HB2 ASN 912 -11.549 -9.007 -18.556 464 HD21 ASN 912 HD21 ASN 912 -10.367 -10.310 -16.815 465 HD22 ASN 912 HD22 ASN 912 -11.319 -10.597 -15.364 466 H GLU 913 HN GLU 913 -13.708 -10.770 -21.243 467 HA GLU 913 HA GLU 913 -12.552 -8.970 -23.209 468 HB2 GLU 913 HB1 GLU 913 -12.932 -10.772 -24.749 469 HB3 GLU 913 HB2 GLU 913 -12.351 -11.460 -23.232 470 HG2 GLU 913 HG1 GLU 913 -14.762 -11.961 -22.618 471 HG3 GLU 913 HG2 GLU 913 -15.224 -11.474 -24.248 472 H GLU 914 HN GLU 914 -15.680 -9.062 -21.898 473 HA GLU 914 HA GLU 914 -17.024 -7.949 -24.326 474 HB2 GLU 914 HB1 GLU 914 -18.206 -8.826 -21.670 475 HB3 GLU 914 HB2 GLU 914 -19.097 -8.273 -23.086 476 HG2 GLU 914 HG1 GLU 914 -18.238 -10.233 -24.365 477 HG3 GLU 914 HG2 GLU 914 -17.437 -10.823 -22.906 478 H ILE 915 HN ILE 915 -16.337 -7.265 -20.850 479 HA ILE 915 HA ILE 915 -17.425 -4.588 -21.032 480 HB ILE 915 HB ILE 915 -17.540 -5.547 -18.934 481 HG12 ILE 915 HG11 ILE 915 -16.605 -3.977 -17.484 482 HG13 ILE 915 HG12 ILE 915 -15.260 -3.590 -18.578 483 HG21 ILE 915 HG21 ILE 915 -15.647 -6.143 -17.441 484 HG22 ILE 915 HG22 ILE 915 -15.789 -7.201 -18.821 485 HG23 ILE 915 HG23 ILE 915 -14.522 -5.953 -18.811 486 HD11 ILE 915 HD1 ILE 915 -16.840 -2.488 -20.075 487 HD12 ILE 915 HD2 ILE 915 -18.213 -2.992 -19.073 488 HD13 ILE 915 HD3 ILE 915 -16.976 -1.842 -18.479 489 H ASN 916 HN ASN 916 -14.035 -5.733 -21.006 490 HA ASN 916 HA ASN 916 -12.878 -3.219 -21.303 491 HB2 ASN 916 HB1 ASN 916 -10.863 -4.308 -22.018 492 HB3 ASN 916 HB2 ASN 916 -11.637 -5.370 -20.851 493 HD21 ASN 916 HD21 ASN 916 -9.689 -6.427 -22.433 494 HD22 ASN 916 HD22 ASN 916 -10.371 -7.424 -23.710 495 H GLU 917 HN GLU 917 -14.391 -5.064 -23.857 496 HA GLU 917 HA GLU 917 -13.739 -3.397 -26.095 497 HB2 GLU 917 HB1 GLU 917 -15.717 -5.520 -25.423 498 HB3 GLU 917 HB2 GLU 917 -16.113 -4.451 -26.775 499 HG2 GLU 917 HG1 GLU 917 -13.864 -4.956 -27.769 500 HG3 GLU 917 HG2 GLU 917 -13.566 -6.100 -26.458 501 H GLU 918 HN GLU 918 -16.351 -3.121 -23.674 502 HA GLU 918 HA GLU 918 -17.806 -0.997 -25.010 503 HB2 GLU 918 HB1 GLU 918 -18.705 -2.461 -23.117 504 HB3 GLU 918 HB2 GLU 918 -17.673 -1.562 -22.007 505 HG2 GLU 918 HG1 GLU 918 -19.962 -0.740 -21.930 506 HG3 GLU 918 HG2 GLU 918 -18.838 0.504 -22.431 507 H LEU 919 HN LEU 919 -15.151 -1.062 -22.660 508 HA LEU 919 HA LEU 919 -14.943 1.863 -22.432 509 HB2 LEU 919 HB1 LEU 919 -13.262 -0.485 -21.520 510 HB3 LEU 919 HB2 LEU 919 -12.812 1.179 -21.186 511 HG LEU 919 HG LEU 919 -15.607 0.511 -20.393 512 HD11 LEU 919 HD11 LEU 919 -13.251 -0.803 -19.003 513 HD12 LEU 919 HD12 LEU 919 -14.938 -0.752 -18.407 514 HD13 LEU 919 HD13 LEU 919 -14.539 -1.627 -19.899 515 HD21 LEU 919 HD21 LEU 919 -14.565 2.611 -19.781 516 HD22 LEU 919 HD22 LEU 919 -14.863 1.627 -18.315 517 HD23 LEU 919 HD23 LEU 919 -13.222 1.765 -19.000 518 H GLY 920 HN GLY 920 -13.302 -0.722 -24.206 519 HA2 GLY 920 HA1 GLY 920 -12.161 -0.605 -26.247 520 HA3 GLY 920 HA2 GLY 920 -12.146 1.161 -26.172 521 H ILE 921 HN ILE 921 -10.948 -1.423 -23.973 522 HA ILE 921 HA ILE 921 -8.273 -0.086 -23.838 523 HB ILE 921 HB ILE 921 -8.327 -0.263 -21.417 524 HG12 ILE 921 HG11 ILE 921 -11.197 -1.242 -21.725 525 HG13 ILE 921 HG12 ILE 921 -9.820 -2.225 -21.229 526 HG21 ILE 921 HG21 ILE 921 -10.767 1.259 -22.397 527 HG22 ILE 921 HG22 ILE 921 -9.793 1.594 -20.952 528 HG23 ILE 921 HG23 ILE 921 -9.090 1.812 -22.557 529 HD11 ILE 921 HD1 ILE 921 -11.028 0.069 -19.668 530 HD12 ILE 921 HD2 ILE 921 -10.972 -1.663 -19.266 531 HD13 ILE 921 HD3 ILE 921 -9.473 -0.708 -19.274 532 H GLY 922 HN GLY 922 -6.670 -1.274 -22.590 533 HA2 GLY 922 HA1 GLY 922 -6.481 -4.062 -23.603 534 HA3 GLY 922 HA2 GLY 922 -5.146 -2.993 -23.193 535 H GLN 923 HN GLN 923 -8.006 -4.345 -21.457 536 HA GLN 923 HA GLN 923 -6.533 -4.811 -18.984 537 HB2 GLN 923 HB1 GLN 923 -9.289 -4.891 -19.828 538 HB3 GLN 923 HB2 GLN 923 -8.905 -6.467 -19.177 539 HG2 GLN 923 HG1 GLN 923 -9.761 -5.190 -17.409 540 HG3 GLN 923 HG2 GLN 923 -8.041 -5.373 -17.095 541 HE21 GLN 923 HE21 GLN 923 -9.887 -3.317 -16.024 542 HE22 GLN 923 HE22 GLN 923 -9.168 -1.791 -16.528 543 H ASP 924 HN ASP 924 -6.633 -7.083 -17.992 544 HA ASP 924 HA ASP 924 -4.742 -8.745 -19.235 545 HB2 ASP 924 HB1 ASP 924 -6.798 -9.695 -17.217 546 HB3 ASP 924 HB2 ASP 924 -5.199 -10.349 -17.486 547 H GLU 925 HN GLU 925 -8.204 -8.869 -19.472 548 HA GLU 925 HA GLU 925 -9.739 -9.933 -20.654 549 HB2 GLU 925 HB1 GLU 925 -8.250 -9.008 -22.438 550 HB3 GLU 925 HB2 GLU 925 -7.549 -10.614 -22.642 551 HG2 GLU 925 HG1 GLU 925 -9.738 -11.548 -23.212 552 HG3 GLU 925 HG2 GLU 925 -10.519 -10.019 -22.790 553 H ALA 926 HN ALA 926 -6.977 -12.082 -20.970 554 HA ALA 926 HA ALA 926 -8.079 -14.146 -19.348 555 HB1 ALA 926 HB1 ALA 926 -8.345 -15.946 -21.066 556 HB2 ALA 926 HB2 ALA 926 -9.502 -14.635 -21.339 557 HB3 ALA 926 HB3 ALA 926 -8.045 -14.756 -22.352 558 H ASP 927 HN ASP 927 -5.796 -13.717 -22.095 559 HA ASP 927 HA ASP 927 -3.913 -15.590 -20.890 560 HB2 ASP 927 HB1 ASP 927 -2.580 -15.336 -22.844 561 HB3 ASP 927 HB2 ASP 927 -4.256 -15.578 -23.293 562 H ALA 928 HN ALA 928 -4.551 -12.613 -19.980 563 HA ALA 928 HA ALA 928 -3.506 -10.899 -18.897 564 HB1 ALA 928 HB1 ALA 928 -2.065 -13.281 -17.683 565 HB2 ALA 928 HB2 ALA 928 -2.299 -11.690 -16.925 566 HB3 ALA 928 HB3 ALA 928 -3.701 -12.717 -17.273 567 H1 ALA 1 HT1 ALA 1 -8.004 -1.309 -6.136 568 H2 ALA 1 HT2 ALA 1 -6.389 -1.002 -6.053 569 H3 ALA 1 HT3 ALA 1 -7.006 -2.371 -5.383 570 HA ALA 1 HA ALA 1 -5.864 -2.837 -7.442 571 HB1 ALA 1 HB1 ALA 1 -7.619 -4.366 -6.741 572 HB2 ALA 1 HB2 ALA 1 -8.846 -3.342 -7.512 573 HB3 ALA 1 HB3 ALA 1 -7.605 -4.182 -8.490 574 H ARG 2 HN ARG 2 -5.705 -2.617 -9.700 575 HA ARG 2 HA ARG 2 -6.122 -0.154 -11.029 576 HB2 ARG 2 HB1 ARG 2 -4.476 -1.728 -11.794 577 HB3 ARG 2 HB2 ARG 2 -5.648 -3.045 -11.836 578 HG2 ARG 2 HG1 ARG 2 -5.033 -2.500 -14.057 579 HG3 ARG 2 HG2 ARG 2 -6.731 -2.166 -13.795 580 HD2 ARG 2 HD1 ARG 2 -5.383 0.282 -13.220 581 HD3 ARG 2 HD2 ARG 2 -4.536 -0.368 -14.609 582 HE ARG 2 HE ARG 2 -7.296 0.643 -14.506 583 HH11 ARG 2 HH11 ARG 2 -5.271 -1.518 -16.404 584 HH12 ARG 2 HH12 ARG 2 -6.448 -1.529 -17.696 585 HH21 ARG 2 HH21 ARG 2 -8.378 0.946 -16.311 586 HH22 ARG 2 HH22 ARG 2 -7.974 0.059 -17.769 587 H THR 3 HN THR 3 -7.885 0.749 -12.043 588 HA THR 3 HA THR 3 -9.858 -0.969 -13.306 589 HB THR 3 HB THR 3 -10.647 -0.840 -10.909 590 HG1 THR 3 HG1 THR 3 -12.343 -1.243 -12.067 591 HG21 THR 3 HG21 THR 3 -10.060 1.513 -10.361 592 HG22 THR 3 HG22 THR 3 -11.319 2.079 -11.490 593 HG23 THR 3 HG23 THR 3 -11.766 1.134 -10.071 594 H MLZ 4 HN MLZ 4 -11.893 1.119 -13.513 595 HA MLZ 4 HA MLZ 4 -10.793 3.101 -15.413 596 HB2 MLZ 4 HB1 MLZ 4 -11.855 1.894 -17.333 597 HB3 MLZ 4 HB2 MLZ 4 -10.630 0.909 -16.608 598 HG2 MLZ 4 HG1 MLZ 4 -13.186 0.385 -15.256 599 HG3 MLZ 4 HG2 MLZ 4 -13.409 0.278 -16.979 600 HD2 MLZ 4 HD1 MLZ 4 -11.719 -1.421 -17.184 601 HD3 MLZ 4 HD2 MLZ 4 -11.107 -1.069 -15.567 602 HE2 MLZ 4 HE1 MLZ 4 -12.248 -3.167 -15.509 603 HE3 MLZ 4 HE2 MLZ 4 -13.071 -1.981 -14.507 604 HZ MLZ 4 HZ1 MLZ 4 -13.958 -2.724 -17.272 605 HCM1 MLZ 4 HC1 MLZ 4 -15.700 -3.955 -15.878 606 HCM2 MLZ 4 HC2 MLZ 4 -14.064 -4.639 -15.871 607 HCM3 MLZ 4 HC3 MLZ 4 -14.633 -3.633 -14.531 608 HZ2 MLZ 4 HZ2 MLZ 4 -14.795 -1.777 -16.219 609 H GLN 5 HN GLN 5 -13.067 3.492 -16.924 610 HA GLN 5 HA GLN 5 -15.479 3.358 -15.370 611 HB2 GLN 5 HB1 GLN 5 -16.051 5.594 -15.242 612 HB3 GLN 5 HB2 GLN 5 -14.532 5.357 -14.384 613 HG2 GLN 5 HG1 GLN 5 -14.985 6.836 -17.005 614 HG3 GLN 5 HG2 GLN 5 -14.490 7.507 -15.472 615 HE21 GLN 5 HE21 GLN 5 -13.395 5.831 -18.355 616 HE22 GLN 5 HE22 GLN 5 -11.673 6.019 -18.003 617 H THR 6 HN THR 6 -17.063 2.858 -16.653 618 HA THR 6 HA THR 6 -16.913 2.867 -19.510 619 HB THR 6 HB THR 6 -19.517 2.356 -19.038 620 HG1 THR 6 HG1 THR 6 -19.743 1.408 -17.054 621 HG21 THR 6 HG21 THR 6 -17.235 0.461 -18.436 622 HG22 THR 6 HG22 THR 6 -18.922 0.004 -18.842 623 HG23 THR 6 HG23 THR 6 -17.914 0.809 -20.042 624 H ALA 7 HN ALA 7 -18.615 4.944 -17.205 625 HA ALA 7 HA ALA 7 -19.941 6.750 -17.360 626 HB1 ALA 7 HB1 ALA 7 -19.413 8.487 -18.958 627 HB2 ALA 7 HB2 ALA 7 -17.918 7.735 -18.372 628 HB3 ALA 7 HB3 ALA 7 -18.541 7.339 -19.991 629 H ARG 8 HN ARG 8 -20.625 4.168 -19.041 630 HA ARG 8 HA ARG 8 -22.873 5.076 -20.699 631 HB2 ARG 8 HB1 ARG 8 -21.354 3.190 -21.391 632 HB3 ARG 8 HB2 ARG 8 -21.876 2.269 -19.990 633 HG2 ARG 8 HG1 ARG 8 -23.055 1.481 -21.930 634 HG3 ARG 8 HG2 ARG 8 -24.224 2.286 -20.879 635 HD2 ARG 8 HD1 ARG 8 -24.134 4.304 -22.315 636 HD3 ARG 8 HD2 ARG 8 -22.898 3.530 -23.329 637 HE ARG 8 HE ARG 8 -25.170 1.823 -23.225 638 HH11 ARG 8 HH11 ARG 8 -24.337 4.930 -24.617 639 HH12 ARG 8 HH12 ARG 8 -25.503 4.770 -25.902 640 HH21 ARG 8 HH21 ARG 8 -26.636 1.683 -24.893 641 HH22 ARG 8 HH22 ARG 8 -26.764 2.976 -26.049 642 H TYR 9 HN TYR 9 -24.016 6.126 -19.106 643 HA TYR 9 HA TYR 9 -25.775 4.436 -17.417 644 HB2 TYR 9 HB1 TYR 9 -23.797 5.103 -16.046 645 HB3 TYR 9 HB2 TYR 9 -24.197 6.790 -16.317 646 HD1 TYR 9 HD1 TYR 9 -25.550 3.577 -14.932 647 HD2 TYR 9 HD2 TYR 9 -25.733 7.886 -14.850 648 HE1 TYR 9 HE1 TYR 9 -27.048 3.479 -12.937 649 HE2 TYR 9 HE2 TYR 9 -27.215 7.788 -12.854 650 HH TYR 9 HH TYR 9 -28.315 6.441 -11.363 Start of MODEL 17 1 H1 GLY 850 HT1 GLY 850 0.205 -13.229 -0.109 2 H2 GLY 850 HT2 GLY 850 -1.291 -12.799 0.395 3 H3 GLY 850 HT3 GLY 850 -0.021 -12.702 1.426 4 HA2 GLY 850 HA1 GLY 850 -0.620 -10.504 0.654 5 HA3 GLY 850 HA2 GLY 850 1.006 -10.968 0.124 6 H SER 851 HN SER 851 -0.372 -8.967 -1.177 7 HA SER 851 HA SER 851 -0.975 -10.145 -3.862 8 HB2 SER 851 HB1 SER 851 -2.503 -7.890 -2.506 9 HB3 SER 851 HB2 SER 851 -2.703 -8.423 -4.182 10 HG SER 851 HG1 SER 851 -3.253 -9.887 -1.808 11 H ARG 852 HN ARG 852 -0.422 -8.938 -5.629 12 HA ARG 852 HA ARG 852 1.126 -6.404 -5.372 13 HB2 ARG 852 HB1 ARG 852 1.871 -8.913 -6.959 14 HB3 ARG 852 HB2 ARG 852 2.726 -7.373 -7.042 15 HG2 ARG 852 HG1 ARG 852 2.522 -9.146 -4.562 16 HG3 ARG 852 HG2 ARG 852 3.914 -8.982 -5.636 17 HD2 ARG 852 HD1 ARG 852 4.007 -6.564 -5.138 18 HD3 ARG 852 HD2 ARG 852 2.705 -6.711 -3.988 19 HE ARG 852 HE ARG 852 5.466 -7.735 -3.660 20 HH11 ARG 852 HH11 ARG 852 2.264 -7.486 -2.211 21 HH12 ARG 852 HH12 ARG 852 2.888 -7.814 -0.611 22 HH21 ARG 852 HH21 ARG 852 6.152 -8.196 -1.606 23 HH22 ARG 852 HH22 ARG 852 5.016 -8.247 -0.292 24 H ARG 853 HN ARG 853 -1.367 -6.102 -5.885 25 HA ARG 853 HA ARG 853 -2.260 -6.426 -8.619 26 HB2 ARG 853 HB1 ARG 853 -3.312 -4.388 -6.614 27 HB3 ARG 853 HB2 ARG 853 -4.162 -5.079 -7.989 28 HG2 ARG 853 HG1 ARG 853 -3.453 -6.438 -5.366 29 HG3 ARG 853 HG2 ARG 853 -5.050 -6.029 -5.985 30 HD2 ARG 853 HD1 ARG 853 -4.745 -7.679 -7.830 31 HD3 ARG 853 HD2 ARG 853 -3.169 -8.126 -7.143 32 HE ARG 853 HE ARG 853 -5.291 -8.293 -5.167 33 HH11 ARG 853 HH11 ARG 853 -3.928 -10.203 -7.795 34 HH12 ARG 853 HH12 ARG 853 -4.501 -11.684 -7.079 35 HH21 ARG 853 HH21 ARG 853 -5.898 -10.099 -4.352 36 HH22 ARG 853 HH22 ARG 853 -5.660 -11.637 -5.156 37 H ALA 854 HN ALA 854 -2.709 -4.815 -10.191 38 HA ALA 854 HA ALA 854 -0.824 -2.606 -10.469 39 HB1 ALA 854 HB1 ALA 854 -2.211 -2.043 -12.440 40 HB2 ALA 854 HB2 ALA 854 -1.694 -3.741 -12.445 41 HB3 ALA 854 HB3 ALA 854 -3.362 -3.327 -11.994 42 H SER 855 HN SER 855 -1.516 -0.355 -10.652 43 HA SER 855 HA SER 855 -3.168 0.371 -8.293 44 HB2 SER 855 HB1 SER 855 -1.731 2.354 -8.196 45 HB3 SER 855 HB2 SER 855 -0.851 0.842 -8.093 46 HG SER 855 HG1 SER 855 -1.001 2.658 -10.282 47 H VAL 856 HN VAL 856 -3.807 2.753 -8.292 48 HA VAL 856 HA VAL 856 -4.794 3.847 -10.819 49 HB VAL 856 HB VAL 856 -6.571 2.239 -10.091 50 HG11 VAL 856 HG11 VAL 856 -8.064 2.804 -8.244 51 HG12 VAL 856 HG12 VAL 856 -6.428 2.534 -7.639 52 HG13 VAL 856 HG13 VAL 856 -7.057 4.191 -7.800 53 HG21 VAL 856 HG21 VAL 856 -8.414 3.653 -10.599 54 HG22 VAL 856 HG22 VAL 856 -7.575 5.104 -10.067 55 HG23 VAL 856 HG23 VAL 856 -7.036 4.236 -11.531 56 H GLY 857 HN GLY 857 -5.551 6.017 -10.660 57 HA2 GLY 857 HA1 GLY 857 -4.892 7.560 -8.182 58 HA3 GLY 857 HA2 GLY 857 -4.791 8.218 -9.818 59 H SER 858 HN SER 858 -6.877 7.334 -7.217 60 HA SER 858 HA SER 858 -9.383 7.155 -8.431 61 HB2 SER 858 HB1 SER 858 -10.283 7.533 -6.144 62 HB3 SER 858 HB2 SER 858 -9.002 6.312 -6.225 63 HG SER 858 HG1 SER 858 -8.817 7.869 -4.465 64 H GLU 859 HN GLU 859 -11.072 8.401 -8.702 65 HA GLU 859 HA GLU 859 -11.367 11.181 -7.984 66 HB2 GLU 859 HB1 GLU 859 -11.512 12.124 -10.200 67 HB3 GLU 859 HB2 GLU 859 -9.904 11.442 -9.973 68 HG2 GLU 859 HG1 GLU 859 -10.660 9.391 -11.241 69 HG3 GLU 859 HG2 GLU 859 -12.180 10.220 -11.588 70 H PHE 860 HN PHE 860 -13.579 11.993 -8.833 71 HA PHE 860 HA PHE 860 -15.524 9.809 -8.530 72 HB2 PHE 860 HB1 PHE 860 -15.823 12.819 -8.634 73 HB3 PHE 860 HB2 PHE 860 -17.185 11.709 -8.574 74 HD1 PHE 860 HD1 PHE 860 -14.203 12.910 -6.664 75 HD2 PHE 860 HD2 PHE 860 -17.832 10.583 -6.562 76 HE1 PHE 860 HE1 PHE 860 -14.016 12.721 -4.196 77 HE2 PHE 860 HE2 PHE 860 -17.644 10.401 -4.090 78 HZ PHE 860 HZ PHE 860 -15.732 11.466 -2.906 79 H THR 861 HN THR 861 -15.769 12.525 -10.865 80 HA THR 861 HA THR 861 -16.771 12.639 -12.915 81 HB THR 861 HB THR 861 -16.137 11.210 -14.683 82 HG1 THR 861 HG1 THR 861 -15.456 9.461 -12.642 83 HG21 THR 861 HG21 THR 861 -14.507 12.821 -13.979 84 HG22 THR 861 HG22 THR 861 -13.756 11.612 -12.895 85 HG23 THR 861 HG23 THR 861 -13.791 11.344 -14.661 86 H GLU 862 HN GLU 862 -17.449 10.041 -14.296 87 HA GLU 862 HA GLU 862 -20.228 9.678 -13.200 88 HB2 GLU 862 HB1 GLU 862 -19.876 10.830 -15.461 89 HB3 GLU 862 HB2 GLU 862 -19.446 9.226 -16.087 90 HG2 GLU 862 HG1 GLU 862 -21.620 8.378 -15.600 91 HG3 GLU 862 HG2 GLU 862 -22.000 9.728 -14.537 92 H SER 863 HN SER 863 -21.170 7.429 -13.978 93 HA SER 863 HA SER 863 -20.176 5.615 -12.215 94 HB2 SER 863 HB1 SER 863 -21.787 5.083 -14.721 95 HB3 SER 863 HB2 SER 863 -21.425 3.832 -13.521 96 HG SER 863 HG1 SER 863 -22.943 6.202 -13.164 97 H ALA 864 HN ALA 864 -19.068 3.750 -12.062 98 HA ALA 864 HA ALA 864 -17.045 3.159 -14.190 99 HB1 ALA 864 HB1 ALA 864 -16.624 3.702 -11.223 100 HB2 ALA 864 HB2 ALA 864 -15.347 3.167 -12.314 101 HB3 ALA 864 HB3 ALA 864 -16.102 4.744 -12.569 102 H TRP 865 HN TRP 865 -15.616 1.219 -13.313 103 HA TRP 865 HA TRP 865 -17.300 -0.801 -11.917 104 HB2 TRP 865 HB1 TRP 865 -15.478 -1.365 -14.230 105 HB3 TRP 865 HB2 TRP 865 -16.199 -2.578 -13.229 106 HD1 TRP 865 HD1 TRP 865 -17.368 0.162 -15.675 107 HE1 TRP 865 HE1 TRP 865 -19.169 -0.840 -17.150 108 HE3 TRP 865 HE3 TRP 865 -17.787 -4.236 -13.263 109 HZ2 TRP 865 HZ2 TRP 865 -20.646 -3.424 -17.279 110 HZ3 TRP 865 HZ3 TRP 865 -19.307 -6.078 -14.148 111 HH2 TRP 865 HH2 TRP 865 -20.718 -5.639 -16.109 112 H VAL 866 HN VAL 866 -16.215 -2.121 -10.600 113 HA VAL 866 HA VAL 866 -13.464 -1.140 -9.833 114 HB VAL 866 HB VAL 866 -15.064 -0.166 -8.339 115 HG11 VAL 866 HG11 VAL 866 -16.822 -1.943 -8.374 116 HG12 VAL 866 HG12 VAL 866 -15.760 -2.991 -7.423 117 HG13 VAL 866 HG13 VAL 866 -16.355 -1.470 -6.735 118 HG21 VAL 866 HG21 VAL 866 -12.806 -0.716 -7.511 119 HG22 VAL 866 HG22 VAL 866 -14.040 -0.728 -6.241 120 HG23 VAL 866 HG23 VAL 866 -13.429 -2.262 -6.880 121 H ARG 867 HN ARG 867 -11.928 -2.523 -9.286 122 HA ARG 867 HA ARG 867 -12.456 -5.374 -9.801 123 HB2 ARG 867 HB1 ARG 867 -10.342 -3.687 -10.440 124 HB3 ARG 867 HB2 ARG 867 -9.691 -4.580 -9.069 125 HG2 ARG 867 HG1 ARG 867 -10.393 -6.703 -10.218 126 HG3 ARG 867 HG2 ARG 867 -10.923 -5.745 -11.597 127 HD2 ARG 867 HD1 ARG 867 -8.874 -6.165 -12.383 128 HD3 ARG 867 HD2 ARG 867 -8.409 -4.774 -11.415 129 HE ARG 867 HE ARG 867 -8.128 -6.782 -9.585 130 HH11 ARG 867 HH11 ARG 867 -7.328 -7.287 -12.963 131 HH12 ARG 867 HH12 ARG 867 -5.945 -8.255 -12.549 132 HH21 ARG 867 HH21 ARG 867 -6.598 -8.286 -9.194 133 HH22 ARG 867 HH22 ARG 867 -5.595 -8.860 -10.491 134 H CYS 868 HN CYS 868 -12.283 -7.003 -8.370 135 HA CYS 868 HA CYS 868 -12.067 -6.580 -5.546 136 HB2 CYS 868 HB1 CYS 868 -13.291 -8.416 -6.621 137 HB3 CYS 868 HB2 CYS 868 -11.779 -9.061 -7.268 138 H ASP 869 HN ASP 869 -10.322 -6.137 -4.409 139 HA ASP 869 HA ASP 869 -7.567 -6.501 -5.296 140 HB2 ASP 869 HB1 ASP 869 -8.901 -5.629 -2.721 141 HB3 ASP 869 HB2 ASP 869 -7.183 -5.977 -2.758 142 H ASP 870 HN ASP 870 -9.795 -8.818 -4.092 143 HA ASP 870 HA ASP 870 -7.643 -10.442 -2.808 144 HB2 ASP 870 HB1 ASP 870 -9.752 -9.908 -1.536 145 HB3 ASP 870 HB2 ASP 870 -10.634 -10.912 -2.687 146 H CYS 871 HN CYS 871 -9.978 -10.439 -5.465 147 HA CYS 871 HA CYS 871 -8.242 -12.443 -6.746 148 HB2 CYS 871 HB1 CYS 871 -9.940 -13.593 -7.825 149 HB3 CYS 871 HB2 CYS 871 -10.329 -13.568 -6.120 150 H PHE 872 HN PHE 872 -10.771 -11.047 -8.457 151 HA PHE 872 HA PHE 872 -9.482 -8.754 -9.645 152 HB2 PHE 872 HB1 PHE 872 -8.995 -9.671 -11.832 153 HB3 PHE 872 HB2 PHE 872 -8.026 -10.442 -10.602 154 HD1 PHE 872 HD1 PHE 872 -10.755 -10.921 -13.050 155 HD2 PHE 872 HD2 PHE 872 -8.333 -12.837 -10.042 156 HE1 PHE 872 HE1 PHE 872 -11.541 -13.143 -13.834 157 HE2 PHE 872 HE2 PHE 872 -9.120 -15.059 -10.827 158 HZ PHE 872 HZ PHE 872 -10.727 -15.215 -12.720 159 H LYS 873 HN LYS 873 -12.226 -10.722 -9.348 160 HA LYS 873 HA LYS 873 -13.853 -10.135 -11.544 161 HB2 LYS 873 HB1 LYS 873 -14.608 -10.403 -8.635 162 HB3 LYS 873 HB2 LYS 873 -15.771 -10.036 -9.920 163 HG2 LYS 873 HG1 LYS 873 -14.608 -12.049 -11.160 164 HG3 LYS 873 HG2 LYS 873 -14.233 -12.564 -9.502 165 HD2 LYS 873 HD1 LYS 873 -16.935 -11.969 -10.754 166 HD3 LYS 873 HD2 LYS 873 -16.300 -13.559 -10.337 167 HE2 LYS 873 HE1 LYS 873 -17.393 -13.399 -8.379 168 HE3 LYS 873 HE2 LYS 873 -16.153 -12.227 -7.903 169 HZ1 LYS 873 HZ1 LYS 873 -18.435 -11.413 -7.597 170 HZ2 LYS 873 HZ2 LYS 873 -17.647 -10.481 -8.690 171 HZ3 LYS 873 HZ3 LYS 873 -18.737 -11.609 -9.212 172 H TRP 874 HN TRP 874 -15.110 -8.621 -12.245 173 HA TRP 874 HA TRP 874 -14.790 -5.841 -11.211 174 HB2 TRP 874 HB1 TRP 874 -15.854 -6.786 -13.883 175 HB3 TRP 874 HB2 TRP 874 -15.709 -5.122 -13.371 176 HD1 TRP 874 HD1 TRP 874 -13.699 -7.767 -15.037 177 HE1 TRP 874 HE1 TRP 874 -11.241 -6.953 -15.405 178 HE3 TRP 874 HE3 TRP 874 -13.814 -3.497 -12.229 179 HZ2 TRP 874 HZ2 TRP 874 -9.614 -4.847 -14.550 180 HZ3 TRP 874 HZ3 TRP 874 -11.777 -2.120 -11.980 181 HH2 TRP 874 HH2 TRP 874 -9.683 -2.744 -13.117 182 H ARG 875 HN ARG 875 -16.537 -4.560 -10.769 183 HA ARG 875 HA ARG 875 -19.327 -5.509 -11.142 184 HB2 ARG 875 HB1 ARG 875 -18.176 -4.601 -8.464 185 HB3 ARG 875 HB2 ARG 875 -19.897 -4.639 -8.807 186 HG2 ARG 875 HG1 ARG 875 -18.026 -7.040 -8.743 187 HG3 ARG 875 HG2 ARG 875 -19.207 -6.605 -7.529 188 HD2 ARG 875 HD1 ARG 875 -19.775 -7.557 -10.345 189 HD3 ARG 875 HD2 ARG 875 -20.063 -8.426 -8.841 190 HE ARG 875 HE ARG 875 -21.600 -6.119 -8.574 191 HH11 ARG 875 HH11 ARG 875 -21.532 -8.705 -10.963 192 HH12 ARG 875 HH12 ARG 875 -23.178 -8.317 -11.463 193 HH21 ARG 875 HH21 ARG 875 -23.758 -5.882 -9.268 194 HH22 ARG 875 HH22 ARG 875 -24.260 -6.813 -10.692 195 H ARG 876 HN ARG 876 -20.682 -3.928 -11.730 196 HA ARG 876 HA ARG 876 -19.728 -1.236 -12.391 197 HB2 ARG 876 HB1 ARG 876 -21.393 -2.807 -13.636 198 HB3 ARG 876 HB2 ARG 876 -22.587 -2.243 -12.487 199 HG2 ARG 876 HG1 ARG 876 -21.013 -0.626 -14.537 200 HG3 ARG 876 HG2 ARG 876 -22.732 -1.004 -14.573 201 HD2 ARG 876 HD1 ARG 876 -21.276 0.885 -12.724 202 HD3 ARG 876 HD2 ARG 876 -22.442 1.309 -13.985 203 HE ARG 876 HE ARG 876 -23.661 -0.469 -12.077 204 HH11 ARG 876 HH11 ARG 876 -22.875 2.953 -12.381 205 HH12 ARG 876 HH12 ARG 876 -24.119 3.401 -11.275 206 HH21 ARG 876 HH21 ARG 876 -25.122 0.194 -10.575 207 HH22 ARG 876 HH22 ARG 876 -25.311 1.883 -10.233 208 H ILE 877 HN ILE 877 -19.782 0.496 -11.202 209 HA ILE 877 HA ILE 877 -21.568 0.710 -8.829 210 HB ILE 877 HB ILE 877 -19.734 1.636 -7.520 211 HG12 ILE 877 HG11 ILE 877 -17.891 0.947 -9.850 212 HG13 ILE 877 HG12 ILE 877 -18.387 2.571 -9.420 213 HG21 ILE 877 HG21 ILE 877 -20.265 -0.828 -7.517 214 HG22 ILE 877 HG22 ILE 877 -18.923 -1.066 -8.648 215 HG23 ILE 877 HG23 ILE 877 -18.625 -0.452 -7.000 216 HD11 ILE 877 HD1 ILE 877 -16.868 0.832 -7.466 217 HD12 ILE 877 HD2 ILE 877 -16.128 1.975 -8.600 218 HD13 ILE 877 HD3 ILE 877 -17.241 2.556 -7.357 219 HA PRO 878 HA PRO 878 -21.950 4.966 -10.282 220 HB2 PRO 878 HB1 PRO 878 -22.712 6.286 -8.022 221 HB3 PRO 878 HB2 PRO 878 -23.804 5.153 -8.877 222 HG2 PRO 878 HG1 PRO 878 -22.057 4.583 -6.462 223 HG3 PRO 878 HG2 PRO 878 -23.796 4.206 -6.677 224 HD2 PRO 878 HD1 PRO 878 -21.831 2.363 -7.129 225 HD3 PRO 878 HD2 PRO 878 -23.321 2.402 -8.115 226 H ALA 879 HN ALA 879 -20.642 6.765 -10.330 227 HA ALA 879 HA ALA 879 -18.007 6.838 -9.533 228 HB1 ALA 879 HB1 ALA 879 -18.927 8.371 -11.148 229 HB2 ALA 879 HB2 ALA 879 -20.027 9.092 -9.948 230 HB3 ALA 879 HB3 ALA 879 -18.283 9.350 -9.824 231 H SER 880 HN SER 880 -20.728 7.633 -7.441 232 HA SER 880 HA SER 880 -19.332 9.095 -5.395 233 HB2 SER 880 HB1 SER 880 -21.783 7.298 -5.183 234 HB3 SER 880 HB2 SER 880 -21.191 8.387 -3.918 235 HG SER 880 HG1 SER 880 -22.222 9.087 -6.482 236 H VAL 881 HN VAL 881 -19.389 5.667 -6.183 237 HA VAL 881 HA VAL 881 -17.937 4.964 -3.695 238 HB VAL 881 HB VAL 881 -18.934 3.251 -6.000 239 HG11 VAL 881 HG11 VAL 881 -16.908 2.212 -4.969 240 HG12 VAL 881 HG12 VAL 881 -17.702 2.316 -3.378 241 HG13 VAL 881 HG13 VAL 881 -18.377 1.286 -4.656 242 HG21 VAL 881 HG21 VAL 881 -20.523 2.332 -4.358 243 HG22 VAL 881 HG22 VAL 881 -19.904 3.448 -3.120 244 HG23 VAL 881 HG23 VAL 881 -20.756 4.072 -4.545 245 H VAL 882 HN VAL 882 -17.402 5.260 -7.211 246 HA VAL 882 HA VAL 882 -14.754 4.209 -6.947 247 HB VAL 882 HB VAL 882 -16.246 4.486 -9.069 248 HG11 VAL 882 HG11 VAL 882 -15.918 7.069 -9.072 249 HG12 VAL 882 HG12 VAL 882 -14.295 6.709 -9.664 250 HG13 VAL 882 HG13 VAL 882 -15.700 6.188 -10.596 251 HG21 VAL 882 HG21 VAL 882 -14.199 4.073 -10.448 252 HG22 VAL 882 HG22 VAL 882 -13.194 4.626 -9.105 253 HG23 VAL 882 HG23 VAL 882 -14.168 3.158 -8.935 254 H GLY 883 HN GLY 883 -15.970 7.320 -6.304 255 HA2 GLY 883 HA1 GLY 883 -13.324 8.658 -6.146 256 HA3 GLY 883 HA2 GLY 883 -14.894 9.344 -5.743 257 H SER 884 HN SER 884 -15.290 6.711 -4.071 258 HA SER 884 HA SER 884 -14.080 7.690 -1.541 259 HB2 SER 884 HB1 SER 884 -16.485 7.176 -1.602 260 HB3 SER 884 HB2 SER 884 -16.125 5.509 -2.091 261 HG SER 884 HG1 SER 884 -16.479 5.764 0.192 262 H ILE 885 HN ILE 885 -14.109 4.831 -3.661 263 HA ILE 885 HA ILE 885 -12.157 3.267 -2.196 264 HB ILE 885 HB ILE 885 -13.464 3.161 -4.911 265 HG12 ILE 885 HG11 ILE 885 -14.209 0.990 -4.258 266 HG13 ILE 885 HG12 ILE 885 -13.109 0.917 -2.880 267 HG21 ILE 885 HG21 ILE 885 -11.071 1.451 -4.132 268 HG22 ILE 885 HG22 ILE 885 -12.194 1.104 -5.471 269 HG23 ILE 885 HG23 ILE 885 -11.202 2.554 -5.529 270 HD11 ILE 885 HD1 ILE 885 -14.428 2.487 -1.625 271 HD12 ILE 885 HD2 ILE 885 -15.437 2.854 -3.042 272 HD13 ILE 885 HD3 ILE 885 -15.521 1.260 -2.288 273 H ASP 886 HN ASP 886 -10.134 3.729 -1.950 274 HA ASP 886 HA ASP 886 -8.553 5.220 -4.012 275 HB2 ASP 886 HB1 ASP 886 -8.087 4.964 -1.016 276 HB3 ASP 886 HB2 ASP 886 -7.010 5.770 -2.150 277 H GLU 887 HN GLU 887 -6.282 4.476 -4.257 278 HA GLU 887 HA GLU 887 -6.030 1.629 -4.422 279 HB2 GLU 887 HB1 GLU 887 -4.851 3.222 -5.880 280 HB3 GLU 887 HB2 GLU 887 -3.943 3.843 -4.503 281 HG2 GLU 887 HG1 GLU 887 -2.645 2.330 -5.989 282 HG3 GLU 887 HG2 GLU 887 -2.662 1.851 -4.302 283 H SER 888 HN SER 888 -5.377 3.807 -1.793 284 HA SER 888 HA SER 888 -3.779 2.018 -0.156 285 HB2 SER 888 HB1 SER 888 -3.822 4.462 0.086 286 HB3 SER 888 HB2 SER 888 -5.518 4.362 0.583 287 HG SER 888 HG1 SER 888 -4.051 4.477 2.370 288 H SER 889 HN SER 889 -7.174 2.225 -0.886 289 HA SER 889 HA SER 889 -8.060 0.564 1.402 290 HB2 SER 889 HB1 SER 889 -9.420 2.504 0.560 291 HB3 SER 889 HB2 SER 889 -9.681 1.604 -0.950 292 HG SER 889 HG1 SER 889 -11.349 1.341 0.695 293 H ARG 890 HN ARG 890 -9.599 -1.249 0.731 294 HA ARG 890 HA ARG 890 -8.729 -2.793 -1.662 295 HB2 ARG 890 HB1 ARG 890 -8.752 -3.914 1.167 296 HB3 ARG 890 HB2 ARG 890 -8.705 -4.897 -0.302 297 HG2 ARG 890 HG1 ARG 890 -6.579 -3.782 -0.979 298 HG3 ARG 890 HG2 ARG 890 -6.597 -2.862 0.541 299 HD2 ARG 890 HD1 ARG 890 -6.570 -4.982 1.820 300 HD3 ARG 890 HD2 ARG 890 -6.501 -5.895 0.297 301 HE ARG 890 HE ARG 890 -4.371 -4.066 0.210 302 HH11 ARG 890 HH11 ARG 890 -5.213 -6.792 2.241 303 HH12 ARG 890 HH12 ARG 890 -3.552 -7.119 2.650 304 HH21 ARG 890 HH21 ARG 890 -2.273 -4.537 0.770 305 HH22 ARG 890 HH22 ARG 890 -1.935 -5.870 1.832 306 H TRP 891 HN TRP 891 -10.579 -2.459 -2.729 307 HA TRP 891 HA TRP 891 -13.217 -3.118 -1.556 308 HB2 TRP 891 HB1 TRP 891 -12.887 -1.297 -3.253 309 HB3 TRP 891 HB2 TRP 891 -12.503 -2.541 -4.443 310 HD1 TRP 891 HD1 TRP 891 -15.236 -0.703 -2.827 311 HE1 TRP 891 HE1 TRP 891 -17.528 -1.371 -3.720 312 HE3 TRP 891 HE3 TRP 891 -13.886 -5.010 -5.252 313 HZ2 TRP 891 HZ2 TRP 891 -18.701 -3.715 -4.957 314 HZ3 TRP 891 HZ3 TRP 891 -15.670 -6.501 -6.191 315 HH2 TRP 891 HH2 TRP 891 -18.038 -5.888 -5.970 316 H ILE 892 HN ILE 892 -14.133 -5.165 -1.705 317 HA ILE 892 HA ILE 892 -12.964 -7.165 -3.568 318 HB ILE 892 HB ILE 892 -12.781 -8.834 -1.836 319 HG12 ILE 892 HG11 ILE 892 -13.348 -6.713 0.265 320 HG13 ILE 892 HG12 ILE 892 -14.576 -7.827 -0.342 321 HG21 ILE 892 HG21 ILE 892 -11.205 -6.374 -0.974 322 HG22 ILE 892 HG22 ILE 892 -10.779 -8.063 -0.688 323 HG23 ILE 892 HG23 ILE 892 -10.793 -7.435 -2.339 324 HD11 ILE 892 HD1 ILE 892 -13.375 -9.765 0.357 325 HD12 ILE 892 HD2 ILE 892 -12.057 -8.761 1.037 326 HD13 ILE 892 HD3 ILE 892 -13.688 -8.672 1.725 327 H CYS 893 HN CYS 893 -14.244 -9.111 -3.848 328 HA CYS 893 HA CYS 893 -16.946 -8.841 -4.256 329 HB2 CYS 893 HB1 CYS 893 -15.439 -11.374 -3.469 330 HB3 CYS 893 HB2 CYS 893 -17.031 -11.280 -4.231 331 H MET 894 HN MET 894 -15.469 -9.999 -1.103 332 HA MET 894 HA MET 894 -18.041 -10.712 -0.012 333 HB2 MET 894 HB1 MET 894 -15.982 -11.699 0.777 334 HB3 MET 894 HB2 MET 894 -15.393 -10.129 1.329 335 HG2 MET 894 HG1 MET 894 -17.024 -10.002 3.064 336 HG3 MET 894 HG2 MET 894 -17.896 -11.405 2.427 337 HE1 MET 894 HE1 MET 894 -13.835 -11.555 4.679 338 HE2 MET 894 HE2 MET 894 -13.932 -10.923 3.025 339 HE3 MET 894 HE3 MET 894 -14.765 -10.078 4.352 340 H ASN 895 HN ASN 895 -16.536 -7.622 -0.379 341 HA ASN 895 HA ASN 895 -18.266 -6.250 1.585 342 HB2 ASN 895 HB1 ASN 895 -16.517 -4.890 1.686 343 HB3 ASN 895 HB2 ASN 895 -15.685 -5.783 0.430 344 HD21 ASN 895 HD21 ASN 895 -16.451 -5.192 -1.919 345 HD22 ASN 895 HD22 ASN 895 -16.629 -3.459 -2.172 346 H ASN 896 HN ASN 896 -18.510 -7.242 -1.674 347 HA ASN 896 HA ASN 896 -19.700 -5.086 -2.983 348 HB2 ASN 896 HB1 ASN 896 -18.915 -7.168 -4.074 349 HB3 ASN 896 HB2 ASN 896 -20.259 -8.048 -3.332 350 HD21 ASN 896 HD21 ASN 896 -20.664 -8.719 -5.565 351 HD22 ASN 896 HD22 ASN 896 -21.747 -7.681 -6.473 352 H SER 897 HN SER 897 -21.580 -4.162 -3.069 353 HA SER 897 HA SER 897 -23.736 -4.442 -1.211 354 HB2 SER 897 HB1 SER 897 -23.461 -3.191 -3.969 355 HB3 SER 897 HB2 SER 897 -24.994 -3.207 -3.112 356 HG SER 897 HG1 SER 897 -22.527 -2.049 -2.229 357 H ASP 898 HN ASP 898 -23.295 -5.812 -4.440 358 HA ASP 898 HA ASP 898 -26.021 -6.933 -4.472 359 HB2 ASP 898 HB1 ASP 898 -23.914 -7.377 -6.569 360 HB3 ASP 898 HB2 ASP 898 -25.650 -7.545 -6.719 361 H LYS 899 HN LYS 899 -26.210 -8.491 -3.082 362 HA LYS 899 HA LYS 899 -24.370 -10.447 -2.261 363 HB2 LYS 899 HB1 LYS 899 -27.417 -10.540 -2.201 364 HB3 LYS 899 HB2 LYS 899 -26.346 -11.589 -1.277 365 HG2 LYS 899 HG1 LYS 899 -26.110 -8.583 -0.972 366 HG3 LYS 899 HG2 LYS 899 -27.391 -9.456 -0.143 367 HD2 LYS 899 HD1 LYS 899 -24.509 -10.350 0.057 368 HD3 LYS 899 HD2 LYS 899 -25.196 -9.105 1.133 369 HE2 LYS 899 HE1 LYS 899 -26.961 -10.690 1.842 370 HE3 LYS 899 HE2 LYS 899 -26.299 -11.927 0.771 371 HZ1 LYS 899 HZ1 LYS 899 -25.518 -12.220 3.057 372 HZ2 LYS 899 HZ2 LYS 899 -24.244 -11.877 2.097 373 HZ3 LYS 899 HZ3 LYS 899 -24.860 -10.728 3.085 374 H ARG 900 HN ARG 900 -26.161 -10.432 -5.158 375 HA ARG 900 HA ARG 900 -26.144 -13.278 -5.825 376 HB2 ARG 900 HB1 ARG 900 -26.383 -10.688 -7.408 377 HB3 ARG 900 HB2 ARG 900 -26.369 -12.273 -8.186 378 HG2 ARG 900 HG1 ARG 900 -28.355 -12.955 -6.858 379 HG3 ARG 900 HG2 ARG 900 -28.387 -11.355 -6.087 380 HD2 ARG 900 HD1 ARG 900 -28.694 -10.293 -8.305 381 HD3 ARG 900 HD2 ARG 900 -28.665 -11.894 -9.075 382 HE ARG 900 HE ARG 900 -30.671 -11.904 -7.053 383 HH11 ARG 900 HH11 ARG 900 -30.178 -10.427 -10.192 384 HH12 ARG 900 HH12 ARG 900 -31.889 -10.312 -10.508 385 HH21 ARG 900 HH21 ARG 900 -32.837 -11.728 -7.519 386 HH22 ARG 900 HH22 ARG 900 -33.349 -11.033 -9.029 387 H PHE 901 HN PHE 901 -23.736 -10.747 -5.958 388 HA PHE 901 HA PHE 901 -21.835 -12.653 -7.225 389 HB2 PHE 901 HB1 PHE 901 -21.709 -9.697 -7.786 390 HB3 PHE 901 HB2 PHE 901 -20.926 -11.013 -8.650 391 HD1 PHE 901 HD1 PHE 901 -22.003 -11.919 -10.620 392 HD2 PHE 901 HD2 PHE 901 -24.216 -9.349 -7.975 393 HE1 PHE 901 HE1 PHE 901 -23.865 -11.869 -12.245 394 HE2 PHE 901 HE2 PHE 901 -26.076 -9.273 -9.616 395 HZ PHE 901 HZ PHE 901 -25.914 -10.551 -11.741 396 H ALA 902 HN ALA 902 -22.328 -11.504 -4.420 397 HA ALA 902 HA ALA 902 -19.890 -10.136 -3.754 398 HB1 ALA 902 HB1 ALA 902 -22.106 -9.483 -2.832 399 HB2 ALA 902 HB2 ALA 902 -22.199 -11.054 -1.990 400 HB3 ALA 902 HB3 ALA 902 -20.952 -9.870 -1.552 401 H ASP 903 HN ASP 903 -19.269 -12.668 -4.689 402 HA ASP 903 HA ASP 903 -17.333 -13.326 -2.656 403 HB2 ASP 903 HB1 ASP 903 -19.522 -15.265 -3.226 404 HB3 ASP 903 HB2 ASP 903 -17.893 -15.917 -3.207 405 H CYS 904 HN CYS 904 -15.470 -14.193 -3.377 406 HA CYS 904 HA CYS 904 -14.673 -13.787 -6.027 407 HB2 CYS 904 HB1 CYS 904 -13.524 -15.599 -3.847 408 HB3 CYS 904 HB2 CYS 904 -12.658 -15.000 -5.264 409 H SER 905 HN SER 905 -16.588 -16.303 -4.799 410 HA SER 905 HA SER 905 -15.892 -18.369 -6.828 411 HB2 SER 905 HB1 SER 905 -17.963 -18.408 -4.605 412 HB3 SER 905 HB2 SER 905 -17.486 -19.769 -5.634 413 HG SER 905 HG1 SER 905 -15.430 -19.721 -4.702 414 H LYS 906 HN LYS 906 -18.110 -15.728 -6.392 415 HA LYS 906 HA LYS 906 -20.290 -16.867 -8.023 416 HB2 LYS 906 HB1 LYS 906 -19.696 -14.113 -6.905 417 HB3 LYS 906 HB2 LYS 906 -21.150 -14.501 -7.826 418 HG2 LYS 906 HG1 LYS 906 -20.417 -15.668 -5.132 419 HG3 LYS 906 HG2 LYS 906 -21.579 -14.382 -5.462 420 HD2 LYS 906 HD1 LYS 906 -23.019 -16.131 -5.258 421 HD3 LYS 906 HD2 LYS 906 -22.738 -16.211 -6.999 422 HE2 LYS 906 HE1 LYS 906 -20.997 -17.995 -6.578 423 HE3 LYS 906 HE2 LYS 906 -21.321 -17.868 -4.848 424 HZ1 LYS 906 HZ1 LYS 906 -22.557 -19.702 -5.849 425 HZ2 LYS 906 HZ2 LYS 906 -23.607 -18.590 -5.285 426 HZ3 LYS 906 HZ3 LYS 906 -23.318 -18.702 -6.890 427 H SER 907 HN SER 907 -21.192 -15.219 -9.652 428 HA SER 907 HA SER 907 -19.317 -15.251 -11.921 429 HB2 SER 907 HB1 SER 907 -21.550 -16.369 -11.954 430 HB3 SER 907 HB2 SER 907 -22.312 -14.768 -11.893 431 HG SER 907 HG1 SER 907 -22.035 -15.679 -14.043 432 H GLN 908 HN GLN 908 -20.618 -13.350 -13.517 433 HA GLN 908 HA GLN 908 -20.238 -10.650 -12.391 434 HB2 GLN 908 HB1 GLN 908 -17.988 -11.644 -12.960 435 HB3 GLN 908 HB2 GLN 908 -18.500 -11.778 -14.639 436 HG2 GLN 908 HG1 GLN 908 -18.553 -9.387 -14.896 437 HG3 GLN 908 HG2 GLN 908 -18.440 -9.121 -13.168 438 HE21 GLN 908 HE21 GLN 908 -16.588 -9.303 -16.002 439 HE22 GLN 908 HE22 GLN 908 -15.021 -9.678 -15.290 440 H GLU 909 HN GLU 909 -21.120 -8.959 -13.923 441 HA GLU 909 HA GLU 909 -23.356 -9.899 -15.478 442 HB2 GLU 909 HB1 GLU 909 -21.949 -7.254 -15.820 443 HB3 GLU 909 HB2 GLU 909 -23.597 -7.614 -16.267 444 HG2 GLU 909 HG1 GLU 909 -22.464 -7.361 -13.463 445 HG3 GLU 909 HG2 GLU 909 -23.427 -6.165 -14.305 446 H MET 910 HN MET 910 -20.055 -8.976 -16.402 447 HA MET 910 HA MET 910 -20.383 -10.160 -19.120 448 HB2 MET 910 HB1 MET 910 -19.233 -7.381 -18.574 449 HB3 MET 910 HB2 MET 910 -19.206 -8.228 -20.119 450 HG2 MET 910 HG1 MET 910 -21.698 -8.188 -20.162 451 HG3 MET 910 HG2 MET 910 -21.683 -7.255 -18.657 452 HE1 MET 910 HE1 MET 910 -22.806 -4.551 -21.223 453 HE2 MET 910 HE2 MET 910 -23.256 -6.271 -21.189 454 HE3 MET 910 HE3 MET 910 -23.145 -5.350 -19.672 455 H SER 911 HN SER 911 -18.458 -11.200 -19.825 456 HA SER 911 HA SER 911 -16.352 -11.657 -17.902 457 HB2 SER 911 HB1 SER 911 -15.938 -12.021 -20.851 458 HB3 SER 911 HB2 SER 911 -15.294 -12.973 -19.524 459 HG SER 911 HG1 SER 911 -17.324 -13.890 -19.187 460 H ASN 912 HN ASN 912 -14.059 -11.102 -18.220 461 HA ASN 912 HA ASN 912 -13.880 -8.285 -18.167 462 HB2 ASN 912 HB1 ASN 912 -11.563 -10.258 -18.328 463 HB3 ASN 912 HB2 ASN 912 -11.462 -8.560 -17.868 464 HD21 ASN 912 HD21 ASN 912 -10.606 -8.959 -15.835 465 HD22 ASN 912 HD22 ASN 912 -11.588 -9.664 -14.555 466 H GLU 913 HN GLU 913 -13.239 -10.463 -20.813 467 HA GLU 913 HA GLU 913 -12.118 -8.486 -22.639 468 HB2 GLU 913 HB1 GLU 913 -12.070 -10.286 -24.225 469 HB3 GLU 913 HB2 GLU 913 -11.466 -10.854 -22.670 470 HG2 GLU 913 HG1 GLU 913 -13.758 -11.834 -22.208 471 HG3 GLU 913 HG2 GLU 913 -14.223 -11.407 -23.853 472 H GLU 914 HN GLU 914 -15.249 -8.822 -21.565 473 HA GLU 914 HA GLU 914 -16.493 -7.841 -24.107 474 HB2 GLU 914 HB1 GLU 914 -17.765 -9.049 -21.628 475 HB3 GLU 914 HB2 GLU 914 -18.639 -8.454 -23.024 476 HG2 GLU 914 HG1 GLU 914 -16.702 -10.813 -22.961 477 HG3 GLU 914 HG2 GLU 914 -18.453 -10.913 -22.969 478 H ILE 915 HN ILE 915 -16.204 -7.189 -20.565 479 HA ILE 915 HA ILE 915 -17.510 -4.618 -20.718 480 HB ILE 915 HB ILE 915 -17.549 -5.427 -18.613 481 HG12 ILE 915 HG11 ILE 915 -16.244 -4.025 -17.103 482 HG13 ILE 915 HG12 ILE 915 -15.131 -3.599 -18.404 483 HG21 ILE 915 HG21 ILE 915 -16.137 -7.236 -18.486 484 HG22 ILE 915 HG22 ILE 915 -14.672 -6.276 -18.816 485 HG23 ILE 915 HG23 ILE 915 -15.527 -6.168 -17.256 486 HD11 ILE 915 HD1 ILE 915 -16.881 -2.375 -19.553 487 HD12 ILE 915 HD2 ILE 915 -18.116 -3.010 -18.464 488 HD13 ILE 915 HD3 ILE 915 -16.863 -1.876 -17.878 489 H ASN 916 HN ASN 916 -14.011 -5.412 -20.770 490 HA ASN 916 HA ASN 916 -13.050 -2.769 -21.037 491 HB2 ASN 916 HB1 ASN 916 -10.982 -3.678 -21.854 492 HB3 ASN 916 HB2 ASN 916 -11.555 -4.685 -20.574 493 HD21 ASN 916 HD21 ASN 916 -9.650 -5.832 -22.108 494 HD22 ASN 916 HD22 ASN 916 -10.365 -6.946 -23.256 495 H GLU 917 HN GLU 917 -14.382 -4.788 -23.599 496 HA GLU 917 HA GLU 917 -13.845 -3.077 -25.820 497 HB2 GLU 917 HB1 GLU 917 -15.595 -5.392 -25.192 498 HB3 GLU 917 HB2 GLU 917 -16.131 -4.349 -26.516 499 HG2 GLU 917 HG1 GLU 917 -13.838 -4.556 -27.535 500 HG3 GLU 917 HG2 GLU 917 -13.400 -5.685 -26.251 501 H GLU 918 HN GLU 918 -16.500 -2.985 -23.453 502 HA GLU 918 HA GLU 918 -18.055 -0.925 -24.801 503 HB2 GLU 918 HB1 GLU 918 -18.974 -2.352 -22.973 504 HB3 GLU 918 HB2 GLU 918 -17.919 -1.521 -21.805 505 HG2 GLU 918 HG1 GLU 918 -19.036 0.574 -22.113 506 HG3 GLU 918 HG2 GLU 918 -19.852 0.003 -23.569 507 H LEU 919 HN LEU 919 -15.342 -0.864 -22.506 508 HA LEU 919 HA LEU 919 -15.335 2.040 -22.184 509 HB2 LEU 919 HB1 LEU 919 -13.447 -0.211 -21.466 510 HB3 LEU 919 HB2 LEU 919 -13.130 1.462 -21.019 511 HG LEU 919 HG LEU 919 -15.834 0.409 -20.229 512 HD11 LEU 919 HD11 LEU 919 -14.479 -1.569 -19.817 513 HD12 LEU 919 HD12 LEU 919 -13.271 -0.594 -18.946 514 HD13 LEU 919 HD13 LEU 919 -14.923 -0.788 -18.298 515 HD21 LEU 919 HD21 LEU 919 -13.634 1.839 -18.685 516 HD22 LEU 919 HD22 LEU 919 -14.975 2.629 -19.532 517 HD23 LEU 919 HD23 LEU 919 -15.309 1.548 -18.149 518 H GLY 920 HN GLY 920 -13.835 -0.275 -24.325 519 HA2 GLY 920 HA1 GLY 920 -13.047 0.179 -26.507 520 HA3 GLY 920 HA2 GLY 920 -12.843 1.887 -26.109 521 H ILE 921 HN ILE 921 -11.626 -0.876 -24.248 522 HA ILE 921 HA ILE 921 -8.781 -0.111 -24.735 523 HB ILE 921 HB ILE 921 -8.397 -0.061 -22.310 524 HG12 ILE 921 HG11 ILE 921 -11.409 -0.372 -22.064 525 HG13 ILE 921 HG12 ILE 921 -10.205 -1.576 -21.612 526 HG21 ILE 921 HG21 ILE 921 -10.593 1.914 -23.009 527 HG22 ILE 921 HG22 ILE 921 -9.261 2.119 -21.855 528 HG23 ILE 921 HG23 ILE 921 -8.913 2.025 -23.584 529 HD11 ILE 921 HD1 ILE 921 -10.989 -0.530 -19.625 530 HD12 ILE 921 HD2 ILE 921 -9.302 -0.026 -19.898 531 HD13 ILE 921 HD3 ILE 921 -10.655 1.091 -20.253 532 H GLY 922 HN GLY 922 -7.304 -1.609 -23.477 533 HA2 GLY 922 HA1 GLY 922 -8.000 -4.439 -24.051 534 HA3 GLY 922 HA2 GLY 922 -6.420 -3.780 -23.625 535 H GLN 923 HN GLN 923 -7.520 -2.374 -21.288 536 HA GLN 923 HA GLN 923 -7.165 -2.578 -19.107 537 HB2 GLN 923 HB1 GLN 923 -8.825 -4.982 -19.427 538 HB3 GLN 923 HB2 GLN 923 -7.603 -5.181 -18.195 539 HG2 GLN 923 HG1 GLN 923 -9.658 -3.002 -18.309 540 HG3 GLN 923 HG2 GLN 923 -9.624 -4.428 -17.226 541 HE21 GLN 923 HE21 GLN 923 -10.106 -2.102 -16.009 542 HE22 GLN 923 HE22 GLN 923 -8.644 -1.555 -15.202 543 H ASP 924 HN ASP 924 -5.869 -3.477 -17.531 544 HA ASP 924 HA ASP 924 -3.182 -3.966 -18.716 545 HB2 ASP 924 HB1 ASP 924 -4.023 -3.380 -15.855 546 HB3 ASP 924 HB2 ASP 924 -2.360 -3.464 -16.432 547 H GLU 925 HN GLU 925 -5.476 -5.749 -16.775 548 HA GLU 925 HA GLU 925 -3.780 -7.887 -15.885 549 HB2 GLU 925 HB1 GLU 925 -5.852 -8.985 -15.357 550 HB3 GLU 925 HB2 GLU 925 -5.953 -7.248 -15.006 551 HG2 GLU 925 HG1 GLU 925 -7.130 -7.102 -17.318 552 HG3 GLU 925 HG2 GLU 925 -7.384 -8.833 -17.128 553 H ALA 926 HN ALA 926 -5.770 -7.478 -18.716 554 HA ALA 926 HA ALA 926 -5.073 -9.968 -20.052 555 HB1 ALA 926 HB1 ALA 926 -6.199 -7.366 -21.164 556 HB2 ALA 926 HB2 ALA 926 -6.219 -8.945 -21.975 557 HB3 ALA 926 HB3 ALA 926 -7.170 -8.702 -20.495 558 H ASP 927 HN ASP 927 -3.945 -6.573 -20.471 559 HA ASP 927 HA ASP 927 -1.896 -7.312 -22.387 560 HB2 ASP 927 HB1 ASP 927 -3.197 -5.172 -22.375 561 HB3 ASP 927 HB2 ASP 927 -2.298 -4.673 -20.943 562 H ALA 928 HN ALA 928 -1.449 -8.876 -20.230 563 HA ALA 928 HA ALA 928 0.528 -7.924 -18.362 564 HB1 ALA 928 HB1 ALA 928 -0.250 -10.750 -19.203 565 HB2 ALA 928 HB2 ALA 928 0.728 -10.320 -17.785 566 HB3 ALA 928 HB3 ALA 928 -0.967 -9.807 -17.875 567 H1 ALA 1 HT1 ALA 1 -7.810 -1.402 -5.872 568 H2 ALA 1 HT2 ALA 1 -6.268 -0.823 -5.770 569 H3 ALA 1 HT3 ALA 1 -6.627 -2.343 -5.230 570 HA ALA 1 HA ALA 1 -5.449 -2.359 -7.328 571 HB1 ALA 1 HB1 ALA 1 -7.038 -3.872 -8.545 572 HB2 ALA 1 HB2 ALA 1 -6.891 -4.281 -6.838 573 HB3 ALA 1 HB3 ALA 1 -8.322 -3.395 -7.416 574 H ARG 2 HN ARG 2 -5.501 -2.043 -9.555 575 HA ARG 2 HA ARG 2 -6.281 0.216 -10.909 576 HB2 ARG 2 HB1 ARG 2 -4.820 -1.418 -11.878 577 HB3 ARG 2 HB2 ARG 2 -6.015 -2.706 -11.714 578 HG2 ARG 2 HG1 ARG 2 -5.812 -2.146 -14.035 579 HG3 ARG 2 HG2 ARG 2 -7.407 -1.689 -13.464 580 HD2 ARG 2 HD1 ARG 2 -6.000 0.667 -13.040 581 HD3 ARG 2 HD2 ARG 2 -5.094 0.017 -14.375 582 HE ARG 2 HE ARG 2 -7.994 0.778 -14.328 583 HH11 ARG 2 HH11 ARG 2 -5.216 0.018 -16.383 584 HH12 ARG 2 HH12 ARG 2 -5.984 0.752 -17.764 585 HH21 ARG 2 HH21 ARG 2 -8.819 1.696 -16.049 586 HH22 ARG 2 HH22 ARG 2 -8.012 1.644 -17.596 587 H THR 3 HN THR 3 -8.080 1.020 -11.998 588 HA THR 3 HA THR 3 -10.330 -0.694 -12.566 589 HB THR 3 HB THR 3 -11.000 -0.267 -10.268 590 HG1 THR 3 HG1 THR 3 -12.770 0.231 -11.510 591 HG21 THR 3 HG21 THR 3 -11.154 1.982 -9.260 592 HG22 THR 3 HG22 THR 3 -9.477 1.638 -9.703 593 HG23 THR 3 HG23 THR 3 -10.487 2.711 -10.726 594 H MLZ 4 HN MLZ 4 -12.329 0.779 -13.330 595 HA MLZ 4 HA MLZ 4 -11.301 2.318 -15.653 596 HB2 MLZ 4 HB1 MLZ 4 -12.257 0.619 -17.161 597 HB3 MLZ 4 HB2 MLZ 4 -11.174 -0.190 -16.034 598 HG2 MLZ 4 HG1 MLZ 4 -13.548 -0.325 -14.651 599 HG3 MLZ 4 HG2 MLZ 4 -14.165 -0.341 -16.283 600 HD2 MLZ 4 HD1 MLZ 4 -12.114 -2.212 -15.070 601 HD3 MLZ 4 HD2 MLZ 4 -13.828 -2.558 -15.190 602 HE2 MLZ 4 HE1 MLZ 4 -13.628 -2.518 -17.685 603 HE3 MLZ 4 HE2 MLZ 4 -11.886 -2.319 -17.536 604 HZ MLZ 4 HZ1 MLZ 4 -13.501 -4.610 -16.432 605 HCM1 MLZ 4 HC1 MLZ 4 -12.295 -5.968 -18.017 606 HCM2 MLZ 4 HC2 MLZ 4 -13.131 -4.651 -18.863 607 HCM3 MLZ 4 HC3 MLZ 4 -11.398 -4.538 -18.532 608 HZ2 MLZ 4 HZ2 MLZ 4 -11.920 -4.445 -16.164 609 H GLN 5 HN GLN 5 -12.978 3.447 -16.836 610 HA GLN 5 HA GLN 5 -15.349 4.063 -15.114 611 HB2 GLN 5 HB1 GLN 5 -13.395 5.454 -14.741 612 HB3 GLN 5 HB2 GLN 5 -13.444 6.018 -16.413 613 HG2 GLN 5 HG1 GLN 5 -15.784 6.310 -14.478 614 HG3 GLN 5 HG2 GLN 5 -14.451 7.450 -14.498 615 HE21 GLN 5 HE21 GLN 5 -17.422 7.543 -15.271 616 HE22 GLN 5 HE22 GLN 5 -17.389 8.375 -16.842 617 H THR 6 HN THR 6 -16.911 3.153 -16.251 618 HA THR 6 HA THR 6 -17.135 2.955 -19.053 619 HB THR 6 HB THR 6 -19.747 2.680 -18.160 620 HG1 THR 6 HG1 THR 6 -19.196 2.881 -16.023 621 HG21 THR 6 HG21 THR 6 -18.399 1.178 -19.625 622 HG22 THR 6 HG22 THR 6 -17.592 0.547 -18.171 623 HG23 THR 6 HG23 THR 6 -19.356 0.351 -18.405 624 H ALA 7 HN ALA 7 -18.672 5.316 -16.888 625 HA ALA 7 HA ALA 7 -20.125 6.990 -17.141 626 HB1 ALA 7 HB1 ALA 7 -18.347 7.942 -18.593 627 HB2 ALA 7 HB2 ALA 7 -19.163 7.256 -20.010 628 HB3 ALA 7 HB3 ALA 7 -19.977 8.483 -19.031 629 H ARG 8 HN ARG 8 -20.490 4.524 -19.631 630 HA ARG 8 HA ARG 8 -23.203 5.113 -20.393 631 HB2 ARG 8 HB1 ARG 8 -21.585 2.541 -20.715 632 HB3 ARG 8 HB2 ARG 8 -23.120 2.926 -21.503 633 HG2 ARG 8 HG1 ARG 8 -21.925 4.975 -22.519 634 HG3 ARG 8 HG2 ARG 8 -20.425 4.252 -21.926 635 HD2 ARG 8 HD1 ARG 8 -20.539 3.482 -24.116 636 HD3 ARG 8 HD2 ARG 8 -21.144 2.109 -23.201 637 HE ARG 8 HE ARG 8 -22.722 4.045 -24.852 638 HH11 ARG 8 HH11 ARG 8 -22.826 0.909 -23.161 639 HH12 ARG 8 HH12 ARG 8 -24.347 0.533 -23.911 640 HH21 ARG 8 HH21 ARG 8 -24.635 3.427 -25.709 641 HH22 ARG 8 HH22 ARG 8 -25.331 1.891 -25.289 642 H TYR 9 HN TYR 9 -23.910 5.422 -18.125 643 HA TYR 9 HA TYR 9 -25.567 3.069 -17.406 644 HB2 TYR 9 HB1 TYR 9 -23.638 3.050 -15.853 645 HB3 TYR 9 HB2 TYR 9 -24.050 4.681 -15.335 646 HD1 TYR 9 HD1 TYR 9 -25.781 5.060 -13.701 647 HD2 TYR 9 HD2 TYR 9 -25.250 1.149 -15.439 648 HE1 TYR 9 HE1 TYR 9 -27.380 4.109 -12.041 649 HE2 TYR 9 HE2 TYR 9 -26.852 0.195 -13.774 650 HH TYR 9 HH TYR 9 -28.516 2.239 -11.349 Start of MODEL 18 1 H1 GLY 850 HT1 GLY 850 1.702 0.273 -3.101 2 H2 GLY 850 HT2 GLY 850 3.273 0.663 -3.362 3 H3 GLY 850 HT3 GLY 850 2.803 -0.905 -3.389 4 HA2 GLY 850 HA1 GLY 850 1.988 1.171 -5.322 5 HA3 GLY 850 HA2 GLY 850 3.158 -0.124 -5.634 6 H SER 851 HN SER 851 1.930 -0.972 -7.351 7 HA SER 851 HA SER 851 -0.193 -2.847 -6.578 8 HB2 SER 851 HB1 SER 851 -1.533 -0.845 -7.044 9 HB3 SER 851 HB2 SER 851 -0.683 -0.608 -8.577 10 HG SER 851 HG1 SER 851 -2.518 -2.650 -7.860 11 H ARG 852 HN ARG 852 -0.528 -4.490 -8.097 12 HA ARG 852 HA ARG 852 1.475 -5.265 -10.012 13 HB2 ARG 852 HB1 ARG 852 -0.113 -6.792 -8.864 14 HB3 ARG 852 HB2 ARG 852 -1.471 -5.987 -9.654 15 HG2 ARG 852 HG1 ARG 852 -0.544 -6.751 -11.876 16 HG3 ARG 852 HG2 ARG 852 0.670 -7.689 -10.997 17 HD2 ARG 852 HD1 ARG 852 -1.065 -9.042 -9.960 18 HD3 ARG 852 HD2 ARG 852 -2.328 -7.944 -10.505 19 HE ARG 852 HE ARG 852 -2.407 -8.943 -12.568 20 HH11 ARG 852 HH11 ARG 852 0.495 -10.235 -11.032 21 HH12 ARG 852 HH12 ARG 852 0.803 -11.272 -12.403 22 HH21 ARG 852 HH21 ARG 852 -1.823 -10.101 -14.263 23 HH22 ARG 852 HH22 ARG 852 -0.503 -11.268 -14.144 24 H ARG 853 HN ARG 853 -1.586 -3.485 -10.345 25 HA ARG 853 HA ARG 853 -1.126 -3.092 -13.293 26 HB2 ARG 853 HB1 ARG 853 -3.681 -3.580 -11.691 27 HB3 ARG 853 HB2 ARG 853 -3.645 -3.087 -13.380 28 HG2 ARG 853 HG1 ARG 853 -2.582 -5.709 -12.248 29 HG3 ARG 853 HG2 ARG 853 -4.065 -5.457 -13.145 30 HD2 ARG 853 HD1 ARG 853 -2.716 -6.287 -14.801 31 HD3 ARG 853 HD2 ARG 853 -2.543 -4.553 -15.052 32 HE ARG 853 HE ARG 853 -0.396 -4.792 -13.658 33 HH11 ARG 853 HH11 ARG 853 -1.373 -7.672 -15.489 34 HH12 ARG 853 HH12 ARG 853 0.293 -8.041 -15.818 35 HH21 ARG 853 HH21 ARG 853 1.561 -5.491 -13.902 36 HH22 ARG 853 HH22 ARG 853 1.919 -6.889 -14.889 37 H ALA 854 HN ALA 854 -2.108 -1.411 -10.381 38 HA ALA 854 HA ALA 854 -2.269 0.746 -9.839 39 HB1 ALA 854 HB1 ALA 854 -0.729 2.319 -10.831 40 HB2 ALA 854 HB2 ALA 854 0.044 0.732 -10.698 41 HB3 ALA 854 HB3 ALA 854 -0.549 1.304 -12.274 42 H SER 855 HN SER 855 -2.864 3.081 -10.524 43 HA SER 855 HA SER 855 -5.587 2.847 -11.237 44 HB2 SER 855 HB1 SER 855 -5.716 5.282 -11.096 45 HB3 SER 855 HB2 SER 855 -4.989 4.523 -9.703 46 HG SER 855 HG1 SER 855 -3.018 5.354 -10.259 47 H VAL 856 HN VAL 856 -6.841 3.914 -12.683 48 HA VAL 856 HA VAL 856 -5.883 3.883 -15.487 49 HB VAL 856 HB VAL 856 -7.948 2.680 -14.788 50 HG11 VAL 856 HG11 VAL 856 -8.926 4.371 -13.246 51 HG12 VAL 856 HG12 VAL 856 -9.229 5.441 -14.633 52 HG13 VAL 856 HG13 VAL 856 -10.049 3.874 -14.520 53 HG21 VAL 856 HG21 VAL 856 -9.201 3.165 -16.759 54 HG22 VAL 856 HG22 VAL 856 -8.487 4.775 -16.921 55 HG23 VAL 856 HG23 VAL 856 -7.483 3.316 -17.153 56 H GLY 857 HN GLY 857 -6.358 5.673 -16.945 57 HA2 GLY 857 HA1 GLY 857 -5.085 7.994 -16.099 58 HA3 GLY 857 HA2 GLY 857 -6.036 7.841 -17.582 59 H SER 858 HN SER 858 -8.607 7.651 -16.684 60 HA SER 858 HA SER 858 -9.285 9.698 -14.726 61 HB2 SER 858 HB1 SER 858 -8.675 11.068 -16.736 62 HB3 SER 858 HB2 SER 858 -9.956 10.245 -17.642 63 HG SER 858 HG1 SER 858 -11.472 11.274 -16.470 64 H GLU 859 HN GLU 859 -11.597 9.990 -14.524 65 HA GLU 859 HA GLU 859 -13.265 7.642 -15.211 66 HB2 GLU 859 HB1 GLU 859 -13.933 10.098 -13.537 67 HB3 GLU 859 HB2 GLU 859 -14.996 8.740 -13.864 68 HG2 GLU 859 HG1 GLU 859 -14.170 8.356 -11.714 69 HG3 GLU 859 HG2 GLU 859 -13.360 7.199 -12.761 70 H PHE 860 HN PHE 860 -15.323 7.973 -16.311 71 HA PHE 860 HA PHE 860 -15.357 10.229 -18.259 72 HB2 PHE 860 HB1 PHE 860 -17.055 7.729 -18.173 73 HB3 PHE 860 HB2 PHE 860 -17.133 8.995 -19.386 74 HD1 PHE 860 HD1 PHE 860 -13.790 9.092 -19.323 75 HD2 PHE 860 HD2 PHE 860 -16.877 6.169 -20.075 76 HE1 PHE 860 HE1 PHE 860 -12.248 7.835 -20.781 77 HE2 PHE 860 HE2 PHE 860 -15.321 4.914 -21.545 78 HZ PHE 860 HZ PHE 860 -13.004 5.742 -21.904 79 H THR 861 HN THR 861 -18.254 8.681 -16.879 80 HA THR 861 HA THR 861 -18.718 10.707 -14.911 81 HB THR 861 HB THR 861 -19.321 12.032 -16.918 82 HG1 THR 861 HG1 THR 861 -21.181 12.808 -16.031 83 HG21 THR 861 HG21 THR 861 -21.717 10.162 -17.156 84 HG22 THR 861 HG22 THR 861 -21.393 11.618 -18.119 85 HG23 THR 861 HG23 THR 861 -20.353 10.196 -18.299 86 H GLU 862 HN GLU 862 -20.805 10.548 -13.986 87 HA GLU 862 HA GLU 862 -22.119 9.518 -12.517 88 HB2 GLU 862 HB1 GLU 862 -23.342 9.896 -14.633 89 HB3 GLU 862 HB2 GLU 862 -23.165 8.172 -15.017 90 HG2 GLU 862 HG1 GLU 862 -24.356 7.567 -12.977 91 HG3 GLU 862 HG2 GLU 862 -24.438 9.249 -12.463 92 H SER 863 HN SER 863 -20.678 6.890 -14.388 93 HA SER 863 HA SER 863 -20.825 5.088 -12.015 94 HB2 SER 863 HB1 SER 863 -21.773 4.413 -14.811 95 HB3 SER 863 HB2 SER 863 -21.519 3.234 -13.508 96 HG SER 863 HG1 SER 863 -23.706 3.953 -13.631 97 H ALA 864 HN ALA 864 -19.455 3.237 -12.092 98 HA ALA 864 HA ALA 864 -17.304 3.117 -14.090 99 HB1 ALA 864 HB1 ALA 864 -16.479 4.795 -12.463 100 HB2 ALA 864 HB2 ALA 864 -16.815 3.666 -11.127 101 HB3 ALA 864 HB3 ALA 864 -15.544 3.302 -12.304 102 H TRP 865 HN TRP 865 -15.743 1.218 -13.464 103 HA TRP 865 HA TRP 865 -17.252 -0.969 -12.048 104 HB2 TRP 865 HB1 TRP 865 -14.914 -1.117 -13.934 105 HB3 TRP 865 HB2 TRP 865 -15.552 -2.474 -13.017 106 HD1 TRP 865 HD1 TRP 865 -16.845 0.103 -15.565 107 HE1 TRP 865 HE1 TRP 865 -18.775 -0.842 -16.888 108 HE3 TRP 865 HE3 TRP 865 -17.113 -4.454 -13.313 109 HZ2 TRP 865 HZ2 TRP 865 -20.244 -3.379 -17.025 110 HZ3 TRP 865 HZ3 TRP 865 -18.751 -6.187 -14.121 111 HH2 TRP 865 HH2 TRP 865 -20.328 -5.635 -15.941 112 H VAL 866 HN VAL 866 -15.814 -2.408 -10.762 113 HA VAL 866 HA VAL 866 -13.324 -1.217 -9.740 114 HB VAL 866 HB VAL 866 -14.907 -0.371 -8.141 115 HG11 VAL 866 HG11 VAL 866 -16.237 -1.763 -6.687 116 HG12 VAL 866 HG12 VAL 866 -16.675 -2.129 -8.357 117 HG13 VAL 866 HG13 VAL 866 -15.636 -3.247 -7.459 118 HG21 VAL 866 HG21 VAL 866 -13.892 -1.080 -6.111 119 HG22 VAL 866 HG22 VAL 866 -13.315 -2.590 -6.836 120 HG23 VAL 866 HG23 VAL 866 -12.649 -1.025 -7.368 121 H ARG 867 HN ARG 867 -11.774 -2.683 -9.287 122 HA ARG 867 HA ARG 867 -12.244 -5.555 -9.878 123 HB2 ARG 867 HB1 ARG 867 -10.224 -3.947 -10.611 124 HB3 ARG 867 HB2 ARG 867 -9.586 -4.365 -9.050 125 HG2 ARG 867 HG1 ARG 867 -9.657 -6.772 -9.700 126 HG3 ARG 867 HG2 ARG 867 -10.269 -6.312 -11.318 127 HD2 ARG 867 HD1 ARG 867 -8.266 -5.521 -12.039 128 HD3 ARG 867 HD2 ARG 867 -7.856 -4.842 -10.502 129 HE ARG 867 HE ARG 867 -6.901 -6.868 -9.759 130 HH11 ARG 867 HH11 ARG 867 -7.978 -7.298 -13.042 131 HH12 ARG 867 HH12 ARG 867 -6.668 -8.411 -13.392 132 HH21 ARG 867 HH21 ARG 867 -5.321 -8.336 -10.281 133 HH22 ARG 867 HH22 ARG 867 -5.156 -8.840 -11.951 134 H CYS 868 HN CYS 868 -12.158 -7.154 -8.320 135 HA CYS 868 HA CYS 868 -11.941 -6.543 -5.499 136 HB2 CYS 868 HB1 CYS 868 -13.305 -8.369 -6.332 137 HB3 CYS 868 HB2 CYS 868 -11.902 -9.118 -7.099 138 H ASP 869 HN ASP 869 -10.079 -5.997 -4.497 139 HA ASP 869 HA ASP 869 -7.430 -6.709 -5.482 140 HB2 ASP 869 HB1 ASP 869 -8.514 -5.426 -2.987 141 HB3 ASP 869 HB2 ASP 869 -6.901 -6.093 -2.924 142 H ASP 870 HN ASP 870 -9.690 -8.749 -3.881 143 HA ASP 870 HA ASP 870 -7.540 -10.332 -2.581 144 HB2 ASP 870 HB1 ASP 870 -9.672 -9.808 -1.366 145 HB3 ASP 870 HB2 ASP 870 -10.525 -10.853 -2.504 146 H CYS 871 HN CYS 871 -9.742 -10.448 -5.331 147 HA CYS 871 HA CYS 871 -8.070 -12.629 -6.398 148 HB2 CYS 871 HB1 CYS 871 -9.800 -13.773 -7.439 149 HB3 CYS 871 HB2 CYS 871 -10.201 -13.619 -5.743 150 H PHE 872 HN PHE 872 -10.521 -11.088 -8.185 151 HA PHE 872 HA PHE 872 -9.179 -8.892 -9.349 152 HB2 PHE 872 HB1 PHE 872 -8.678 -9.679 -11.593 153 HB3 PHE 872 HB2 PHE 872 -7.660 -10.440 -10.406 154 HD1 PHE 872 HD1 PHE 872 -10.402 -10.945 -12.844 155 HD2 PHE 872 HD2 PHE 872 -7.820 -12.879 -9.981 156 HE1 PHE 872 HE1 PHE 872 -11.047 -13.166 -13.757 157 HE2 PHE 872 HE2 PHE 872 -8.466 -15.095 -10.898 158 HZ PHE 872 HZ PHE 872 -10.081 -15.240 -12.786 159 H LYS 873 HN LYS 873 -11.836 -11.003 -9.289 160 HA LYS 873 HA LYS 873 -13.518 -10.534 -11.380 161 HB2 LYS 873 HB1 LYS 873 -13.811 -11.770 -9.111 162 HB3 LYS 873 HB2 LYS 873 -14.506 -10.233 -8.564 163 HG2 LYS 873 HG1 LYS 873 -15.605 -11.426 -11.075 164 HG3 LYS 873 HG2 LYS 873 -15.905 -12.277 -9.563 165 HD2 LYS 873 HD1 LYS 873 -16.480 -9.326 -9.716 166 HD3 LYS 873 HD2 LYS 873 -17.657 -10.486 -10.325 167 HE2 LYS 873 HE1 LYS 873 -16.429 -10.646 -7.604 168 HE3 LYS 873 HE2 LYS 873 -17.951 -9.786 -7.910 169 HZ1 LYS 873 HZ1 LYS 873 -17.419 -12.691 -8.164 170 HZ2 LYS 873 HZ2 LYS 873 -18.511 -11.936 -7.203 171 HZ3 LYS 873 HZ3 LYS 873 -18.741 -11.983 -8.843 172 H TRP 874 HN TRP 874 -15.053 -9.097 -12.042 173 HA TRP 874 HA TRP 874 -14.616 -6.304 -11.136 174 HB2 TRP 874 HB1 TRP 874 -15.641 -7.309 -13.833 175 HB3 TRP 874 HB2 TRP 874 -15.286 -5.655 -13.422 176 HD1 TRP 874 HD1 TRP 874 -13.523 -8.831 -14.446 177 HE1 TRP 874 HE1 TRP 874 -11.031 -8.315 -14.911 178 HE3 TRP 874 HE3 TRP 874 -13.332 -4.138 -12.491 179 HZ2 TRP 874 HZ2 TRP 874 -9.235 -6.128 -14.535 180 HZ3 TRP 874 HZ3 TRP 874 -11.169 -2.958 -12.377 181 HH2 TRP 874 HH2 TRP 874 -9.151 -3.838 -13.454 182 H ARG 875 HN ARG 875 -16.302 -4.823 -10.910 183 HA ARG 875 HA ARG 875 -19.109 -5.739 -11.094 184 HB2 ARG 875 HB1 ARG 875 -17.742 -4.846 -8.516 185 HB3 ARG 875 HB2 ARG 875 -19.477 -4.710 -8.734 186 HG2 ARG 875 HG1 ARG 875 -17.855 -7.285 -8.722 187 HG3 ARG 875 HG2 ARG 875 -18.965 -6.720 -7.495 188 HD2 ARG 875 HD1 ARG 875 -19.632 -7.793 -10.229 189 HD3 ARG 875 HD2 ARG 875 -20.115 -8.396 -8.665 190 HE ARG 875 HE ARG 875 -21.524 -6.270 -8.436 191 HH11 ARG 875 HH11 ARG 875 -20.765 -7.383 -11.696 192 HH12 ARG 875 HH12 ARG 875 -22.145 -6.467 -12.334 193 HH21 ARG 875 HH21 ARG 875 -23.272 -5.266 -9.429 194 HH22 ARG 875 HH22 ARG 875 -23.420 -5.422 -11.187 195 H ARG 876 HN ARG 876 -20.546 -4.185 -11.537 196 HA ARG 876 HA ARG 876 -19.554 -1.506 -12.257 197 HB2 ARG 876 HB1 ARG 876 -21.308 -3.172 -13.471 198 HB3 ARG 876 HB2 ARG 876 -22.458 -2.252 -12.515 199 HG2 ARG 876 HG1 ARG 876 -20.399 -1.137 -14.465 200 HG3 ARG 876 HG2 ARG 876 -22.099 -1.387 -14.830 201 HD2 ARG 876 HD1 ARG 876 -20.993 0.556 -12.768 202 HD3 ARG 876 HD2 ARG 876 -21.460 0.983 -14.395 203 HE ARG 876 HE ARG 876 -23.240 0.461 -12.124 204 HH11 ARG 876 HH11 ARG 876 -23.177 0.700 -15.656 205 HH12 ARG 876 HH12 ARG 876 -24.875 1.139 -15.682 206 HH21 ARG 876 HH21 ARG 876 -25.433 1.022 -12.376 207 HH22 ARG 876 HH22 ARG 876 -26.016 1.323 -14.010 208 H ILE 877 HN ILE 877 -19.691 0.194 -11.050 209 HA ILE 877 HA ILE 877 -21.550 0.377 -8.716 210 HB ILE 877 HB ILE 877 -19.732 1.431 -7.457 211 HG12 ILE 877 HG11 ILE 877 -17.899 0.745 -9.791 212 HG13 ILE 877 HG12 ILE 877 -18.453 2.365 -9.405 213 HG21 ILE 877 HG21 ILE 877 -20.154 -1.055 -7.388 214 HG22 ILE 877 HG22 ILE 877 -18.809 -1.263 -8.528 215 HG23 ILE 877 HG23 ILE 877 -18.524 -0.584 -6.907 216 HD11 ILE 877 HD1 ILE 877 -16.787 0.696 -7.494 217 HD12 ILE 877 HD2 ILE 877 -16.166 1.921 -8.609 218 HD13 ILE 877 HD3 ILE 877 -17.275 2.391 -7.316 219 HA PRO 878 HA PRO 878 -22.108 4.650 -10.216 220 HB2 PRO 878 HB1 PRO 878 -22.655 6.023 -7.941 221 HB3 PRO 878 HB2 PRO 878 -23.832 4.898 -8.686 222 HG2 PRO 878 HG1 PRO 878 -21.916 4.328 -6.405 223 HG3 PRO 878 HG2 PRO 878 -23.674 3.992 -6.472 224 HD2 PRO 878 HD1 PRO 878 -21.812 2.084 -7.035 225 HD3 PRO 878 HD2 PRO 878 -23.359 2.160 -7.928 226 H ALA 879 HN ALA 879 -20.711 6.410 -10.441 227 HA ALA 879 HA ALA 879 -17.985 6.191 -9.724 228 HB1 ALA 879 HB1 ALA 879 -19.617 8.639 -10.499 229 HB2 ALA 879 HB2 ALA 879 -17.846 8.511 -10.572 230 HB3 ALA 879 HB3 ALA 879 -18.842 7.493 -11.628 231 H SER 880 HN SER 880 -20.598 7.423 -7.769 232 HA SER 880 HA SER 880 -19.118 9.032 -5.896 233 HB2 SER 880 HB1 SER 880 -21.019 8.576 -4.388 234 HB3 SER 880 HB2 SER 880 -21.550 9.087 -6.002 235 HG SER 880 HG1 SER 880 -22.714 7.256 -5.188 236 H VAL 881 HN VAL 881 -19.330 5.536 -6.357 237 HA VAL 881 HA VAL 881 -17.957 4.989 -3.782 238 HB VAL 881 HB VAL 881 -18.944 3.151 -5.985 239 HG11 VAL 881 HG11 VAL 881 -18.391 1.252 -4.549 240 HG12 VAL 881 HG12 VAL 881 -16.914 2.132 -4.942 241 HG13 VAL 881 HG13 VAL 881 -17.670 2.335 -3.344 242 HG21 VAL 881 HG21 VAL 881 -20.695 4.119 -4.491 243 HG22 VAL 881 HG22 VAL 881 -20.534 2.369 -4.298 244 HG23 VAL 881 HG23 VAL 881 -19.834 3.467 -3.089 245 H VAL 882 HN VAL 882 -17.284 5.111 -7.277 246 HA VAL 882 HA VAL 882 -14.606 4.164 -6.879 247 HB VAL 882 HB VAL 882 -16.070 4.403 -9.093 248 HG11 VAL 882 HG11 VAL 882 -15.775 6.898 -9.300 249 HG12 VAL 882 HG12 VAL 882 -14.037 6.635 -9.500 250 HG13 VAL 882 HG13 VAL 882 -15.175 5.981 -10.684 251 HG21 VAL 882 HG21 VAL 882 -14.063 2.999 -8.793 252 HG22 VAL 882 HG22 VAL 882 -14.041 3.817 -10.358 253 HG23 VAL 882 HG23 VAL 882 -13.024 4.418 -9.032 254 H GLY 883 HN GLY 883 -15.996 7.249 -6.373 255 HA2 GLY 883 HA1 GLY 883 -13.460 8.725 -6.106 256 HA3 GLY 883 HA2 GLY 883 -15.078 9.273 -5.661 257 H SER 884 HN SER 884 -15.444 6.708 -4.019 258 HA SER 884 HA SER 884 -14.230 7.671 -1.500 259 HB2 SER 884 HB1 SER 884 -16.625 7.044 -1.645 260 HB3 SER 884 HB2 SER 884 -16.162 5.380 -2.029 261 HG SER 884 HG1 SER 884 -15.258 5.174 0.014 262 H ILE 885 HN ILE 885 -14.129 4.813 -3.613 263 HA ILE 885 HA ILE 885 -12.105 3.339 -2.124 264 HB ILE 885 HB ILE 885 -13.461 3.128 -4.813 265 HG12 ILE 885 HG11 ILE 885 -14.112 0.938 -4.106 266 HG13 ILE 885 HG12 ILE 885 -13.025 0.956 -2.716 267 HG21 ILE 885 HG21 ILE 885 -11.189 2.582 -5.446 268 HG22 ILE 885 HG22 ILE 885 -11.013 1.501 -4.041 269 HG23 ILE 885 HG23 ILE 885 -12.144 1.109 -5.362 270 HD11 ILE 885 HD1 ILE 885 -15.420 2.798 -2.993 271 HD12 ILE 885 HD2 ILE 885 -15.462 1.241 -2.166 272 HD13 ILE 885 HD3 ILE 885 -14.423 2.534 -1.543 273 H ASP 886 HN ASP 886 -10.064 3.931 -1.951 274 HA ASP 886 HA ASP 886 -8.697 5.682 -3.912 275 HB2 ASP 886 HB1 ASP 886 -7.629 4.252 -1.451 276 HB3 ASP 886 HB2 ASP 886 -6.735 5.389 -2.450 277 H GLU 887 HN GLU 887 -6.752 4.962 -5.061 278 HA GLU 887 HA GLU 887 -6.958 2.434 -6.348 279 HB2 GLU 887 HB1 GLU 887 -5.802 4.319 -7.342 280 HB3 GLU 887 HB2 GLU 887 -4.642 4.383 -6.021 281 HG2 GLU 887 HG1 GLU 887 -3.703 3.417 -8.105 282 HG3 GLU 887 HG2 GLU 887 -3.566 2.369 -6.706 283 H SER 888 HN SER 888 -5.212 3.362 -3.412 284 HA SER 888 HA SER 888 -3.905 0.765 -3.041 285 HB2 SER 888 HB1 SER 888 -3.156 1.801 -0.923 286 HB3 SER 888 HB2 SER 888 -2.804 2.818 -2.330 287 HG SER 888 HG1 SER 888 -3.731 4.009 -0.577 288 H SER 889 HN SER 889 -7.125 1.791 -2.533 289 HA SER 889 HA SER 889 -7.521 0.496 0.063 290 HB2 SER 889 HB1 SER 889 -8.842 2.487 -0.649 291 HB3 SER 889 HB2 SER 889 -9.628 1.453 -1.871 292 HG SER 889 HG1 SER 889 -9.809 1.364 0.949 293 H ARG 890 HN ARG 890 -8.733 -1.250 0.479 294 HA ARG 890 HA ARG 890 -8.584 -3.444 -1.547 295 HB2 ARG 890 HB1 ARG 890 -8.748 -3.546 1.488 296 HB3 ARG 890 HB2 ARG 890 -8.765 -4.957 0.417 297 HG2 ARG 890 HG1 ARG 890 -6.543 -4.320 -0.484 298 HG3 ARG 890 HG2 ARG 890 -6.489 -2.936 0.625 299 HD2 ARG 890 HD1 ARG 890 -6.640 -4.459 2.560 300 HD3 ARG 890 HD2 ARG 890 -6.719 -5.856 1.488 301 HE ARG 890 HE ARG 890 -4.359 -4.227 2.167 302 HH11 ARG 890 HH11 ARG 890 -5.546 -6.677 -0.047 303 HH12 ARG 890 HH12 ARG 890 -3.937 -7.185 -0.482 304 HH21 ARG 890 HH21 ARG 890 -2.347 -4.928 1.566 305 HH22 ARG 890 HH22 ARG 890 -2.179 -6.217 0.412 306 H TRP 891 HN TRP 891 -10.466 -2.420 -2.566 307 HA TRP 891 HA TRP 891 -13.109 -3.127 -1.448 308 HB2 TRP 891 HB1 TRP 891 -12.796 -1.277 -3.103 309 HB3 TRP 891 HB2 TRP 891 -12.385 -2.490 -4.318 310 HD1 TRP 891 HD1 TRP 891 -15.167 -0.708 -2.726 311 HE1 TRP 891 HE1 TRP 891 -17.433 -1.425 -3.616 312 HE3 TRP 891 HE3 TRP 891 -13.721 -4.983 -5.168 313 HZ2 TRP 891 HZ2 TRP 891 -18.558 -3.776 -4.878 314 HZ3 TRP 891 HZ3 TRP 891 -15.472 -6.489 -6.144 315 HH2 TRP 891 HH2 TRP 891 -17.853 -5.916 -5.933 316 H ILE 892 HN ILE 892 -14.012 -5.155 -1.608 317 HA ILE 892 HA ILE 892 -12.865 -7.157 -3.475 318 HB ILE 892 HB ILE 892 -12.693 -8.822 -1.751 319 HG12 ILE 892 HG11 ILE 892 -13.288 -6.740 0.377 320 HG13 ILE 892 HG12 ILE 892 -14.521 -7.824 -0.271 321 HG21 ILE 892 HG21 ILE 892 -10.719 -8.031 -0.548 322 HG22 ILE 892 HG22 ILE 892 -10.703 -7.409 -2.206 323 HG23 ILE 892 HG23 ILE 892 -11.151 -6.352 -0.850 324 HD11 ILE 892 HD1 ILE 892 -13.339 -9.797 0.373 325 HD12 ILE 892 HD2 ILE 892 -12.028 -8.825 1.112 326 HD13 ILE 892 HD3 ILE 892 -13.671 -8.757 1.776 327 H CYS 893 HN CYS 893 -14.178 -9.107 -3.735 328 HA CYS 893 HA CYS 893 -16.855 -8.745 -4.209 329 HB2 CYS 893 HB1 CYS 893 -15.545 -11.366 -3.373 330 HB3 CYS 893 HB2 CYS 893 -17.048 -11.128 -4.286 331 H MET 894 HN MET 894 -15.492 -9.955 -1.042 332 HA MET 894 HA MET 894 -18.070 -10.711 -0.009 333 HB2 MET 894 HB1 MET 894 -16.183 -11.716 0.915 334 HB3 MET 894 HB2 MET 894 -15.357 -10.197 1.196 335 HG2 MET 894 HG1 MET 894 -17.852 -10.913 2.727 336 HG3 MET 894 HG2 MET 894 -16.243 -11.471 3.194 337 HE1 MET 894 HE1 MET 894 -17.054 -8.754 5.898 338 HE2 MET 894 HE2 MET 894 -18.229 -9.811 5.087 339 HE3 MET 894 HE3 MET 894 -16.655 -10.461 5.604 340 H ASN 895 HN ASN 895 -16.509 -7.605 -0.249 341 HA ASN 895 HA ASN 895 -18.285 -6.242 1.659 342 HB2 ASN 895 HB1 ASN 895 -16.517 -4.908 1.807 343 HB3 ASN 895 HB2 ASN 895 -15.678 -5.803 0.555 344 HD21 ASN 895 HD21 ASN 895 -16.372 -5.165 -1.801 345 HD22 ASN 895 HD22 ASN 895 -16.524 -3.428 -2.036 346 H ASN 896 HN ASN 896 -18.505 -7.189 -1.599 347 HA ASN 896 HA ASN 896 -19.600 -5.007 -2.932 348 HB2 ASN 896 HB1 ASN 896 -18.860 -7.142 -3.972 349 HB3 ASN 896 HB2 ASN 896 -20.267 -7.947 -3.269 350 HD21 ASN 896 HD21 ASN 896 -20.541 -8.609 -5.536 351 HD22 ASN 896 HD22 ASN 896 -21.627 -7.573 -6.443 352 H SER 897 HN SER 897 -21.454 -4.024 -3.074 353 HA SER 897 HA SER 897 -23.658 -4.244 -1.253 354 HB2 SER 897 HB1 SER 897 -23.286 -2.958 -3.984 355 HB3 SER 897 HB2 SER 897 -24.828 -2.923 -3.141 356 HG SER 897 HG1 SER 897 -22.324 -1.886 -2.214 357 H ASP 898 HN ASP 898 -23.204 -5.544 -4.512 358 HA ASP 898 HA ASP 898 -25.957 -6.560 -4.639 359 HB2 ASP 898 HB1 ASP 898 -23.775 -7.094 -6.641 360 HB3 ASP 898 HB2 ASP 898 -25.509 -7.201 -6.877 361 H LYS 899 HN LYS 899 -26.296 -8.134 -3.287 362 HA LYS 899 HA LYS 899 -24.614 -10.242 -2.482 363 HB2 LYS 899 HB1 LYS 899 -27.661 -10.120 -2.520 364 HB3 LYS 899 HB2 LYS 899 -26.699 -11.277 -1.604 365 HG2 LYS 899 HG1 LYS 899 -26.286 -8.296 -1.189 366 HG3 LYS 899 HG2 LYS 899 -27.618 -9.145 -0.405 367 HD2 LYS 899 HD1 LYS 899 -24.822 -10.232 -0.204 368 HD3 LYS 899 HD2 LYS 899 -25.369 -8.938 0.881 369 HE2 LYS 899 HE1 LYS 899 -27.017 -11.443 0.477 370 HE3 LYS 899 HE2 LYS 899 -25.633 -11.470 1.589 371 HZ1 LYS 899 HZ1 LYS 899 -26.673 -9.656 2.831 372 HZ2 LYS 899 HZ2 LYS 899 -27.954 -9.624 1.815 373 HZ3 LYS 899 HZ3 LYS 899 -27.688 -10.929 2.756 374 H ARG 900 HN ARG 900 -26.298 -9.995 -5.439 375 HA ARG 900 HA ARG 900 -26.419 -12.798 -6.240 376 HB2 ARG 900 HB1 ARG 900 -26.339 -10.148 -7.752 377 HB3 ARG 900 HB2 ARG 900 -26.408 -11.712 -8.563 378 HG2 ARG 900 HG1 ARG 900 -28.527 -12.247 -7.374 379 HG3 ARG 900 HG2 ARG 900 -28.483 -10.658 -6.587 380 HD2 ARG 900 HD1 ARG 900 -28.559 -9.561 -8.829 381 HD3 ARG 900 HD2 ARG 900 -28.582 -11.147 -9.595 382 HE ARG 900 HE ARG 900 -30.806 -11.474 -8.981 383 HH11 ARG 900 HH11 ARG 900 -29.740 -8.474 -7.504 384 HH12 ARG 900 HH12 ARG 900 -31.365 -8.007 -7.084 385 HH21 ARG 900 HH21 ARG 900 -32.839 -10.809 -8.420 386 HH22 ARG 900 HH22 ARG 900 -33.067 -9.296 -7.592 387 H PHE 901 HN PHE 901 -23.836 -10.450 -6.101 388 HA PHE 901 HA PHE 901 -21.984 -12.416 -7.358 389 HB2 PHE 901 HB1 PHE 901 -21.806 -9.426 -7.748 390 HB3 PHE 901 HB2 PHE 901 -20.933 -10.661 -8.636 391 HD1 PHE 901 HD1 PHE 901 -24.044 -8.750 -8.310 392 HD2 PHE 901 HD2 PHE 901 -22.047 -11.833 -10.567 393 HE1 PHE 901 HE1 PHE 901 -25.719 -8.515 -10.123 394 HE2 PHE 901 HE2 PHE 901 -23.727 -11.607 -12.362 395 HZ PHE 901 HZ PHE 901 -25.572 -9.952 -12.148 396 H ALA 902 HN ALA 902 -22.486 -11.314 -4.489 397 HA ALA 902 HA ALA 902 -20.002 -10.007 -3.794 398 HB1 ALA 902 HB1 ALA 902 -22.229 -9.260 -2.918 399 HB2 ALA 902 HB2 ALA 902 -22.394 -10.815 -2.067 400 HB3 ALA 902 HB3 ALA 902 -21.116 -9.672 -1.611 401 H ASP 903 HN ASP 903 -19.406 -12.493 -4.667 402 HA ASP 903 HA ASP 903 -17.621 -13.282 -2.479 403 HB2 ASP 903 HB1 ASP 903 -19.637 -15.178 -3.662 404 HB3 ASP 903 HB2 ASP 903 -18.076 -15.766 -3.096 405 H CYS 904 HN CYS 904 -15.685 -14.133 -3.131 406 HA CYS 904 HA CYS 904 -14.695 -13.677 -5.728 407 HB2 CYS 904 HB1 CYS 904 -13.748 -15.526 -3.483 408 HB3 CYS 904 HB2 CYS 904 -12.786 -15.030 -4.876 409 H SER 905 HN SER 905 -16.658 -16.235 -4.556 410 HA SER 905 HA SER 905 -15.993 -18.237 -6.641 411 HB2 SER 905 HB1 SER 905 -18.149 -18.246 -4.500 412 HB3 SER 905 HB2 SER 905 -17.702 -19.592 -5.568 413 HG SER 905 HG1 SER 905 -16.689 -19.753 -3.507 414 H LYS 906 HN LYS 906 -18.185 -15.567 -6.212 415 HA LYS 906 HA LYS 906 -20.223 -16.565 -8.114 416 HB2 LYS 906 HB1 LYS 906 -19.782 -14.012 -6.546 417 HB3 LYS 906 HB2 LYS 906 -20.968 -14.098 -7.841 418 HG2 LYS 906 HG1 LYS 906 -21.036 -15.686 -5.259 419 HG3 LYS 906 HG2 LYS 906 -22.009 -14.283 -5.707 420 HD2 LYS 906 HD1 LYS 906 -23.531 -15.907 -6.140 421 HD3 LYS 906 HD2 LYS 906 -22.773 -15.841 -7.734 422 HE2 LYS 906 HE1 LYS 906 -21.317 -17.796 -7.054 423 HE3 LYS 906 HE2 LYS 906 -22.107 -17.804 -5.477 424 HZ1 LYS 906 HZ1 LYS 906 -23.106 -19.431 -6.973 425 HZ2 LYS 906 HZ2 LYS 906 -24.212 -18.294 -6.599 426 HZ3 LYS 906 HZ3 LYS 906 -23.491 -18.283 -8.066 427 H SER 907 HN SER 907 -20.937 -14.970 -9.772 428 HA SER 907 HA SER 907 -18.688 -14.709 -11.684 429 HB2 SER 907 HB1 SER 907 -20.655 -16.173 -12.150 430 HB3 SER 907 HB2 SER 907 -21.674 -14.723 -12.219 431 HG SER 907 HG1 SER 907 -20.854 -15.486 -14.287 432 H GLN 908 HN GLN 908 -20.039 -12.971 -13.467 433 HA GLN 908 HA GLN 908 -20.620 -10.410 -12.227 434 HB2 GLN 908 HB1 GLN 908 -18.862 -9.118 -13.086 435 HB3 GLN 908 HB2 GLN 908 -18.096 -10.516 -12.339 436 HG2 GLN 908 HG1 GLN 908 -18.116 -11.513 -14.768 437 HG3 GLN 908 HG2 GLN 908 -18.410 -9.847 -15.236 438 HE21 GLN 908 HE21 GLN 908 -16.427 -9.719 -16.352 439 HE22 GLN 908 HE22 GLN 908 -14.850 -9.887 -15.583 440 H GLU 909 HN GLU 909 -21.295 -8.788 -13.847 441 HA GLU 909 HA GLU 909 -23.236 -9.963 -15.560 442 HB2 GLU 909 HB1 GLU 909 -22.269 -7.105 -15.234 443 HB3 GLU 909 HB2 GLU 909 -23.646 -7.551 -16.249 444 HG2 GLU 909 HG1 GLU 909 -24.859 -8.469 -14.356 445 HG3 GLU 909 HG2 GLU 909 -23.473 -8.250 -13.290 446 H MET 910 HN MET 910 -19.983 -8.897 -16.389 447 HA MET 910 HA MET 910 -20.403 -9.881 -19.171 448 HB2 MET 910 HB1 MET 910 -19.305 -7.115 -18.518 449 HB3 MET 910 HB2 MET 910 -19.040 -7.935 -20.050 450 HG2 MET 910 HG1 MET 910 -21.798 -7.256 -18.981 451 HG3 MET 910 HG2 MET 910 -20.867 -6.247 -20.083 452 HE1 MET 910 HE1 MET 910 -23.831 -7.213 -20.668 453 HE2 MET 910 HE2 MET 910 -22.890 -6.174 -21.764 454 HE3 MET 910 HE3 MET 910 -23.706 -7.622 -22.394 455 H SER 911 HN SER 911 -18.650 -11.015 -19.942 456 HA SER 911 HA SER 911 -16.395 -11.614 -18.253 457 HB2 SER 911 HB1 SER 911 -16.269 -11.933 -21.229 458 HB3 SER 911 HB2 SER 911 -15.571 -12.944 -19.971 459 HG SER 911 HG1 SER 911 -17.408 -13.944 -20.918 460 H ASN 912 HN ASN 912 -14.130 -11.215 -18.742 461 HA ASN 912 HA ASN 912 -13.777 -8.446 -18.458 462 HB2 ASN 912 HB1 ASN 912 -11.640 -10.557 -19.060 463 HB3 ASN 912 HB2 ASN 912 -11.313 -8.928 -18.467 464 HD21 ASN 912 HD21 ASN 912 -10.228 -10.808 -16.928 465 HD22 ASN 912 HD22 ASN 912 -11.186 -10.968 -15.464 466 H GLU 913 HN GLU 913 -13.398 -10.349 -21.361 467 HA GLU 913 HA GLU 913 -12.236 -8.200 -22.987 468 HB2 GLU 913 HB1 GLU 913 -11.703 -10.597 -23.262 469 HB3 GLU 913 HB2 GLU 913 -13.373 -10.916 -23.751 470 HG2 GLU 913 HG1 GLU 913 -13.091 -9.642 -25.785 471 HG3 GLU 913 HG2 GLU 913 -11.571 -8.946 -25.207 472 H GLU 914 HN GLU 914 -15.433 -9.005 -22.013 473 HA GLU 914 HA GLU 914 -16.757 -7.646 -24.304 474 HB2 GLU 914 HB1 GLU 914 -17.952 -8.942 -21.819 475 HB3 GLU 914 HB2 GLU 914 -18.847 -8.291 -23.179 476 HG2 GLU 914 HG1 GLU 914 -16.997 -10.711 -23.184 477 HG3 GLU 914 HG2 GLU 914 -18.751 -10.731 -23.251 478 H ILE 915 HN ILE 915 -16.264 -7.248 -20.733 479 HA ILE 915 HA ILE 915 -17.471 -4.625 -20.735 480 HB ILE 915 HB ILE 915 -17.485 -5.530 -18.648 481 HG12 ILE 915 HG11 ILE 915 -16.183 -4.090 -17.176 482 HG13 ILE 915 HG12 ILE 915 -15.085 -3.663 -18.491 483 HG21 ILE 915 HG21 ILE 915 -15.484 -6.262 -17.308 484 HG22 ILE 915 HG22 ILE 915 -16.022 -7.317 -18.586 485 HG23 ILE 915 HG23 ILE 915 -14.590 -6.302 -18.865 486 HD11 ILE 915 HD1 ILE 915 -16.930 -2.509 -19.657 487 HD12 ILE 915 HD2 ILE 915 -18.054 -3.023 -18.417 488 HD13 ILE 915 HD3 ILE 915 -16.695 -1.907 -18.044 489 H ASN 916 HN ASN 916 -13.937 -5.440 -20.775 490 HA ASN 916 HA ASN 916 -13.143 -2.755 -20.909 491 HB2 ASN 916 HB1 ASN 916 -10.975 -3.487 -21.511 492 HB3 ASN 916 HB2 ASN 916 -11.655 -4.672 -20.420 493 HD21 ASN 916 HD21 ASN 916 -9.679 -5.754 -21.424 494 HD22 ASN 916 HD22 ASN 916 -9.974 -6.720 -22.862 495 H GLU 917 HN GLU 917 -14.197 -4.685 -23.639 496 HA GLU 917 HA GLU 917 -13.696 -2.857 -25.766 497 HB2 GLU 917 HB1 GLU 917 -15.455 -5.200 -25.246 498 HB3 GLU 917 HB2 GLU 917 -15.946 -4.124 -26.551 499 HG2 GLU 917 HG1 GLU 917 -13.643 -4.305 -27.533 500 HG3 GLU 917 HG2 GLU 917 -13.213 -5.455 -26.269 501 H GLU 918 HN GLU 918 -16.331 -2.893 -23.411 502 HA GLU 918 HA GLU 918 -18.163 -1.105 -24.666 503 HB2 GLU 918 HB1 GLU 918 -18.434 -2.533 -22.538 504 HB3 GLU 918 HB2 GLU 918 -17.642 -1.212 -21.661 505 HG2 GLU 918 HG1 GLU 918 -19.414 0.336 -22.175 506 HG3 GLU 918 HG2 GLU 918 -20.112 -0.755 -23.369 507 H LEU 919 HN LEU 919 -15.225 -0.466 -22.813 508 HA LEU 919 HA LEU 919 -15.596 2.475 -23.046 509 HB2 LEU 919 HB1 LEU 919 -13.283 1.096 -21.677 510 HB3 LEU 919 HB2 LEU 919 -13.845 2.742 -21.507 511 HG LEU 919 HG LEU 919 -16.087 1.393 -20.677 512 HD11 LEU 919 HD11 LEU 919 -15.045 -0.822 -20.828 513 HD12 LEU 919 HD12 LEU 919 -13.673 -0.290 -19.850 514 HD13 LEU 919 HD13 LEU 919 -15.289 -0.417 -19.131 515 HD21 LEU 919 HD21 LEU 919 -13.689 2.210 -19.022 516 HD22 LEU 919 HD22 LEU 919 -15.099 3.206 -19.457 517 HD23 LEU 919 HD23 LEU 919 -15.320 1.802 -18.389 518 H GLY 920 HN GLY 920 -13.529 -0.157 -24.184 519 HA2 GLY 920 HA1 GLY 920 -12.443 -0.205 -26.303 520 HA3 GLY 920 HA2 GLY 920 -12.401 1.559 -26.354 521 H ILE 921 HN ILE 921 -11.405 -0.691 -23.764 522 HA ILE 921 HA ILE 921 -8.601 0.352 -23.841 523 HB ILE 921 HB ILE 921 -8.617 0.597 -21.436 524 HG12 ILE 921 HG11 ILE 921 -11.535 -0.266 -21.546 525 HG13 ILE 921 HG12 ILE 921 -10.197 -1.099 -20.756 526 HG21 ILE 921 HG21 ILE 921 -10.948 2.162 -22.586 527 HG22 ILE 921 HG22 ILE 921 -9.830 2.644 -21.290 528 HG23 ILE 921 HG23 ILE 921 -9.231 2.479 -22.940 529 HD11 ILE 921 HD1 ILE 921 -11.387 -0.006 -19.023 530 HD12 ILE 921 HD2 ILE 921 -9.917 0.956 -19.266 531 HD13 ILE 921 HD3 ILE 921 -11.470 1.525 -19.913 532 H GLY 922 HN GLY 922 -7.286 -0.959 -22.019 533 HA2 GLY 922 HA1 GLY 922 -7.731 -3.848 -22.396 534 HA3 GLY 922 HA2 GLY 922 -6.143 -3.080 -22.416 535 H GLN 923 HN GLN 923 -6.428 -4.908 -20.864 536 HA GLN 923 HA GLN 923 -6.564 -4.093 -18.032 537 HB2 GLN 923 HB1 GLN 923 -8.789 -5.277 -19.379 538 HB3 GLN 923 HB2 GLN 923 -8.038 -6.613 -18.549 539 HG2 GLN 923 HG1 GLN 923 -9.456 -5.861 -16.926 540 HG3 GLN 923 HG2 GLN 923 -7.964 -5.039 -16.482 541 HE21 GLN 923 HE21 GLN 923 -8.878 -3.189 -15.483 542 HE22 GLN 923 HE22 GLN 923 -9.885 -2.059 -16.386 543 H ASP 924 HN ASP 924 -6.236 -6.145 -16.622 544 HA ASP 924 HA ASP 924 -3.787 -7.561 -17.162 545 HB2 ASP 924 HB1 ASP 924 -5.087 -6.934 -14.951 546 HB3 ASP 924 HB2 ASP 924 -6.003 -8.402 -15.259 547 H GLU 925 HN GLU 925 -7.035 -8.138 -18.092 548 HA GLU 925 HA GLU 925 -8.232 -9.651 -19.139 549 HB2 GLU 925 HB1 GLU 925 -6.249 -9.455 -20.679 550 HB3 GLU 925 HB2 GLU 925 -5.689 -11.005 -20.089 551 HG2 GLU 925 HG1 GLU 925 -8.472 -10.522 -21.217 552 HG3 GLU 925 HG2 GLU 925 -7.091 -10.927 -22.229 553 H ALA 926 HN ALA 926 -5.589 -11.541 -17.793 554 HA ALA 926 HA ALA 926 -7.155 -12.826 -15.761 555 HB1 ALA 926 HB1 ALA 926 -8.092 -14.156 -17.618 556 HB2 ALA 926 HB2 ALA 926 -6.457 -14.608 -18.141 557 HB3 ALA 926 HB3 ALA 926 -7.081 -15.160 -16.571 558 H ASP 927 HN ASP 927 -4.340 -13.408 -17.882 559 HA ASP 927 HA ASP 927 -2.297 -14.233 -17.567 560 HB2 ASP 927 HB1 ASP 927 -2.143 -12.009 -16.349 561 HB3 ASP 927 HB2 ASP 927 -2.261 -12.914 -14.843 562 H ALA 928 HN ALA 928 -4.680 -15.730 -16.366 563 HA ALA 928 HA ALA 928 -3.714 -17.482 -14.314 564 HB1 ALA 928 HB1 ALA 928 -6.101 -17.061 -14.742 565 HB2 ALA 928 HB2 ALA 928 -5.966 -17.834 -16.341 566 HB3 ALA 928 HB3 ALA 928 -5.731 -18.791 -14.865 567 H1 ALA 1 HT1 ALA 1 -5.080 -2.355 -6.970 568 H2 ALA 1 HT2 ALA 1 -5.874 -1.463 -5.846 569 H3 ALA 1 HT3 ALA 1 -5.232 -0.728 -7.165 570 HA ALA 1 HA ALA 1 -7.342 -2.749 -7.243 571 HB1 ALA 1 HB1 ALA 1 -7.751 0.246 -7.405 572 HB2 ALA 1 HB2 ALA 1 -8.977 -1.011 -7.698 573 HB3 ALA 1 HB3 ALA 1 -8.251 -0.850 -6.095 574 H ARG 2 HN ARG 2 -6.472 0.051 -9.373 575 HA ARG 2 HA ARG 2 -6.689 0.310 -11.587 576 HB2 ARG 2 HB1 ARG 2 -4.974 -1.372 -12.035 577 HB3 ARG 2 HB2 ARG 2 -6.119 -2.672 -11.833 578 HG2 ARG 2 HG1 ARG 2 -5.696 -2.383 -14.178 579 HG3 ARG 2 HG2 ARG 2 -7.364 -2.068 -13.792 580 HD2 ARG 2 HD1 ARG 2 -6.365 0.497 -13.694 581 HD3 ARG 2 HD2 ARG 2 -5.253 -0.215 -14.841 582 HE ARG 2 HE ARG 2 -8.179 0.235 -15.142 583 HH11 ARG 2 HH11 ARG 2 -5.437 -1.394 -16.667 584 HH12 ARG 2 HH12 ARG 2 -6.321 -1.513 -18.181 585 HH21 ARG 2 HH21 ARG 2 -9.023 0.258 -17.157 586 HH22 ARG 2 HH22 ARG 2 -8.255 -0.705 -18.418 587 H THR 3 HN THR 3 -8.565 0.747 -12.749 588 HA THR 3 HA THR 3 -10.330 -1.414 -13.313 589 HB THR 3 HB THR 3 -11.079 -0.806 -10.946 590 HG1 THR 3 HG1 THR 3 -12.590 -1.817 -12.090 591 HG21 THR 3 HG21 THR 3 -12.212 1.727 -12.191 592 HG22 THR 3 HG22 THR 3 -12.335 1.172 -10.515 593 HG23 THR 3 HG23 THR 3 -10.768 1.680 -11.154 594 H MLZ 4 HN MLZ 4 -12.721 -0.004 -13.889 595 HA MLZ 4 HA MLZ 4 -11.979 1.596 -16.279 596 HB2 MLZ 4 HB1 MLZ 4 -14.389 -0.226 -16.408 597 HB3 MLZ 4 HB2 MLZ 4 -13.358 0.389 -17.670 598 HG2 MLZ 4 HG1 MLZ 4 -12.768 -1.735 -17.865 599 HG3 MLZ 4 HG2 MLZ 4 -11.585 -1.320 -16.622 600 HD2 MLZ 4 HD1 MLZ 4 -13.177 -2.166 -14.894 601 HD3 MLZ 4 HD2 MLZ 4 -14.358 -2.522 -16.151 602 HE2 MLZ 4 HE1 MLZ 4 -11.732 -3.937 -15.566 603 HE3 MLZ 4 HE2 MLZ 4 -13.369 -4.559 -15.422 604 HZ MLZ 4 HZ1 MLZ 4 -11.921 -3.974 -17.963 605 HCM1 MLZ 4 HC1 MLZ 4 -12.241 -6.349 -18.313 606 HCM2 MLZ 4 HC2 MLZ 4 -11.473 -6.077 -16.736 607 HCM3 MLZ 4 HC3 MLZ 4 -13.195 -6.420 -16.811 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.531 -4.285 -17.928 609 H GLN 5 HN GLN 5 -14.075 2.670 -17.138 610 HA GLN 5 HA GLN 5 -15.562 3.962 -14.901 611 HB2 GLN 5 HB1 GLN 5 -14.883 6.088 -15.675 612 HB3 GLN 5 HB2 GLN 5 -13.502 5.128 -15.184 613 HG2 GLN 5 HG1 GLN 5 -14.294 5.395 -18.127 614 HG3 GLN 5 HG2 GLN 5 -13.330 6.614 -17.334 615 HE21 GLN 5 HE21 GLN 5 -12.211 5.560 -19.489 616 HE22 GLN 5 HE22 GLN 5 -10.937 4.429 -19.039 617 H THR 6 HN THR 6 -16.986 2.280 -16.480 618 HA THR 6 HA THR 6 -17.918 3.217 -18.963 619 HB THR 6 HB THR 6 -19.974 1.840 -18.587 620 HG1 THR 6 HG1 THR 6 -19.910 1.950 -16.301 621 HG21 THR 6 HG21 THR 6 -18.798 -0.307 -18.717 622 HG22 THR 6 HG22 THR 6 -18.054 0.915 -19.741 623 HG23 THR 6 HG23 THR 6 -17.290 0.479 -18.189 624 H ALA 7 HN ALA 7 -19.059 4.888 -19.562 625 HA ALA 7 HA ALA 7 -20.731 6.452 -17.746 626 HB1 ALA 7 HB1 ALA 7 -19.291 7.502 -19.455 627 HB2 ALA 7 HB2 ALA 7 -20.217 6.695 -20.745 628 HB3 ALA 7 HB3 ALA 7 -20.997 7.911 -19.710 629 H ARG 8 HN ARG 8 -21.326 3.692 -19.654 630 HA ARG 8 HA ARG 8 -24.130 4.155 -20.302 631 HB2 ARG 8 HB1 ARG 8 -22.557 2.658 -21.620 632 HB3 ARG 8 HB2 ARG 8 -22.572 1.532 -20.271 633 HG2 ARG 8 HG1 ARG 8 -25.102 1.375 -20.500 634 HG3 ARG 8 HG2 ARG 8 -25.005 2.495 -21.863 635 HD2 ARG 8 HD1 ARG 8 -25.182 0.288 -22.765 636 HD3 ARG 8 HD2 ARG 8 -23.540 0.848 -23.058 637 HE ARG 8 HE ARG 8 -22.728 -0.572 -21.257 638 HH11 ARG 8 HH11 ARG 8 -26.134 -1.204 -21.804 639 HH12 ARG 8 HH12 ARG 8 -26.008 -2.822 -21.170 640 HH21 ARG 8 HH21 ARG 8 -22.584 -2.653 -20.750 641 HH22 ARG 8 HH22 ARG 8 -24.037 -3.605 -20.497 642 H TYR 9 HN TYR 9 -24.710 4.911 -18.235 643 HA TYR 9 HA TYR 9 -24.795 3.469 -15.826 644 HB2 TYR 9 HB1 TYR 9 -26.568 5.018 -15.150 645 HB3 TYR 9 HB2 TYR 9 -25.182 5.811 -15.861 646 HD1 TYR 9 HD1 TYR 9 -28.760 4.982 -16.323 647 HD2 TYR 9 HD2 TYR 9 -25.351 7.058 -17.957 648 HE1 TYR 9 HE1 TYR 9 -30.261 6.228 -17.883 649 HE2 TYR 9 HE2 TYR 9 -26.844 8.285 -19.523 650 HH TYR 9 HH TYR 9 -28.994 8.622 -20.233 Start of MODEL 19 1 H1 GLY 850 HT1 GLY 850 2.705 -11.885 -4.400 2 H2 GLY 850 HT2 GLY 850 4.075 -11.790 -5.292 3 H3 GLY 850 HT3 GLY 850 3.209 -13.181 -5.267 4 HA2 GLY 850 HA1 GLY 850 2.839 -12.017 -7.343 5 HA3 GLY 850 HA2 GLY 850 1.354 -12.145 -6.382 6 H SER 851 HN SER 851 2.402 -10.116 -8.435 7 HA SER 851 HA SER 851 2.687 -7.603 -6.969 8 HB2 SER 851 HB1 SER 851 2.930 -6.610 -9.126 9 HB3 SER 851 HB2 SER 851 3.805 -8.146 -9.162 10 HG SER 851 HG1 SER 851 2.558 -7.997 -11.016 11 H ARG 852 HN ARG 852 1.324 -5.718 -7.687 12 HA ARG 852 HA ARG 852 -1.500 -6.019 -7.198 13 HB2 ARG 852 HB1 ARG 852 -1.601 -3.637 -7.549 14 HB3 ARG 852 HB2 ARG 852 -0.135 -4.018 -6.644 15 HG2 ARG 852 HG1 ARG 852 1.157 -3.885 -8.836 16 HG3 ARG 852 HG2 ARG 852 -0.333 -3.302 -9.600 17 HD2 ARG 852 HD1 ARG 852 -0.391 -1.433 -7.924 18 HD3 ARG 852 HD2 ARG 852 1.166 -1.973 -7.296 19 HE ARG 852 HE ARG 852 0.612 -0.606 -9.860 20 HH11 ARG 852 HH11 ARG 852 3.149 -2.265 -8.078 21 HH12 ARG 852 HH12 ARG 852 4.384 -1.608 -9.118 22 HH21 ARG 852 HH21 ARG 852 2.148 0.165 -11.064 23 HH22 ARG 852 HH22 ARG 852 3.830 -0.241 -10.792 24 H ARG 853 HN ARG 853 0.131 -6.807 -9.958 25 HA ARG 853 HA ARG 853 -0.332 -7.348 -12.079 26 HB2 ARG 853 HB1 ARG 853 -3.290 -7.019 -11.513 27 HB3 ARG 853 HB2 ARG 853 -2.526 -7.969 -12.776 28 HG2 ARG 853 HG1 ARG 853 -2.454 -8.539 -9.779 29 HG3 ARG 853 HG2 ARG 853 -3.357 -9.411 -11.004 30 HD2 ARG 853 HD1 ARG 853 -1.167 -10.048 -12.100 31 HD3 ARG 853 HD2 ARG 853 -0.325 -9.276 -10.756 32 HE ARG 853 HE ARG 853 -0.921 -11.010 -9.322 33 HH11 ARG 853 HH11 ARG 853 -2.698 -11.436 -12.328 34 HH12 ARG 853 HH12 ARG 853 -3.145 -13.063 -11.963 35 HH21 ARG 853 HH21 ARG 853 -1.545 -13.130 -8.890 36 HH22 ARG 853 HH22 ARG 853 -2.501 -13.996 -10.059 37 H ALA 854 HN ALA 854 -2.416 -4.586 -11.253 38 HA ALA 854 HA ALA 854 -1.102 -2.924 -13.232 39 HB1 ALA 854 HB1 ALA 854 -2.705 -4.076 -14.717 40 HB2 ALA 854 HB2 ALA 854 -4.049 -3.612 -13.650 41 HB3 ALA 854 HB3 ALA 854 -3.126 -2.365 -14.526 42 H SER 855 HN SER 855 -1.736 -0.720 -13.139 43 HA SER 855 HA SER 855 -3.344 0.265 -10.868 44 HB2 SER 855 HB1 SER 855 -1.465 1.580 -9.977 45 HB3 SER 855 HB2 SER 855 -1.327 -0.152 -9.750 46 HG SER 855 HG1 SER 855 0.031 1.451 -11.697 47 H VAL 856 HN VAL 856 -3.290 2.578 -10.732 48 HA VAL 856 HA VAL 856 -3.905 4.569 -11.406 49 HB VAL 856 HB VAL 856 -2.624 5.927 -12.860 50 HG11 VAL 856 HG11 VAL 856 -1.831 5.464 -10.599 51 HG12 VAL 856 HG12 VAL 856 -0.823 4.131 -11.211 52 HG13 VAL 856 HG13 VAL 856 -0.502 5.803 -11.720 53 HG21 VAL 856 HG21 VAL 856 -0.883 3.589 -13.668 54 HG22 VAL 856 HG22 VAL 856 -2.141 4.297 -14.711 55 HG23 VAL 856 HG23 VAL 856 -0.769 5.278 -14.174 56 H GLY 857 HN GLY 857 -4.721 6.074 -13.035 57 HA2 GLY 857 HA1 GLY 857 -6.234 6.302 -14.989 58 HA3 GLY 857 HA2 GLY 857 -6.778 4.649 -14.696 59 H SER 858 HN SER 858 -7.975 7.515 -14.513 60 HA SER 858 HA SER 858 -9.159 7.407 -11.765 61 HB2 SER 858 HB1 SER 858 -8.097 9.847 -13.233 62 HB3 SER 858 HB2 SER 858 -8.855 9.832 -11.631 63 HG SER 858 HG1 SER 858 -6.560 9.833 -11.507 64 H GLU 859 HN GLU 859 -11.042 8.770 -11.451 65 HA GLU 859 HA GLU 859 -13.080 8.338 -13.417 66 HB2 GLU 859 HB1 GLU 859 -14.558 9.416 -11.873 67 HB3 GLU 859 HB2 GLU 859 -13.488 8.329 -10.985 68 HG2 GLU 859 HG1 GLU 859 -12.075 10.289 -10.327 69 HG3 GLU 859 HG2 GLU 859 -13.196 11.365 -11.162 70 H PHE 860 HN PHE 860 -14.329 9.750 -14.517 71 HA PHE 860 HA PHE 860 -13.586 12.601 -14.911 72 HB2 PHE 860 HB1 PHE 860 -12.325 11.118 -16.531 73 HB3 PHE 860 HB2 PHE 860 -13.846 10.556 -17.163 74 HD1 PHE 860 HD1 PHE 860 -14.967 11.759 -18.887 75 HD2 PHE 860 HD2 PHE 860 -11.829 13.677 -16.635 76 HE1 PHE 860 HE1 PHE 860 -15.037 13.696 -20.439 77 HE2 PHE 860 HE2 PHE 860 -11.900 15.615 -18.192 78 HZ PHE 860 HZ PHE 860 -13.505 15.627 -20.094 79 H THR 861 HN THR 861 -15.709 9.942 -15.934 80 HA THR 861 HA THR 861 -18.135 11.634 -15.572 81 HB THR 861 HB THR 861 -18.998 10.386 -17.715 82 HG1 THR 861 HG1 THR 861 -17.368 10.177 -19.263 83 HG21 THR 861 HG21 THR 861 -17.140 12.774 -17.878 84 HG22 THR 861 HG22 THR 861 -18.405 12.321 -19.049 85 HG23 THR 861 HG23 THR 861 -18.855 12.776 -17.390 86 H GLU 862 HN GLU 862 -19.781 10.822 -14.805 87 HA GLU 862 HA GLU 862 -21.303 9.459 -13.789 88 HB2 GLU 862 HB1 GLU 862 -20.861 7.992 -16.401 89 HB3 GLU 862 HB2 GLU 862 -22.285 7.869 -15.355 90 HG2 GLU 862 HG1 GLU 862 -22.720 10.279 -15.606 91 HG3 GLU 862 HG2 GLU 862 -21.336 10.424 -16.685 92 H SER 863 HN SER 863 -22.083 6.947 -13.697 93 HA SER 863 HA SER 863 -20.664 5.576 -11.705 94 HB2 SER 863 HB1 SER 863 -22.168 3.779 -12.071 95 HB3 SER 863 HB2 SER 863 -23.067 5.270 -12.354 96 HG SER 863 HG1 SER 863 -22.669 4.912 -14.641 97 H ALA 864 HN ALA 864 -19.529 3.540 -11.700 98 HA ALA 864 HA ALA 864 -17.839 3.082 -14.119 99 HB1 ALA 864 HB1 ALA 864 -16.858 3.873 -11.345 100 HB2 ALA 864 HB2 ALA 864 -15.822 3.474 -12.730 101 HB3 ALA 864 HB3 ALA 864 -16.841 4.925 -12.778 102 H TRP 865 HN TRP 865 -16.094 1.310 -13.529 103 HA TRP 865 HA TRP 865 -17.397 -0.863 -11.938 104 HB2 TRP 865 HB1 TRP 865 -15.086 -0.898 -13.856 105 HB3 TRP 865 HB2 TRP 865 -15.733 -2.295 -13.014 106 HD1 TRP 865 HD1 TRP 865 -16.926 0.338 -15.573 107 HE1 TRP 865 HE1 TRP 865 -18.814 -0.621 -16.993 108 HE3 TRP 865 HE3 TRP 865 -17.351 -4.181 -13.269 109 HZ2 TRP 865 HZ2 TRP 865 -20.135 -3.212 -17.281 110 HZ3 TRP 865 HZ3 TRP 865 -18.927 -5.917 -14.150 111 HH2 TRP 865 HH2 TRP 865 -20.309 -5.431 -16.136 112 H VAL 866 HN VAL 866 -15.831 -2.266 -10.753 113 HA VAL 866 HA VAL 866 -13.361 -1.019 -9.745 114 HB VAL 866 HB VAL 866 -14.972 -0.272 -8.115 115 HG11 VAL 866 HG11 VAL 866 -15.572 -3.195 -7.495 116 HG12 VAL 866 HG12 VAL 866 -16.221 -1.766 -6.668 117 HG13 VAL 866 HG13 VAL 866 -16.668 -2.096 -8.344 118 HG21 VAL 866 HG21 VAL 866 -12.693 -0.852 -7.343 119 HG22 VAL 866 HG22 VAL 866 -13.939 -1.004 -6.089 120 HG23 VAL 866 HG23 VAL 866 -13.295 -2.457 -6.860 121 H ARG 867 HN ARG 867 -11.762 -2.494 -9.277 122 HA ARG 867 HA ARG 867 -12.211 -5.337 -9.982 123 HB2 ARG 867 HB1 ARG 867 -10.057 -3.641 -10.387 124 HB3 ARG 867 HB2 ARG 867 -9.551 -4.466 -8.930 125 HG2 ARG 867 HG1 ARG 867 -9.883 -6.660 -10.059 126 HG3 ARG 867 HG2 ARG 867 -10.408 -5.836 -11.525 127 HD2 ARG 867 HD1 ARG 867 -8.231 -6.194 -12.078 128 HD3 ARG 867 HD2 ARG 867 -8.110 -4.576 -11.381 129 HE ARG 867 HE ARG 867 -7.614 -6.969 -9.641 130 HH11 ARG 867 HH11 ARG 867 -6.057 -4.403 -11.463 131 HH12 ARG 867 HH12 ARG 867 -4.582 -4.548 -10.530 132 HH21 ARG 867 HH21 ARG 867 -5.650 -7.122 -8.581 133 HH22 ARG 867 HH22 ARG 867 -4.336 -6.080 -9.080 134 H CYS 868 HN CYS 868 -12.131 -7.047 -8.527 135 HA CYS 868 HA CYS 868 -12.003 -6.566 -5.662 136 HB2 CYS 868 HB1 CYS 868 -13.279 -8.433 -6.535 137 HB3 CYS 868 HB2 CYS 868 -11.836 -9.101 -7.306 138 H ASP 869 HN ASP 869 -10.246 -6.060 -4.596 139 HA ASP 869 HA ASP 869 -7.525 -6.262 -5.561 140 HB2 ASP 869 HB1 ASP 869 -8.806 -5.612 -2.886 141 HB3 ASP 869 HB2 ASP 869 -7.067 -5.686 -3.082 142 H ASP 870 HN ASP 870 -9.539 -8.723 -4.349 143 HA ASP 870 HA ASP 870 -7.211 -10.311 -3.368 144 HB2 ASP 870 HB1 ASP 870 -9.140 -9.951 -1.796 145 HB3 ASP 870 HB2 ASP 870 -10.160 -10.866 -2.897 146 H CYS 871 HN CYS 871 -9.779 -10.192 -5.780 147 HA CYS 871 HA CYS 871 -8.677 -12.598 -7.154 148 HB2 CYS 871 HB1 CYS 871 -11.333 -11.143 -7.581 149 HB3 CYS 871 HB2 CYS 871 -10.756 -12.572 -8.463 150 H PHE 872 HN PHE 872 -10.418 -10.487 -8.907 151 HA PHE 872 HA PHE 872 -8.879 -8.603 -10.197 152 HB2 PHE 872 HB1 PHE 872 -8.154 -9.583 -12.250 153 HB3 PHE 872 HB2 PHE 872 -7.387 -10.434 -10.936 154 HD1 PHE 872 HD1 PHE 872 -9.616 -10.692 -13.809 155 HD2 PHE 872 HD2 PHE 872 -8.147 -12.791 -10.342 156 HE1 PHE 872 HE1 PHE 872 -10.450 -12.839 -14.752 157 HE2 PHE 872 HE2 PHE 872 -8.992 -14.929 -11.280 158 HZ PHE 872 HZ PHE 872 -10.147 -14.954 -13.483 159 H LYS 873 HN LYS 873 -11.424 -10.961 -10.253 160 HA LYS 873 HA LYS 873 -13.360 -10.292 -12.018 161 HB2 LYS 873 HB1 LYS 873 -13.177 -11.621 -9.597 162 HB3 LYS 873 HB2 LYS 873 -14.221 -10.287 -9.149 163 HG2 LYS 873 HG1 LYS 873 -14.941 -11.801 -11.624 164 HG3 LYS 873 HG2 LYS 873 -15.053 -12.660 -10.096 165 HD2 LYS 873 HD1 LYS 873 -16.353 -9.950 -10.385 166 HD3 LYS 873 HD2 LYS 873 -17.142 -11.424 -10.977 167 HE2 LYS 873 HE1 LYS 873 -17.138 -12.434 -8.787 168 HE3 LYS 873 HE2 LYS 873 -16.121 -11.142 -8.132 169 HZ1 LYS 873 HZ1 LYS 873 -18.464 -10.865 -7.546 170 HZ2 LYS 873 HZ2 LYS 873 -17.963 -9.622 -8.495 171 HZ3 LYS 873 HZ3 LYS 873 -18.875 -10.842 -9.143 172 H TRP 874 HN TRP 874 -15.057 -8.808 -12.220 173 HA TRP 874 HA TRP 874 -14.521 -6.116 -11.049 174 HB2 TRP 874 HB1 TRP 874 -15.657 -6.808 -13.784 175 HB3 TRP 874 HB2 TRP 874 -15.310 -5.195 -13.175 176 HD1 TRP 874 HD1 TRP 874 -13.647 -8.199 -14.696 177 HE1 TRP 874 HE1 TRP 874 -11.156 -7.708 -15.223 178 HE3 TRP 874 HE3 TRP 874 -13.211 -3.707 -12.343 179 HZ2 TRP 874 HZ2 TRP 874 -9.288 -5.687 -14.708 180 HZ3 TRP 874 HZ3 TRP 874 -10.971 -2.627 -12.195 181 HH2 TRP 874 HH2 TRP 874 -9.051 -3.473 -13.462 182 H ARG 875 HN ARG 875 -16.310 -4.638 -10.762 183 HA ARG 875 HA ARG 875 -19.070 -5.646 -11.102 184 HB2 ARG 875 HB1 ARG 875 -17.861 -4.800 -8.432 185 HB3 ARG 875 HB2 ARG 875 -19.578 -4.636 -8.739 186 HG2 ARG 875 HG1 ARG 875 -18.000 -7.231 -8.724 187 HG3 ARG 875 HG2 ARG 875 -19.137 -6.686 -7.515 188 HD2 ARG 875 HD1 ARG 875 -19.756 -7.547 -10.356 189 HD3 ARG 875 HD2 ARG 875 -20.217 -8.349 -8.861 190 HE ARG 875 HE ARG 875 -21.422 -5.847 -8.653 191 HH11 ARG 875 HH11 ARG 875 -21.743 -8.495 -10.929 192 HH12 ARG 875 HH12 ARG 875 -23.263 -7.840 -11.520 193 HH21 ARG 875 HH21 ARG 875 -23.490 -5.303 -9.392 194 HH22 ARG 875 HH22 ARG 875 -24.106 -6.166 -10.814 195 H ARG 876 HN ARG 876 -20.484 -4.134 -11.633 196 HA ARG 876 HA ARG 876 -19.672 -1.352 -12.159 197 HB2 ARG 876 HB1 ARG 876 -21.171 -2.925 -13.579 198 HB3 ARG 876 HB2 ARG 876 -22.441 -2.562 -12.418 199 HG2 ARG 876 HG1 ARG 876 -20.968 -0.623 -14.263 200 HG3 ARG 876 HG2 ARG 876 -22.643 -1.166 -14.385 201 HD2 ARG 876 HD1 ARG 876 -22.892 -0.096 -11.984 202 HD3 ARG 876 HD2 ARG 876 -21.373 0.710 -12.400 203 HE ARG 876 HE ARG 876 -22.546 2.158 -13.772 204 HH11 ARG 876 HH11 ARG 876 -24.705 -0.573 -13.238 205 HH12 ARG 876 HH12 ARG 876 -26.066 0.300 -13.883 206 HH21 ARG 876 HH21 ARG 876 -24.260 3.158 -14.519 207 HH22 ARG 876 HH22 ARG 876 -25.819 2.367 -14.646 208 H ILE 877 HN ILE 877 -19.794 0.212 -10.799 209 HA ILE 877 HA ILE 877 -21.624 0.204 -8.445 210 HB ILE 877 HB ILE 877 -19.829 1.202 -7.126 211 HG12 ILE 877 HG11 ILE 877 -18.034 0.819 -9.559 212 HG13 ILE 877 HG12 ILE 877 -18.607 2.365 -8.966 213 HG21 ILE 877 HG21 ILE 877 -18.547 -0.806 -6.754 214 HG22 ILE 877 HG22 ILE 877 -20.159 -1.297 -7.273 215 HG23 ILE 877 HG23 ILE 877 -18.817 -1.347 -8.432 216 HD11 ILE 877 HD1 ILE 877 -17.341 2.236 -6.971 217 HD12 ILE 877 HD2 ILE 877 -16.867 0.559 -7.271 218 HD13 ILE 877 HD3 ILE 877 -16.272 1.856 -8.321 219 HA PRO 878 HA PRO 878 -22.373 4.484 -9.718 220 HB2 PRO 878 HB1 PRO 878 -23.083 5.695 -7.372 221 HB3 PRO 878 HB2 PRO 878 -24.151 4.522 -8.203 222 HG2 PRO 878 HG1 PRO 878 -22.235 3.989 -5.909 223 HG3 PRO 878 HG2 PRO 878 -23.960 3.514 -6.038 224 HD2 PRO 878 HD1 PRO 878 -21.934 1.798 -6.656 225 HD3 PRO 878 HD2 PRO 878 -23.467 1.795 -7.576 226 H ALA 879 HN ALA 879 -21.229 6.374 -9.807 227 HA ALA 879 HA ALA 879 -18.528 6.503 -9.254 228 HB1 ALA 879 HB1 ALA 879 -20.465 8.860 -9.415 229 HB2 ALA 879 HB2 ALA 879 -18.745 8.857 -9.863 230 HB3 ALA 879 HB3 ALA 879 -19.921 7.927 -10.816 231 H SER 880 HN SER 880 -21.079 7.224 -6.954 232 HA SER 880 HA SER 880 -19.566 8.767 -5.043 233 HB2 SER 880 HB1 SER 880 -21.941 6.906 -4.623 234 HB3 SER 880 HB2 SER 880 -21.280 8.020 -3.415 235 HG SER 880 HG1 SER 880 -22.511 8.681 -5.903 236 H VAL 881 HN VAL 881 -19.557 5.340 -5.818 237 HA VAL 881 HA VAL 881 -17.924 4.697 -3.419 238 HB VAL 881 HB VAL 881 -19.011 2.912 -5.625 239 HG11 VAL 881 HG11 VAL 881 -17.599 2.085 -3.053 240 HG12 VAL 881 HG12 VAL 881 -18.315 1.000 -4.262 241 HG13 VAL 881 HG13 VAL 881 -16.895 1.957 -4.682 242 HG21 VAL 881 HG21 VAL 881 -20.472 1.993 -3.871 243 HG22 VAL 881 HG22 VAL 881 -19.814 3.156 -2.698 244 HG23 VAL 881 HG23 VAL 881 -20.766 3.720 -4.083 245 H VAL 882 HN VAL 882 -17.643 5.016 -6.960 246 HA VAL 882 HA VAL 882 -14.931 4.111 -6.910 247 HB VAL 882 HB VAL 882 -16.578 4.442 -8.955 248 HG11 VAL 882 HG11 VAL 882 -16.003 6.223 -10.455 249 HG12 VAL 882 HG12 VAL 882 -16.411 6.988 -8.913 250 HG13 VAL 882 HG13 VAL 882 -14.719 6.817 -9.389 251 HG21 VAL 882 HG21 VAL 882 -14.624 4.136 -10.453 252 HG22 VAL 882 HG22 VAL 882 -13.540 4.673 -9.157 253 HG23 VAL 882 HG23 VAL 882 -14.463 3.170 -8.984 254 H GLY 883 HN GLY 883 -16.292 7.152 -6.103 255 HA2 GLY 883 HA1 GLY 883 -13.772 8.671 -6.056 256 HA3 GLY 883 HA2 GLY 883 -15.341 9.171 -5.421 257 H SER 884 HN SER 884 -15.326 6.433 -3.904 258 HA SER 884 HA SER 884 -13.921 7.390 -1.468 259 HB2 SER 884 HB1 SER 884 -16.286 6.718 -1.320 260 HB3 SER 884 HB2 SER 884 -15.869 5.098 -1.906 261 HG SER 884 HG1 SER 884 -16.011 5.257 0.411 262 H ILE 885 HN ILE 885 -13.987 4.609 -3.695 263 HA ILE 885 HA ILE 885 -11.891 3.113 -2.354 264 HB ILE 885 HB ILE 885 -13.470 2.857 -4.903 265 HG12 ILE 885 HG11 ILE 885 -14.085 0.696 -4.028 266 HG13 ILE 885 HG12 ILE 885 -12.904 0.786 -2.722 267 HG21 ILE 885 HG21 ILE 885 -11.002 1.188 -4.287 268 HG22 ILE 885 HG22 ILE 885 -12.261 0.777 -5.477 269 HG23 ILE 885 HG23 ILE 885 -11.281 2.216 -5.717 270 HD11 ILE 885 HD1 ILE 885 -15.281 1.156 -2.023 271 HD12 ILE 885 HD2 ILE 885 -14.199 2.485 -1.580 272 HD13 ILE 885 HD3 ILE 885 -15.291 2.640 -2.979 273 H ASP 886 HN ASP 886 -9.858 3.600 -2.313 274 HA ASP 886 HA ASP 886 -8.515 5.258 -4.383 275 HB2 ASP 886 HB1 ASP 886 -7.570 4.203 -1.689 276 HB3 ASP 886 HB2 ASP 886 -6.626 5.230 -2.762 277 H GLU 887 HN GLU 887 -6.330 4.591 -5.116 278 HA GLU 887 HA GLU 887 -6.112 2.018 -6.279 279 HB2 GLU 887 HB1 GLU 887 -4.802 4.007 -6.952 280 HB3 GLU 887 HB2 GLU 887 -3.971 3.999 -5.396 281 HG2 GLU 887 HG1 GLU 887 -2.518 3.102 -7.111 282 HG3 GLU 887 HG2 GLU 887 -2.886 1.856 -5.934 283 H SER 888 HN SER 888 -4.808 3.235 -3.199 284 HA SER 888 HA SER 888 -3.622 0.718 -2.377 285 HB2 SER 888 HB1 SER 888 -4.054 3.296 -0.885 286 HB3 SER 888 HB2 SER 888 -3.003 1.961 -0.364 287 HG SER 888 HG1 SER 888 -1.828 3.618 -1.438 288 H SER 889 HN SER 889 -6.809 1.279 -2.551 289 HA SER 889 HA SER 889 -7.724 0.589 0.133 290 HB2 SER 889 HB1 SER 889 -8.979 1.976 -1.534 291 HB3 SER 889 HB2 SER 889 -9.275 0.493 -2.469 292 HG SER 889 HG1 SER 889 -10.972 1.072 -0.940 293 H ARG 890 HN ARG 890 -9.547 -1.228 -0.035 294 HA ARG 890 HA ARG 890 -8.586 -3.749 -1.217 295 HB2 ARG 890 HB1 ARG 890 -8.764 -5.011 0.875 296 HB3 ARG 890 HB2 ARG 890 -7.433 -3.860 0.844 297 HG2 ARG 890 HG1 ARG 890 -8.690 -2.298 2.285 298 HG3 ARG 890 HG2 ARG 890 -10.083 -3.397 2.290 299 HD2 ARG 890 HD1 ARG 890 -8.695 -5.153 3.344 300 HD3 ARG 890 HD2 ARG 890 -7.303 -4.049 3.347 301 HE ARG 890 HE ARG 890 -9.451 -2.744 4.665 302 HH11 ARG 890 HH11 ARG 890 -7.366 -5.491 5.281 303 HH12 ARG 890 HH12 ARG 890 -7.521 -5.338 7.010 304 HH21 ARG 890 HH21 ARG 890 -9.605 -2.604 6.880 305 HH22 ARG 890 HH22 ARG 890 -8.756 -3.742 7.884 306 H TRP 891 HN TRP 891 -10.441 -2.674 -2.377 307 HA TRP 891 HA TRP 891 -13.151 -3.367 -1.412 308 HB2 TRP 891 HB1 TRP 891 -12.716 -1.456 -2.973 309 HB3 TRP 891 HB2 TRP 891 -12.351 -2.639 -4.230 310 HD1 TRP 891 HD1 TRP 891 -15.070 -0.859 -2.495 311 HE1 TRP 891 HE1 TRP 891 -17.367 -1.419 -3.454 312 HE3 TRP 891 HE3 TRP 891 -13.803 -5.013 -5.223 313 HZ2 TRP 891 HZ2 TRP 891 -18.583 -3.645 -4.834 314 HZ3 TRP 891 HZ3 TRP 891 -15.606 -6.410 -6.243 315 HH2 TRP 891 HH2 TRP 891 -17.970 -5.751 -6.004 316 H ILE 892 HN ILE 892 -13.999 -5.413 -1.627 317 HA ILE 892 HA ILE 892 -12.944 -7.255 -3.697 318 HB ILE 892 HB ILE 892 -12.734 -9.078 -2.107 319 HG12 ILE 892 HG11 ILE 892 -13.088 -7.138 0.185 320 HG13 ILE 892 HG12 ILE 892 -14.426 -8.096 -0.460 321 HG21 ILE 892 HG21 ILE 892 -11.049 -6.734 -1.128 322 HG22 ILE 892 HG22 ILE 892 -10.659 -8.450 -1.009 323 HG23 ILE 892 HG23 ILE 892 -10.723 -7.673 -2.595 324 HD11 ILE 892 HD1 ILE 892 -11.914 -9.349 0.654 325 HD12 ILE 892 HD2 ILE 892 -13.471 -9.179 1.483 326 HD13 ILE 892 HD3 ILE 892 -13.369 -10.171 0.010 327 H CYS 893 HN CYS 893 -14.281 -9.201 -4.034 328 HA CYS 893 HA CYS 893 -16.964 -8.770 -4.392 329 HB2 CYS 893 HB1 CYS 893 -15.828 -11.484 -3.671 330 HB3 CYS 893 HB2 CYS 893 -17.220 -11.107 -4.682 331 H MET 894 HN MET 894 -15.504 -10.140 -1.338 332 HA MET 894 HA MET 894 -18.092 -10.775 -0.213 333 HB2 MET 894 HB1 MET 894 -15.461 -10.389 1.244 334 HB3 MET 894 HB2 MET 894 -16.917 -11.149 1.880 335 HG2 MET 894 HG1 MET 894 -16.777 -12.891 0.100 336 HG3 MET 894 HG2 MET 894 -15.287 -12.153 -0.483 337 HE1 MET 894 HE1 MET 894 -16.570 -12.969 3.263 338 HE2 MET 894 HE2 MET 894 -17.013 -14.339 2.216 339 HE3 MET 894 HE3 MET 894 -15.763 -14.536 3.462 340 H ASN 895 HN ASN 895 -16.565 -7.752 -0.569 341 HA ASN 895 HA ASN 895 -18.170 -6.444 1.564 342 HB2 ASN 895 HB1 ASN 895 -16.387 -5.145 1.761 343 HB3 ASN 895 HB2 ASN 895 -15.560 -6.036 0.497 344 HD21 ASN 895 HD21 ASN 895 -16.259 -5.331 -1.848 345 HD22 ASN 895 HD22 ASN 895 -16.345 -3.581 -2.048 346 H ASN 896 HN ASN 896 -18.471 -7.255 -1.707 347 HA ASN 896 HA ASN 896 -19.495 -5.000 -2.962 348 HB2 ASN 896 HB1 ASN 896 -18.875 -7.122 -4.094 349 HB3 ASN 896 HB2 ASN 896 -20.296 -7.899 -3.386 350 HD21 ASN 896 HD21 ASN 896 -20.802 -8.489 -5.587 351 HD22 ASN 896 HD22 ASN 896 -21.750 -7.328 -6.499 352 H SER 897 HN SER 897 -21.303 -3.935 -3.078 353 HA SER 897 HA SER 897 -23.506 -4.082 -1.256 354 HB2 SER 897 HB1 SER 897 -23.102 -2.793 -3.980 355 HB3 SER 897 HB2 SER 897 -24.632 -2.694 -3.120 356 HG SER 897 HG1 SER 897 -22.073 -1.779 -2.212 357 H ASP 898 HN ASP 898 -23.144 -5.364 -4.538 358 HA ASP 898 HA ASP 898 -25.931 -6.300 -4.624 359 HB2 ASP 898 HB1 ASP 898 -23.819 -6.906 -6.675 360 HB3 ASP 898 HB2 ASP 898 -25.560 -6.929 -6.865 361 H LYS 899 HN LYS 899 -26.288 -7.842 -3.254 362 HA LYS 899 HA LYS 899 -24.628 -9.920 -2.366 363 HB2 LYS 899 HB1 LYS 899 -27.675 -9.787 -2.412 364 HB3 LYS 899 HB2 LYS 899 -26.720 -10.911 -1.450 365 HG2 LYS 899 HG1 LYS 899 -26.267 -7.931 -1.137 366 HG3 LYS 899 HG2 LYS 899 -27.640 -8.702 -0.355 367 HD2 LYS 899 HD1 LYS 899 -24.844 -9.812 -0.051 368 HD3 LYS 899 HD2 LYS 899 -25.473 -8.516 1.001 369 HE2 LYS 899 HE1 LYS 899 -27.378 -9.959 1.645 370 HE3 LYS 899 HE2 LYS 899 -26.775 -11.246 0.599 371 HZ1 LYS 899 HZ1 LYS 899 -24.772 -11.350 1.998 372 HZ2 LYS 899 HZ2 LYS 899 -25.332 -10.154 2.962 373 HZ3 LYS 899 HZ3 LYS 899 -26.102 -11.591 2.910 374 H ARG 900 HN ARG 900 -26.299 -9.808 -5.330 375 HA ARG 900 HA ARG 900 -26.478 -12.667 -5.943 376 HB2 ARG 900 HB1 ARG 900 -26.516 -10.096 -7.571 377 HB3 ARG 900 HB2 ARG 900 -26.566 -11.689 -8.329 378 HG2 ARG 900 HG1 ARG 900 -28.630 -12.239 -7.061 379 HG3 ARG 900 HG2 ARG 900 -28.588 -10.634 -6.299 380 HD2 ARG 900 HD1 ARG 900 -28.762 -9.571 -8.532 381 HD3 ARG 900 HD2 ARG 900 -28.813 -11.177 -9.290 382 HE ARG 900 HE ARG 900 -30.873 -11.053 -7.333 383 HH11 ARG 900 HH11 ARG 900 -30.195 -9.604 -10.451 384 HH12 ARG 900 HH12 ARG 900 -31.884 -9.375 -10.814 385 HH21 ARG 900 HH21 ARG 900 -33.009 -10.730 -7.859 386 HH22 ARG 900 HH22 ARG 900 -33.430 -9.999 -9.379 387 H PHE 901 HN PHE 901 -23.898 -10.335 -6.017 388 HA PHE 901 HA PHE 901 -22.078 -12.350 -7.263 389 HB2 PHE 901 HB1 PHE 901 -21.837 -9.391 -7.775 390 HB3 PHE 901 HB2 PHE 901 -21.063 -10.706 -8.640 391 HD1 PHE 901 HD1 PHE 901 -24.263 -8.881 -8.060 392 HD2 PHE 901 HD2 PHE 901 -22.165 -11.615 -10.648 393 HE1 PHE 901 HE1 PHE 901 -26.061 -8.674 -9.758 394 HE2 PHE 901 HE2 PHE 901 -23.965 -11.429 -12.317 395 HZ PHE 901 HZ PHE 901 -25.927 -9.961 -11.879 396 H ALA 902 HN ALA 902 -22.547 -11.313 -4.435 397 HA ALA 902 HA ALA 902 -20.056 -9.985 -3.761 398 HB1 ALA 902 HB1 ALA 902 -21.185 -9.514 -1.617 399 HB2 ALA 902 HB2 ALA 902 -22.266 -9.113 -2.956 400 HB3 ALA 902 HB3 ALA 902 -22.500 -10.627 -2.043 401 H ASP 903 HN ASP 903 -19.542 -12.533 -4.539 402 HA ASP 903 HA ASP 903 -17.958 -13.377 -2.228 403 HB2 ASP 903 HB1 ASP 903 -19.821 -15.270 -3.662 404 HB3 ASP 903 HB2 ASP 903 -18.381 -15.827 -2.828 405 H CYS 904 HN CYS 904 -15.992 -14.163 -2.707 406 HA CYS 904 HA CYS 904 -14.835 -13.518 -5.194 407 HB2 CYS 904 HB1 CYS 904 -13.986 -15.207 -2.805 408 HB3 CYS 904 HB2 CYS 904 -12.928 -14.857 -4.173 409 H SER 905 HN SER 905 -16.854 -16.100 -4.533 410 HA SER 905 HA SER 905 -15.762 -17.893 -6.632 411 HB2 SER 905 HB1 SER 905 -18.143 -18.288 -4.790 412 HB3 SER 905 HB2 SER 905 -17.473 -19.473 -5.930 413 HG SER 905 HG1 SER 905 -16.701 -19.802 -3.789 414 H LYS 906 HN LYS 906 -18.084 -15.329 -6.283 415 HA LYS 906 HA LYS 906 -19.987 -16.329 -8.303 416 HB2 LYS 906 HB1 LYS 906 -19.698 -13.748 -6.752 417 HB3 LYS 906 HB2 LYS 906 -20.919 -13.954 -8.001 418 HG2 LYS 906 HG1 LYS 906 -20.773 -15.688 -5.518 419 HG3 LYS 906 HG2 LYS 906 -21.740 -14.216 -5.692 420 HD2 LYS 906 HD1 LYS 906 -23.334 -15.759 -6.156 421 HD3 LYS 906 HD2 LYS 906 -22.756 -15.470 -7.797 422 HE2 LYS 906 HE1 LYS 906 -21.322 -17.528 -7.612 423 HE3 LYS 906 HE2 LYS 906 -21.884 -17.754 -5.954 424 HZ1 LYS 906 HZ1 LYS 906 -23.142 -19.123 -7.514 425 HZ2 LYS 906 HZ2 LYS 906 -24.140 -18.036 -6.824 426 HZ3 LYS 906 HZ3 LYS 906 -23.630 -17.817 -8.361 427 H SER 907 HN SER 907 -20.787 -14.566 -9.791 428 HA SER 907 HA SER 907 -18.762 -14.270 -11.912 429 HB2 SER 907 HB1 SER 907 -20.729 -14.426 -13.348 430 HB3 SER 907 HB2 SER 907 -20.788 -15.703 -12.109 431 HG SER 907 HG1 SER 907 -22.805 -14.637 -12.331 432 H GLN 908 HN GLN 908 -20.118 -12.485 -13.549 433 HA GLN 908 HA GLN 908 -20.812 -10.019 -12.190 434 HB2 GLN 908 HB1 GLN 908 -19.102 -8.611 -13.087 435 HB3 GLN 908 HB2 GLN 908 -18.319 -9.936 -12.233 436 HG2 GLN 908 HG1 GLN 908 -18.288 -11.062 -14.660 437 HG3 GLN 908 HG2 GLN 908 -18.567 -9.406 -15.176 438 HE21 GLN 908 HE21 GLN 908 -16.605 -9.182 -16.234 439 HE22 GLN 908 HE22 GLN 908 -15.030 -9.449 -15.491 440 H GLU 909 HN GLU 909 -21.480 -8.325 -13.776 441 HA GLU 909 HA GLU 909 -23.500 -9.279 -15.453 442 HB2 GLU 909 HB1 GLU 909 -22.061 -6.652 -15.881 443 HB3 GLU 909 HB2 GLU 909 -23.713 -7.024 -16.322 444 HG2 GLU 909 HG1 GLU 909 -22.572 -6.643 -13.535 445 HG3 GLU 909 HG2 GLU 909 -23.577 -5.514 -14.421 446 H MET 910 HN MET 910 -20.162 -8.575 -16.405 447 HA MET 910 HA MET 910 -20.567 -9.768 -19.107 448 HB2 MET 910 HB1 MET 910 -19.400 -6.979 -18.661 449 HB3 MET 910 HB2 MET 910 -19.275 -7.907 -20.140 450 HG2 MET 910 HG1 MET 910 -21.035 -6.669 -20.753 451 HG3 MET 910 HG2 MET 910 -21.940 -7.952 -19.960 452 HE1 MET 910 HE1 MET 910 -24.105 -4.820 -19.136 453 HE2 MET 910 HE2 MET 910 -23.265 -5.219 -20.651 454 HE3 MET 910 HE3 MET 910 -24.089 -6.496 -19.727 455 H SER 911 HN SER 911 -18.730 -10.919 -19.806 456 HA SER 911 HA SER 911 -16.560 -11.341 -17.924 457 HB2 SER 911 HB1 SER 911 -15.524 -12.588 -19.912 458 HB3 SER 911 HB2 SER 911 -16.987 -13.203 -19.188 459 HG SER 911 HG1 SER 911 -17.095 -13.156 -21.505 460 H ASN 912 HN ASN 912 -14.303 -11.173 -18.517 461 HA ASN 912 HA ASN 912 -13.771 -8.357 -18.740 462 HB2 ASN 912 HB1 ASN 912 -11.707 -10.595 -18.795 463 HB3 ASN 912 HB2 ASN 912 -11.418 -8.890 -18.403 464 HD21 ASN 912 HD21 ASN 912 -10.454 -10.574 -16.621 465 HD22 ASN 912 HD22 ASN 912 -11.449 -10.452 -15.168 466 H GLU 913 HN GLU 913 -13.710 -10.759 -21.262 467 HA GLU 913 HA GLU 913 -12.365 -9.021 -23.197 468 HB2 GLU 913 HB1 GLU 913 -12.904 -10.723 -24.809 469 HB3 GLU 913 HB2 GLU 913 -12.260 -11.477 -23.354 470 HG2 GLU 913 HG1 GLU 913 -14.617 -11.993 -22.627 471 HG3 GLU 913 HG2 GLU 913 -15.199 -11.351 -24.164 472 H GLU 914 HN GLU 914 -15.445 -8.890 -21.824 473 HA GLU 914 HA GLU 914 -16.555 -7.290 -24.103 474 HB2 GLU 914 HB1 GLU 914 -17.956 -8.593 -21.749 475 HB3 GLU 914 HB2 GLU 914 -18.723 -7.550 -22.958 476 HG2 GLU 914 HG1 GLU 914 -17.995 -9.180 -24.727 477 HG3 GLU 914 HG2 GLU 914 -17.427 -10.264 -23.454 478 H ILE 915 HN ILE 915 -16.149 -7.270 -20.491 479 HA ILE 915 HA ILE 915 -16.614 -4.432 -20.456 480 HB ILE 915 HB ILE 915 -17.389 -5.761 -18.712 481 HG12 ILE 915 HG11 ILE 915 -17.020 -4.279 -16.912 482 HG13 ILE 915 HG12 ILE 915 -15.386 -3.912 -17.376 483 HG21 ILE 915 HG21 ILE 915 -15.867 -6.476 -16.806 484 HG22 ILE 915 HG22 ILE 915 -15.773 -7.440 -18.262 485 HG23 ILE 915 HG23 ILE 915 -14.496 -6.258 -17.919 486 HD11 ILE 915 HD1 ILE 915 -17.897 -2.973 -18.822 487 HD12 ILE 915 HD2 ILE 915 -16.713 -1.994 -17.903 488 HD13 ILE 915 HD3 ILE 915 -16.254 -2.697 -19.432 489 H ASN 916 HN ASN 916 -14.267 -5.665 -21.751 490 HA ASN 916 HA ASN 916 -12.556 -3.273 -21.159 491 HB2 ASN 916 HB1 ASN 916 -10.602 -4.261 -22.109 492 HB3 ASN 916 HB2 ASN 916 -11.222 -5.325 -20.865 493 HD21 ASN 916 HD21 ASN 916 -9.458 -6.532 -22.412 494 HD22 ASN 916 HD22 ASN 916 -10.218 -7.504 -23.658 495 H GLU 917 HN GLU 917 -14.113 -5.094 -23.759 496 HA GLU 917 HA GLU 917 -13.621 -3.264 -25.886 497 HB2 GLU 917 HB1 GLU 917 -15.582 -5.445 -25.305 498 HB3 GLU 917 HB2 GLU 917 -15.888 -4.410 -26.675 499 HG2 GLU 917 HG1 GLU 917 -13.348 -6.035 -26.187 500 HG3 GLU 917 HG2 GLU 917 -14.658 -6.496 -27.268 501 H GLU 918 HN GLU 918 -16.224 -3.319 -23.460 502 HA GLU 918 HA GLU 918 -17.924 -1.396 -24.589 503 HB2 GLU 918 HB1 GLU 918 -18.185 -2.832 -22.411 504 HB3 GLU 918 HB2 GLU 918 -17.363 -1.499 -21.601 505 HG2 GLU 918 HG1 GLU 918 -19.797 -1.316 -21.388 506 HG3 GLU 918 HG2 GLU 918 -19.132 0.058 -22.256 507 H LEU 919 HN LEU 919 -14.877 -0.864 -22.938 508 HA LEU 919 HA LEU 919 -15.203 2.094 -23.097 509 HB2 LEU 919 HB1 LEU 919 -13.026 0.567 -21.646 510 HB3 LEU 919 HB2 LEU 919 -13.409 2.274 -21.547 511 HG LEU 919 HG LEU 919 -15.823 1.111 -20.801 512 HD11 LEU 919 HD11 LEU 919 -14.849 -1.142 -20.755 513 HD12 LEU 919 HD12 LEU 919 -13.561 -0.587 -19.677 514 HD13 LEU 919 HD13 LEU 919 -15.249 -0.598 -19.124 515 HD21 LEU 919 HD21 LEU 919 -15.102 1.658 -18.474 516 HD22 LEU 919 HD22 LEU 919 -13.469 2.024 -19.129 517 HD23 LEU 919 HD23 LEU 919 -14.859 2.967 -19.668 518 H GLY 920 HN GLY 920 -13.226 -0.594 -24.238 519 HA2 GLY 920 HA1 GLY 920 -12.033 -0.667 -26.286 520 HA3 GLY 920 HA2 GLY 920 -11.942 1.096 -26.333 521 H ILE 921 HN ILE 921 -11.135 -1.060 -23.612 522 HA ILE 921 HA ILE 921 -8.398 0.126 -23.487 523 HB ILE 921 HB ILE 921 -8.501 -0.269 -21.080 524 HG12 ILE 921 HG11 ILE 921 -11.404 -1.097 -21.504 525 HG13 ILE 921 HG12 ILE 921 -10.071 -2.199 -21.132 526 HG21 ILE 921 HG21 ILE 921 -10.853 1.384 -22.083 527 HG22 ILE 921 HG22 ILE 921 -9.983 1.586 -20.550 528 HG23 ILE 921 HG23 ILE 921 -9.158 1.899 -22.076 529 HD11 ILE 921 HD1 ILE 921 -11.093 0.009 -19.324 530 HD12 ILE 921 HD2 ILE 921 -11.286 -1.739 -19.107 531 HD13 ILE 921 HD3 ILE 921 -9.669 -1.008 -18.995 532 H GLY 922 HN GLY 922 -6.823 -1.183 -22.267 533 HA2 GLY 922 HA1 GLY 922 -6.641 -3.898 -23.515 534 HA3 GLY 922 HA2 GLY 922 -5.299 -2.794 -23.241 535 H GLN 923 HN GLN 923 -7.897 -4.212 -21.165 536 HA GLN 923 HA GLN 923 -6.147 -4.565 -18.892 537 HB2 GLN 923 HB1 GLN 923 -8.948 -4.778 -19.372 538 HB3 GLN 923 HB2 GLN 923 -8.451 -6.370 -18.859 539 HG2 GLN 923 HG1 GLN 923 -9.049 -5.325 -16.890 540 HG3 GLN 923 HG2 GLN 923 -7.298 -5.224 -16.853 541 HE21 GLN 923 HE21 GLN 923 -9.745 -3.413 -15.840 542 HE22 GLN 923 HE22 GLN 923 -9.205 -1.817 -16.346 543 H ASP 924 HN ASP 924 -5.865 -6.672 -17.825 544 HA ASP 924 HA ASP 924 -4.249 -8.482 -19.375 545 HB2 ASP 924 HB1 ASP 924 -5.439 -8.764 -16.590 546 HB3 ASP 924 HB2 ASP 924 -4.166 -9.773 -17.260 547 H GLU 925 HN GLU 925 -7.597 -8.503 -18.692 548 HA GLU 925 HA GLU 925 -9.364 -9.708 -19.201 549 HB2 GLU 925 HB1 GLU 925 -8.254 -9.472 -21.446 550 HB3 GLU 925 HB2 GLU 925 -7.736 -11.143 -21.321 551 HG2 GLU 925 HG1 GLU 925 -10.607 -10.192 -21.051 552 HG3 GLU 925 HG2 GLU 925 -9.889 -10.646 -22.590 553 H ALA 926 HN ALA 926 -6.790 -12.095 -19.457 554 HA ALA 926 HA ALA 926 -8.338 -14.205 -18.055 555 HB1 ALA 926 HB1 ALA 926 -6.915 -14.791 -19.968 556 HB2 ALA 926 HB2 ALA 926 -5.487 -14.146 -19.129 557 HB3 ALA 926 HB3 ALA 926 -6.337 -15.566 -18.483 558 H ASP 927 HN ASP 927 -5.335 -12.386 -17.481 559 HA ASP 927 HA ASP 927 -4.014 -12.111 -15.713 560 HB2 ASP 927 HB1 ASP 927 -6.192 -10.730 -15.278 561 HB3 ASP 927 HB2 ASP 927 -6.448 -11.852 -13.949 562 H ALA 928 HN ALA 928 -5.026 -14.948 -16.135 563 HA ALA 928 HA ALA 928 -3.665 -16.146 -13.793 564 HB1 ALA 928 HB1 ALA 928 -6.450 -16.952 -14.740 565 HB2 ALA 928 HB2 ALA 928 -5.489 -17.788 -13.503 566 HB3 ALA 928 HB3 ALA 928 -6.061 -16.134 -13.212 567 H1 ALA 1 HT1 ALA 1 -6.966 -1.082 -6.185 568 H2 ALA 1 HT2 ALA 1 -5.355 -0.809 -6.343 569 H3 ALA 1 HT3 ALA 1 -5.921 -2.307 -5.920 570 HA ALA 1 HA ALA 1 -5.178 -2.106 -8.271 571 HB1 ALA 1 HB1 ALA 1 -6.632 -3.960 -7.663 572 HB2 ALA 1 HB2 ALA 1 -8.064 -2.902 -7.669 573 HB3 ALA 1 HB3 ALA 1 -7.224 -3.266 -9.183 574 H ARG 2 HN ARG 2 -5.615 -1.280 -10.366 575 HA ARG 2 HA ARG 2 -7.150 1.204 -10.620 576 HB2 ARG 2 HB1 ARG 2 -6.603 1.176 -12.903 577 HB3 ARG 2 HB2 ARG 2 -5.166 0.721 -12.040 578 HG2 ARG 2 HG1 ARG 2 -5.221 -1.513 -12.803 579 HG3 ARG 2 HG2 ARG 2 -6.934 -1.489 -13.183 580 HD2 ARG 2 HD1 ARG 2 -4.815 0.096 -14.674 581 HD3 ARG 2 HD2 ARG 2 -5.522 -1.440 -15.216 582 HE ARG 2 HE ARG 2 -7.731 0.189 -14.805 583 HH11 ARG 2 HH11 ARG 2 -4.901 0.517 -16.844 584 HH12 ARG 2 HH12 ARG 2 -5.713 1.598 -17.943 585 HH21 ARG 2 HH21 ARG 2 -8.669 1.610 -16.162 586 HH22 ARG 2 HH22 ARG 2 -7.821 2.177 -17.583 587 H THR 3 HN THR 3 -8.776 1.360 -12.474 588 HA THR 3 HA THR 3 -10.219 -1.019 -13.211 589 HB THR 3 HB THR 3 -11.159 -0.563 -10.894 590 HG1 THR 3 HG1 THR 3 -12.535 -1.589 -12.243 591 HG21 THR 3 HG21 THR 3 -12.530 1.314 -10.411 592 HG22 THR 3 HG22 THR 3 -11.005 1.969 -11.005 593 HG23 THR 3 HG23 THR 3 -12.435 1.939 -12.065 594 H MLZ 4 HN MLZ 4 -12.677 0.362 -13.880 595 HA MLZ 4 HA MLZ 4 -11.882 2.070 -16.154 596 HB2 MLZ 4 HB1 MLZ 4 -12.809 0.543 -17.751 597 HB3 MLZ 4 HB2 MLZ 4 -11.655 -0.351 -16.821 598 HG2 MLZ 4 HG1 MLZ 4 -14.644 -0.467 -16.231 599 HG3 MLZ 4 HG2 MLZ 4 -13.920 -1.424 -17.507 600 HD2 MLZ 4 HD1 MLZ 4 -13.003 -1.641 -14.651 601 HD3 MLZ 4 HD2 MLZ 4 -14.253 -2.656 -15.349 602 HE2 MLZ 4 HE1 MLZ 4 -11.544 -2.430 -16.689 603 HE3 MLZ 4 HE2 MLZ 4 -11.762 -3.470 -15.256 604 HZ MLZ 4 HZ1 MLZ 4 -13.390 -3.712 -17.745 605 HCM1 MLZ 4 HC1 MLZ 4 -12.137 -5.666 -18.250 606 HCM2 MLZ 4 HC2 MLZ 4 -11.049 -4.280 -18.118 607 HCM3 MLZ 4 HC3 MLZ 4 -11.190 -5.445 -16.772 608 HZ2 MLZ 4 HZ2 MLZ 4 -13.468 -4.704 -16.440 609 H GLN 5 HN GLN 5 -13.730 3.215 -17.121 610 HA GLN 5 HA GLN 5 -16.202 3.252 -15.456 611 HB2 GLN 5 HB1 GLN 5 -16.166 5.649 -15.303 612 HB3 GLN 5 HB2 GLN 5 -14.788 4.911 -14.504 613 HG2 GLN 5 HG1 GLN 5 -13.370 6.213 -15.623 614 HG3 GLN 5 HG2 GLN 5 -13.917 5.586 -17.168 615 HE21 GLN 5 HE21 GLN 5 -15.779 6.722 -18.216 616 HE22 GLN 5 HE22 GLN 5 -16.088 8.416 -17.799 617 H THR 6 HN THR 6 -17.626 2.442 -16.869 618 HA THR 6 HA THR 6 -17.352 2.681 -19.672 619 HB THR 6 HB THR 6 -19.838 1.735 -19.503 620 HG1 THR 6 HG1 THR 6 -20.276 1.961 -17.369 621 HG21 THR 6 HG21 THR 6 -18.885 -0.508 -19.091 622 HG22 THR 6 HG22 THR 6 -17.893 0.433 -20.212 623 HG23 THR 6 HG23 THR 6 -17.372 0.248 -18.523 624 H ALA 7 HN ALA 7 -19.664 4.381 -17.535 625 HA ALA 7 HA ALA 7 -21.206 5.994 -17.948 626 HB1 ALA 7 HB1 ALA 7 -19.070 7.221 -18.086 627 HB2 ALA 7 HB2 ALA 7 -19.091 7.029 -19.855 628 HB3 ALA 7 HB3 ALA 7 -20.357 7.978 -19.046 629 H ARG 8 HN ARG 8 -21.601 3.649 -19.536 630 HA ARG 8 HA ARG 8 -23.407 4.413 -21.660 631 HB2 ARG 8 HB1 ARG 8 -21.146 4.614 -22.775 632 HB3 ARG 8 HB2 ARG 8 -20.789 2.955 -22.308 633 HG2 ARG 8 HG1 ARG 8 -21.422 2.993 -24.619 634 HG3 ARG 8 HG2 ARG 8 -22.700 2.166 -23.724 635 HD2 ARG 8 HD1 ARG 8 -24.079 4.227 -23.786 636 HD3 ARG 8 HD2 ARG 8 -22.765 5.080 -24.625 637 HE ARG 8 HE ARG 8 -23.445 2.719 -26.087 638 HH11 ARG 8 HH11 ARG 8 -24.825 5.873 -25.432 639 HH12 ARG 8 HH12 ARG 8 -25.740 5.881 -26.916 640 HH21 ARG 8 HH21 ARG 8 -24.636 2.796 -27.961 641 HH22 ARG 8 HH22 ARG 8 -25.630 4.180 -28.305 642 H TYR 9 HN TYR 9 -24.935 2.971 -21.554 643 HA TYR 9 HA TYR 9 -24.523 0.323 -20.240 644 HB2 TYR 9 HB1 TYR 9 -26.952 2.009 -19.723 645 HB3 TYR 9 HB2 TYR 9 -26.240 0.750 -18.732 646 HD1 TYR 9 HD1 TYR 9 -26.636 4.246 -19.161 647 HD2 TYR 9 HD2 TYR 9 -23.772 1.321 -17.800 648 HE1 TYR 9 HE1 TYR 9 -25.417 6.023 -17.917 649 HE2 TYR 9 HE2 TYR 9 -22.544 3.114 -16.562 650 HH TYR 9 HH TYR 9 -23.533 6.540 -16.758 Start of MODEL 20 1 H1 GLY 850 HT1 GLY 850 -1.970 -10.046 -10.697 2 H2 GLY 850 HT2 GLY 850 -1.662 -10.130 -12.301 3 H3 GLY 850 HT3 GLY 850 -2.172 -8.725 -11.647 4 HA2 GLY 850 HA1 GLY 850 0.424 -10.029 -11.086 5 HA3 GLY 850 HA2 GLY 850 0.189 -8.586 -12.089 6 H SER 851 HN SER 851 0.279 -9.853 -8.826 7 HA SER 851 HA SER 851 0.131 -8.986 -6.753 8 HB2 SER 851 HB1 SER 851 2.060 -7.624 -7.617 9 HB3 SER 851 HB2 SER 851 0.919 -6.306 -7.921 10 HG SER 851 HG1 SER 851 1.796 -7.414 -5.477 11 H ARG 852 HN ARG 852 -0.795 -6.762 -5.563 12 HA ARG 852 HA ARG 852 -3.685 -7.055 -5.739 13 HB2 ARG 852 HB1 ARG 852 -1.971 -5.032 -4.223 14 HB3 ARG 852 HB2 ARG 852 -3.688 -5.326 -3.952 15 HG2 ARG 852 HG1 ARG 852 -1.508 -7.406 -3.487 16 HG3 ARG 852 HG2 ARG 852 -2.223 -6.367 -2.249 17 HD2 ARG 852 HD1 ARG 852 -4.456 -7.299 -2.721 18 HD3 ARG 852 HD2 ARG 852 -3.755 -8.374 -3.948 19 HE ARG 852 HE ARG 852 -2.351 -8.838 -1.539 20 HH11 ARG 852 HH11 ARG 852 -5.609 -9.270 -2.732 21 HH12 ARG 852 HH12 ARG 852 -5.902 -10.686 -1.732 22 HH21 ARG 852 HH21 ARG 852 -2.804 -10.633 -0.244 23 HH22 ARG 852 HH22 ARG 852 -4.372 -11.387 -0.355 24 H ARG 853 HN ARG 853 -1.580 -5.033 -7.436 25 HA ARG 853 HA ARG 853 -1.718 -3.270 -8.848 26 HB2 ARG 853 HB1 ARG 853 -4.728 -3.556 -8.731 27 HB3 ARG 853 HB2 ARG 853 -3.834 -2.588 -9.874 28 HG2 ARG 853 HG1 ARG 853 -3.513 -5.613 -9.771 29 HG3 ARG 853 HG2 ARG 853 -4.815 -4.805 -10.632 30 HD2 ARG 853 HD1 ARG 853 -3.226 -5.166 -12.288 31 HD3 ARG 853 HD2 ARG 853 -3.078 -3.453 -11.888 32 HE ARG 853 HE ARG 853 -1.262 -5.486 -10.635 33 HH11 ARG 853 HH11 ARG 853 -1.448 -2.776 -12.932 34 HH12 ARG 853 HH12 ARG 853 0.285 -2.632 -12.936 35 HH21 ARG 853 HH21 ARG 853 0.837 -5.269 -10.795 36 HH22 ARG 853 HH22 ARG 853 1.564 -4.011 -11.768 37 H ALA 854 HN ALA 854 -1.947 -1.058 -8.951 38 HA ALA 854 HA ALA 854 -2.601 0.326 -6.407 39 HB1 ALA 854 HB1 ALA 854 -1.417 2.221 -7.400 40 HB2 ALA 854 HB2 ALA 854 -0.394 0.768 -7.397 41 HB3 ALA 854 HB3 ALA 854 -1.169 1.310 -8.908 42 H SER 855 HN SER 855 -3.815 2.327 -6.455 43 HA SER 855 HA SER 855 -5.547 3.017 -8.676 44 HB2 SER 855 HB1 SER 855 -7.650 2.476 -7.439 45 HB3 SER 855 HB2 SER 855 -6.758 1.172 -8.189 46 HG SER 855 HG1 SER 855 -6.727 1.824 -5.407 47 H VAL 856 HN VAL 856 -6.913 4.699 -8.362 48 HA VAL 856 HA VAL 856 -7.134 6.093 -5.801 49 HB VAL 856 HB VAL 856 -6.688 8.325 -6.745 50 HG11 VAL 856 HG11 VAL 856 -5.021 7.178 -5.363 51 HG12 VAL 856 HG12 VAL 856 -4.231 6.558 -6.836 52 HG13 VAL 856 HG13 VAL 856 -4.303 8.306 -6.528 53 HG21 VAL 856 HG21 VAL 856 -5.359 8.621 -8.764 54 HG22 VAL 856 HG22 VAL 856 -5.417 6.877 -9.096 55 HG23 VAL 856 HG23 VAL 856 -6.906 7.851 -9.139 56 H GLY 857 HN GLY 857 -8.753 7.730 -5.834 57 HA2 GLY 857 HA1 GLY 857 -11.146 6.704 -7.014 58 HA3 GLY 857 HA2 GLY 857 -11.028 8.076 -5.914 59 H SER 858 HN SER 858 -9.921 7.455 -9.287 60 HA SER 858 HA SER 858 -10.518 10.081 -10.263 61 HB2 SER 858 HB1 SER 858 -10.112 7.474 -11.779 62 HB3 SER 858 HB2 SER 858 -10.109 9.103 -12.486 63 HG SER 858 HG1 SER 858 -7.985 8.378 -12.037 64 H GLU 859 HN GLU 859 -12.176 10.870 -11.385 65 HA GLU 859 HA GLU 859 -14.443 9.222 -12.281 66 HB2 GLU 859 HB1 GLU 859 -16.138 10.455 -11.116 67 HB3 GLU 859 HB2 GLU 859 -15.024 9.755 -9.942 68 HG2 GLU 859 HG1 GLU 859 -13.877 11.978 -9.744 69 HG3 GLU 859 HG2 GLU 859 -15.077 12.670 -10.837 70 H PHE 860 HN PHE 860 -15.733 10.153 -13.826 71 HA PHE 860 HA PHE 860 -15.131 12.854 -14.931 72 HB2 PHE 860 HB1 PHE 860 -13.537 11.131 -15.852 73 HB3 PHE 860 HB2 PHE 860 -14.886 10.221 -16.459 74 HD1 PHE 860 HD1 PHE 860 -15.611 10.586 -18.680 75 HD2 PHE 860 HD2 PHE 860 -13.407 13.684 -16.639 76 HE1 PHE 860 HE1 PHE 860 -15.574 11.934 -20.763 77 HE2 PHE 860 HE2 PHE 860 -13.369 15.028 -18.729 78 HZ PHE 860 HZ PHE 860 -14.454 14.156 -20.791 79 H THR 861 HN THR 861 -16.920 9.843 -15.367 80 HA THR 861 HA THR 861 -19.376 11.307 -16.292 81 HB THR 861 HB THR 861 -18.015 10.667 -18.184 82 HG1 THR 861 HG1 THR 861 -19.651 9.906 -19.335 83 HG21 THR 861 HG21 THR 861 -17.749 8.353 -18.893 84 HG22 THR 861 HG22 THR 861 -16.931 8.605 -17.351 85 HG23 THR 861 HG23 THR 861 -18.501 7.764 -17.397 86 H GLU 862 HN GLU 862 -20.660 8.763 -16.948 87 HA GLU 862 HA GLU 862 -22.285 8.383 -14.689 88 HB2 GLU 862 HB1 GLU 862 -21.749 6.548 -17.056 89 HB3 GLU 862 HB2 GLU 862 -23.100 6.356 -15.927 90 HG2 GLU 862 HG1 GLU 862 -23.995 8.548 -16.551 91 HG3 GLU 862 HG2 GLU 862 -22.645 8.821 -17.652 92 H SER 863 HN SER 863 -22.732 6.462 -13.416 93 HA SER 863 HA SER 863 -21.061 5.292 -11.718 94 HB2 SER 863 HB1 SER 863 -23.224 3.821 -13.245 95 HB3 SER 863 HB2 SER 863 -22.560 3.359 -11.669 96 HG SER 863 HG1 SER 863 -24.544 4.649 -11.583 97 H ALA 864 HN ALA 864 -19.596 3.619 -11.508 98 HA ALA 864 HA ALA 864 -18.255 2.979 -14.126 99 HB1 ALA 864 HB1 ALA 864 -16.189 3.650 -13.229 100 HB2 ALA 864 HB2 ALA 864 -17.296 4.881 -12.593 101 HB3 ALA 864 HB3 ALA 864 -16.736 3.522 -11.582 102 H TRP 865 HN TRP 865 -16.195 1.432 -13.361 103 HA TRP 865 HA TRP 865 -17.457 -0.893 -11.953 104 HB2 TRP 865 HB1 TRP 865 -15.165 -0.796 -13.909 105 HB3 TRP 865 HB2 TRP 865 -15.757 -2.246 -13.102 106 HD1 TRP 865 HD1 TRP 865 -16.802 0.350 -15.714 107 HE1 TRP 865 HE1 TRP 865 -18.630 -0.588 -17.209 108 HE3 TRP 865 HE3 TRP 865 -17.618 -4.038 -13.249 109 HZ2 TRP 865 HZ2 TRP 865 -20.311 -2.979 -17.300 110 HZ3 TRP 865 HZ3 TRP 865 -19.314 -5.681 -14.100 111 HH2 TRP 865 HH2 TRP 865 -20.666 -5.147 -16.089 112 H VAL 866 HN VAL 866 -15.929 -2.231 -10.743 113 HA VAL 866 HA VAL 866 -13.458 -0.973 -9.745 114 HB VAL 866 HB VAL 866 -15.128 -0.268 -8.120 115 HG11 VAL 866 HG11 VAL 866 -16.231 -1.829 -6.615 116 HG12 VAL 866 HG12 VAL 866 -16.692 -2.216 -8.277 117 HG13 VAL 866 HG13 VAL 866 -15.499 -3.219 -7.434 118 HG21 VAL 866 HG21 VAL 866 -13.248 -2.314 -6.905 119 HG22 VAL 866 HG22 VAL 866 -12.790 -0.670 -7.418 120 HG23 VAL 866 HG23 VAL 866 -13.969 -0.906 -6.118 121 H ARG 867 HN ARG 867 -11.870 -2.469 -9.226 122 HA ARG 867 HA ARG 867 -12.415 -5.282 -9.999 123 HB2 ARG 867 HB1 ARG 867 -10.316 -3.668 -10.653 124 HB3 ARG 867 HB2 ARG 867 -9.645 -4.465 -9.252 125 HG2 ARG 867 HG1 ARG 867 -10.206 -6.687 -10.330 126 HG3 ARG 867 HG2 ARG 867 -10.773 -5.811 -11.749 127 HD2 ARG 867 HD1 ARG 867 -8.714 -5.973 -12.535 128 HD3 ARG 867 HD2 ARG 867 -8.280 -4.666 -11.441 129 HE ARG 867 HE ARG 867 -8.014 -7.012 -9.908 130 HH11 ARG 867 HH11 ARG 867 -6.591 -6.115 -13.009 131 HH12 ARG 867 HH12 ARG 867 -5.387 -7.397 -12.843 132 HH21 ARG 867 HH21 ARG 867 -6.355 -8.533 -9.840 133 HH22 ARG 867 HH22 ARG 867 -5.275 -8.614 -11.225 134 H CYS 868 HN CYS 868 -12.040 -6.999 -8.647 135 HA CYS 868 HA CYS 868 -11.882 -6.618 -5.783 136 HB2 CYS 868 HB1 CYS 868 -13.038 -8.463 -6.960 137 HB3 CYS 868 HB2 CYS 868 -11.482 -9.061 -7.544 138 H ASP 869 HN ASP 869 -10.128 -6.108 -4.669 139 HA ASP 869 HA ASP 869 -7.367 -6.339 -5.530 140 HB2 ASP 869 HB1 ASP 869 -8.737 -5.833 -2.866 141 HB3 ASP 869 HB2 ASP 869 -6.998 -5.978 -2.998 142 H ASP 870 HN ASP 870 -9.469 -8.885 -4.778 143 HA ASP 870 HA ASP 870 -7.225 -10.518 -3.683 144 HB2 ASP 870 HB1 ASP 870 -9.038 -9.872 -2.017 145 HB3 ASP 870 HB2 ASP 870 -10.121 -10.932 -2.917 146 H CYS 871 HN CYS 871 -9.670 -10.306 -6.099 147 HA CYS 871 HA CYS 871 -8.174 -12.484 -7.364 148 HB2 CYS 871 HB1 CYS 871 -9.982 -13.474 -8.459 149 HB3 CYS 871 HB2 CYS 871 -10.315 -13.473 -6.744 150 H PHE 872 HN PHE 872 -10.528 -11.085 -9.167 151 HA PHE 872 HA PHE 872 -9.188 -8.810 -10.370 152 HB2 PHE 872 HB1 PHE 872 -8.697 -9.902 -12.562 153 HB3 PHE 872 HB2 PHE 872 -7.652 -10.352 -11.238 154 HD1 PHE 872 HD1 PHE 872 -10.524 -11.542 -13.337 155 HD2 PHE 872 HD2 PHE 872 -7.417 -12.651 -10.555 156 HE1 PHE 872 HE1 PHE 872 -10.998 -13.939 -13.760 157 HE2 PHE 872 HE2 PHE 872 -7.896 -15.050 -10.983 158 HZ PHE 872 HZ PHE 872 -9.688 -15.696 -12.584 159 H LYS 873 HN LYS 873 -11.911 -10.669 -10.043 160 HA LYS 873 HA LYS 873 -13.617 -10.138 -12.207 161 HB2 LYS 873 HB1 LYS 873 -14.083 -11.499 -10.202 162 HB3 LYS 873 HB2 LYS 873 -14.332 -9.992 -9.271 163 HG2 LYS 873 HG1 LYS 873 -16.294 -9.471 -10.429 164 HG3 LYS 873 HG2 LYS 873 -15.784 -10.362 -11.869 165 HD2 LYS 873 HD1 LYS 873 -17.565 -11.558 -10.937 166 HD3 LYS 873 HD2 LYS 873 -16.087 -12.490 -10.671 167 HE2 LYS 873 HE1 LYS 873 -16.020 -11.911 -8.346 168 HE3 LYS 873 HE2 LYS 873 -17.112 -10.536 -8.565 169 HZ1 LYS 873 HZ1 LYS 873 -17.923 -13.355 -8.908 170 HZ2 LYS 873 HZ2 LYS 873 -18.189 -12.479 -7.548 171 HZ3 LYS 873 HZ3 LYS 873 -18.915 -12.052 -8.989 172 H TRP 874 HN TRP 874 -15.126 -8.504 -12.615 173 HA TRP 874 HA TRP 874 -14.656 -5.869 -11.339 174 HB2 TRP 874 HB1 TRP 874 -15.889 -6.402 -14.056 175 HB3 TRP 874 HB2 TRP 874 -15.514 -4.832 -13.357 176 HD1 TRP 874 HD1 TRP 874 -13.900 -7.666 -15.228 177 HE1 TRP 874 HE1 TRP 874 -11.386 -7.166 -15.644 178 HE3 TRP 874 HE3 TRP 874 -13.434 -3.418 -12.449 179 HZ2 TRP 874 HZ2 TRP 874 -9.451 -5.277 -14.792 180 HZ3 TRP 874 HZ3 TRP 874 -11.226 -2.298 -12.281 181 HH2 TRP 874 HH2 TRP 874 -9.257 -3.151 -13.470 182 H ARG 875 HN ARG 875 -16.357 -4.616 -10.665 183 HA ARG 875 HA ARG 875 -19.150 -5.676 -10.846 184 HB2 ARG 875 HB1 ARG 875 -17.732 -4.521 -8.398 185 HB3 ARG 875 HB2 ARG 875 -19.475 -4.622 -8.531 186 HG2 ARG 875 HG1 ARG 875 -17.513 -6.941 -8.384 187 HG3 ARG 875 HG2 ARG 875 -18.717 -6.420 -7.205 188 HD2 ARG 875 HD1 ARG 875 -19.198 -7.851 -9.769 189 HD3 ARG 875 HD2 ARG 875 -19.594 -8.356 -8.132 190 HE ARG 875 HE ARG 875 -21.200 -6.303 -8.124 191 HH11 ARG 875 HH11 ARG 875 -20.420 -7.957 -11.084 192 HH12 ARG 875 HH12 ARG 875 -21.760 -7.196 -11.927 193 HH21 ARG 875 HH21 ARG 875 -23.034 -5.594 -9.210 194 HH22 ARG 875 HH22 ARG 875 -23.264 -6.100 -10.886 195 H ARG 876 HN ARG 876 -20.582 -4.220 -11.544 196 HA ARG 876 HA ARG 876 -19.899 -1.416 -12.079 197 HB2 ARG 876 HB1 ARG 876 -21.346 -2.553 -13.617 198 HB3 ARG 876 HB2 ARG 876 -22.417 -3.073 -12.319 199 HG2 ARG 876 HG1 ARG 876 -23.493 -1.305 -13.483 200 HG3 ARG 876 HG2 ARG 876 -23.067 -0.747 -11.884 201 HD2 ARG 876 HD1 ARG 876 -22.716 1.042 -13.454 202 HD3 ARG 876 HD2 ARG 876 -21.195 0.555 -12.750 203 HE ARG 876 HE ARG 876 -20.423 0.238 -14.890 204 HH11 ARG 876 HH11 ARG 876 -23.887 -0.397 -15.098 205 HH12 ARG 876 HH12 ARG 876 -23.810 -0.422 -16.853 206 HH21 ARG 876 HH21 ARG 876 -20.616 0.507 -17.145 207 HH22 ARG 876 HH22 ARG 876 -22.117 -0.008 -17.897 208 H ILE 877 HN ILE 877 -19.920 0.142 -10.686 209 HA ILE 877 HA ILE 877 -21.753 0.094 -8.322 210 HB ILE 877 HB ILE 877 -20.021 0.955 -6.902 211 HG12 ILE 877 HG11 ILE 877 -18.157 0.898 -9.315 212 HG13 ILE 877 HG12 ILE 877 -18.804 2.327 -8.530 213 HG21 ILE 877 HG21 ILE 877 -18.834 -1.409 -8.378 214 HG22 ILE 877 HG22 ILE 877 -18.668 -1.011 -6.651 215 HG23 ILE 877 HG23 ILE 877 -20.229 -1.537 -7.282 216 HD11 ILE 877 HD1 ILE 877 -16.483 1.914 -7.833 217 HD12 ILE 877 HD2 ILE 877 -17.631 1.913 -6.487 218 HD13 ILE 877 HD3 ILE 877 -16.983 0.387 -7.089 219 HA PRO 878 HA PRO 878 -22.597 4.308 -9.548 220 HB2 PRO 878 HB1 PRO 878 -23.318 5.509 -7.170 221 HB3 PRO 878 HB2 PRO 878 -24.378 4.348 -8.037 222 HG2 PRO 878 HG1 PRO 878 -22.494 3.808 -5.721 223 HG3 PRO 878 HG2 PRO 878 -24.196 3.282 -5.906 224 HD2 PRO 878 HD1 PRO 878 -22.107 1.639 -6.493 225 HD3 PRO 878 HD2 PRO 878 -23.608 1.609 -7.463 226 H ALA 879 HN ALA 879 -21.581 6.225 -9.723 227 HA ALA 879 HA ALA 879 -18.869 6.577 -9.124 228 HB1 ALA 879 HB1 ALA 879 -20.219 7.723 -10.878 229 HB2 ALA 879 HB2 ALA 879 -21.026 8.667 -9.602 230 HB3 ALA 879 HB3 ALA 879 -19.281 8.866 -9.882 231 H SER 880 HN SER 880 -21.549 7.090 -6.963 232 HA SER 880 HA SER 880 -20.457 8.874 -5.042 233 HB2 SER 880 HB1 SER 880 -22.241 6.456 -4.543 234 HB3 SER 880 HB2 SER 880 -22.091 7.894 -3.518 235 HG SER 880 HG1 SER 880 -23.060 9.121 -5.143 236 H VAL 881 HN VAL 881 -19.707 5.481 -5.679 237 HA VAL 881 HA VAL 881 -17.853 5.498 -3.312 238 HB VAL 881 HB VAL 881 -17.800 2.953 -4.622 239 HG11 VAL 881 HG11 VAL 881 -18.861 3.743 -1.873 240 HG12 VAL 881 HG12 VAL 881 -18.242 2.148 -2.360 241 HG13 VAL 881 HG13 VAL 881 -17.144 3.535 -2.262 242 HG21 VAL 881 HG21 VAL 881 -20.594 3.718 -3.696 243 HG22 VAL 881 HG22 VAL 881 -20.104 3.212 -5.334 244 HG23 VAL 881 HG23 VAL 881 -20.017 2.067 -4.002 245 H VAL 882 HN VAL 882 -17.872 5.300 -6.812 246 HA VAL 882 HA VAL 882 -15.225 4.429 -7.184 247 HB VAL 882 HB VAL 882 -15.309 5.130 -9.345 248 HG11 VAL 882 HG11 VAL 882 -17.712 4.906 -10.177 249 HG12 VAL 882 HG12 VAL 882 -16.936 3.572 -9.309 250 HG13 VAL 882 HG13 VAL 882 -18.112 4.604 -8.502 251 HG21 VAL 882 HG21 VAL 882 -16.686 6.916 -10.363 252 HG22 VAL 882 HG22 VAL 882 -16.956 7.524 -8.715 253 HG23 VAL 882 HG23 VAL 882 -15.326 7.415 -9.371 254 H GLY 883 HN GLY 883 -16.318 7.560 -6.267 255 HA2 GLY 883 HA1 GLY 883 -13.695 8.892 -6.378 256 HA3 GLY 883 HA2 GLY 883 -15.205 9.566 -5.765 257 H SER 884 HN SER 884 -14.824 6.615 -4.302 258 HA SER 884 HA SER 884 -13.497 7.724 -1.859 259 HB2 SER 884 HB1 SER 884 -15.984 7.636 -1.734 260 HB3 SER 884 HB2 SER 884 -15.914 5.895 -2.043 261 HG SER 884 HG1 SER 884 -14.925 7.322 0.213 262 H ILE 885 HN ILE 885 -13.848 4.905 -3.995 263 HA ILE 885 HA ILE 885 -12.022 3.254 -2.372 264 HB ILE 885 HB ILE 885 -13.359 2.943 -5.044 265 HG12 ILE 885 HG11 ILE 885 -13.872 0.676 -4.147 266 HG13 ILE 885 HG12 ILE 885 -12.967 1.006 -2.684 267 HG21 ILE 885 HG21 ILE 885 -12.083 0.885 -5.489 268 HG22 ILE 885 HG22 ILE 885 -11.077 2.323 -5.626 269 HG23 ILE 885 HG23 ILE 885 -10.959 1.291 -4.168 270 HD11 ILE 885 HD1 ILE 885 -14.630 2.743 -2.069 271 HD12 ILE 885 HD2 ILE 885 -15.469 2.464 -3.625 272 HD13 ILE 885 HD3 ILE 885 -15.413 1.188 -2.400 273 H ASP 886 HN ASP 886 -9.935 3.380 -2.300 274 HA ASP 886 HA ASP 886 -8.215 4.455 -4.418 275 HB2 ASP 886 HB1 ASP 886 -8.099 5.427 -1.523 276 HB3 ASP 886 HB2 ASP 886 -6.893 5.767 -2.746 277 H GLU 887 HN GLU 887 -5.799 3.870 -3.815 278 HA GLU 887 HA GLU 887 -5.577 1.170 -2.908 279 HB2 GLU 887 HB1 GLU 887 -3.969 2.336 -4.385 280 HB3 GLU 887 HB2 GLU 887 -3.455 3.351 -3.010 281 HG2 GLU 887 HG1 GLU 887 -2.418 1.516 -1.914 282 HG3 GLU 887 HG2 GLU 887 -3.369 0.333 -2.821 283 H SER 888 HN SER 888 -5.784 4.073 -1.049 284 HA SER 888 HA SER 888 -4.710 3.124 1.465 285 HB2 SER 888 HB1 SER 888 -5.085 5.470 0.882 286 HB3 SER 888 HB2 SER 888 -6.825 5.164 0.816 287 HG SER 888 HG1 SER 888 -5.113 5.069 3.094 288 H SER 889 HN SER 889 -7.635 2.529 -0.290 289 HA SER 889 HA SER 889 -8.796 0.758 1.808 290 HB2 SER 889 HB1 SER 889 -10.318 2.439 0.725 291 HB3 SER 889 HB2 SER 889 -9.974 1.702 -0.850 292 HG SER 889 HG1 SER 889 -11.912 0.922 0.272 293 H ARG 890 HN ARG 890 -9.582 -1.344 0.813 294 HA ARG 890 HA ARG 890 -8.565 -2.055 -1.810 295 HB2 ARG 890 HB1 ARG 890 -7.679 -3.772 0.541 296 HB3 ARG 890 HB2 ARG 890 -7.801 -4.360 -1.117 297 HG2 ARG 890 HG1 ARG 890 -6.332 -2.330 -1.763 298 HG3 ARG 890 HG2 ARG 890 -5.936 -2.243 -0.040 299 HD2 ARG 890 HD1 ARG 890 -5.096 -4.594 -0.182 300 HD3 ARG 890 HD2 ARG 890 -5.429 -4.599 -1.915 301 HE ARG 890 HE ARG 890 -3.205 -3.335 -0.532 302 HH11 ARG 890 HH11 ARG 890 -4.993 -3.103 -3.580 303 HH12 ARG 890 HH12 ARG 890 -3.656 -2.295 -4.364 304 HH21 ARG 890 HH21 ARG 890 -1.627 -2.248 -1.600 305 HH22 ARG 890 HH22 ARG 890 -1.904 -1.640 -3.207 306 H TRP 891 HN TRP 891 -10.279 -2.524 -2.839 307 HA TRP 891 HA TRP 891 -12.802 -3.226 -1.473 308 HB2 TRP 891 HB1 TRP 891 -12.659 -1.334 -3.063 309 HB3 TRP 891 HB2 TRP 891 -12.240 -2.477 -4.348 310 HD1 TRP 891 HD1 TRP 891 -15.037 -0.859 -2.627 311 HE1 TRP 891 HE1 TRP 891 -17.311 -1.694 -3.462 312 HE3 TRP 891 HE3 TRP 891 -13.443 -4.928 -5.277 313 HZ2 TRP 891 HZ2 TRP 891 -18.327 -4.145 -4.659 314 HZ3 TRP 891 HZ3 TRP 891 -15.112 -6.606 -6.098 315 HH2 TRP 891 HH2 TRP 891 -17.479 -6.276 -5.671 316 H ILE 892 HN ILE 892 -13.730 -5.298 -1.634 317 HA ILE 892 HA ILE 892 -12.738 -7.188 -3.714 318 HB ILE 892 HB ILE 892 -12.497 -8.987 -2.128 319 HG12 ILE 892 HG11 ILE 892 -12.818 -7.032 0.166 320 HG13 ILE 892 HG12 ILE 892 -14.149 -8.019 -0.438 321 HG21 ILE 892 HG21 ILE 892 -10.504 -7.629 -2.674 322 HG22 ILE 892 HG22 ILE 892 -10.790 -6.626 -1.233 323 HG23 ILE 892 HG23 ILE 892 -10.401 -8.339 -1.059 324 HD11 ILE 892 HD1 ILE 892 -11.593 -9.230 0.626 325 HD12 ILE 892 HD2 ILE 892 -13.131 -9.081 1.489 326 HD13 ILE 892 HD3 ILE 892 -13.047 -10.077 0.017 327 H CYS 893 HN CYS 893 -14.076 -9.099 -4.048 328 HA CYS 893 HA CYS 893 -16.778 -8.685 -4.309 329 HB2 CYS 893 HB1 CYS 893 -15.406 -11.364 -3.836 330 HB3 CYS 893 HB2 CYS 893 -16.993 -11.084 -4.563 331 H MET 894 HN MET 894 -15.207 -10.068 -1.319 332 HA MET 894 HA MET 894 -17.746 -10.845 -0.174 333 HB2 MET 894 HB1 MET 894 -15.505 -11.804 0.418 334 HB3 MET 894 HB2 MET 894 -15.125 -10.297 1.249 335 HG2 MET 894 HG1 MET 894 -15.828 -12.022 2.815 336 HG3 MET 894 HG2 MET 894 -16.905 -10.640 2.851 337 HE1 MET 894 HE1 MET 894 -16.904 -13.660 0.175 338 HE2 MET 894 HE2 MET 894 -16.411 -14.374 1.730 339 HE3 MET 894 HE3 MET 894 -17.987 -14.782 1.018 340 H ASN 895 HN ASN 895 -16.154 -7.781 -0.369 341 HA ASN 895 HA ASN 895 -17.793 -6.497 1.726 342 HB2 ASN 895 HB1 ASN 895 -16.006 -5.192 1.868 343 HB3 ASN 895 HB2 ASN 895 -15.229 -6.036 0.544 344 HD21 ASN 895 HD21 ASN 895 -16.017 -5.280 -1.748 345 HD22 ASN 895 HD22 ASN 895 -16.125 -3.530 -1.898 346 H ASN 896 HN ASN 896 -18.174 -7.298 -1.547 347 HA ASN 896 HA ASN 896 -19.289 -5.055 -2.740 348 HB2 ASN 896 HB1 ASN 896 -18.657 -7.165 -3.905 349 HB3 ASN 896 HB2 ASN 896 -20.047 -7.962 -3.162 350 HD21 ASN 896 HD21 ASN 896 -20.583 -8.551 -5.355 351 HD22 ASN 896 HD22 ASN 896 -21.637 -7.429 -6.186 352 H SER 897 HN SER 897 -21.095 -4.000 -2.736 353 HA SER 897 HA SER 897 -23.269 -4.201 -0.923 354 HB2 SER 897 HB1 SER 897 -22.984 -2.982 -3.700 355 HB3 SER 897 HB2 SER 897 -24.419 -2.789 -2.701 356 HG SER 897 HG1 SER 897 -22.929 -1.049 -2.406 357 H ASP 898 HN ASP 898 -22.935 -5.432 -4.220 358 HA ASP 898 HA ASP 898 -25.711 -6.355 -4.324 359 HB2 ASP 898 HB1 ASP 898 -23.602 -7.018 -6.363 360 HB3 ASP 898 HB2 ASP 898 -25.344 -6.958 -6.564 361 H LYS 899 HN LYS 899 -26.065 -7.936 -2.945 362 HA LYS 899 HA LYS 899 -24.479 -10.146 -2.256 363 HB2 LYS 899 HB1 LYS 899 -27.518 -9.904 -2.225 364 HB3 LYS 899 HB2 LYS 899 -26.578 -11.111 -1.350 365 HG2 LYS 899 HG1 LYS 899 -26.052 -8.155 -0.894 366 HG3 LYS 899 HG2 LYS 899 -27.396 -8.969 -0.095 367 HD2 LYS 899 HD1 LYS 899 -24.637 -10.157 0.028 368 HD3 LYS 899 HD2 LYS 899 -25.116 -8.863 1.146 369 HE2 LYS 899 HE1 LYS 899 -26.859 -11.303 0.735 370 HE3 LYS 899 HE2 LYS 899 -25.455 -11.398 1.816 371 HZ1 LYS 899 HZ1 LYS 899 -26.403 -9.571 3.110 372 HZ2 LYS 899 HZ2 LYS 899 -27.704 -9.476 2.122 373 HZ3 LYS 899 HZ3 LYS 899 -27.464 -10.805 3.037 374 H ARG 900 HN ARG 900 -26.292 -9.743 -5.134 375 HA ARG 900 HA ARG 900 -26.514 -12.507 -6.035 376 HB2 ARG 900 HB1 ARG 900 -26.498 -9.786 -7.404 377 HB3 ARG 900 HB2 ARG 900 -26.595 -11.294 -8.313 378 HG2 ARG 900 HG1 ARG 900 -28.686 -11.904 -7.152 379 HG3 ARG 900 HG2 ARG 900 -28.572 -10.452 -6.146 380 HD2 ARG 900 HD1 ARG 900 -30.158 -10.062 -7.940 381 HD3 ARG 900 HD2 ARG 900 -28.739 -9.024 -8.149 382 HE ARG 900 HE ARG 900 -28.537 -11.535 -9.621 383 HH11 ARG 900 HH11 ARG 900 -29.929 -8.331 -9.875 384 HH12 ARG 900 HH12 ARG 900 -29.926 -8.369 -11.617 385 HH21 ARG 900 HH21 ARG 900 -28.563 -11.519 -11.840 386 HH22 ARG 900 HH22 ARG 900 -29.187 -10.139 -12.693 387 H PHE 901 HN PHE 901 -23.860 -10.221 -5.972 388 HA PHE 901 HA PHE 901 -22.170 -12.158 -7.474 389 HB2 PHE 901 HB1 PHE 901 -21.909 -9.153 -7.715 390 HB3 PHE 901 HB2 PHE 901 -21.181 -10.363 -8.747 391 HD1 PHE 901 HD1 PHE 901 -22.437 -11.246 -10.695 392 HD2 PHE 901 HD2 PHE 901 -24.264 -8.491 -7.951 393 HE1 PHE 901 HE1 PHE 901 -24.249 -10.848 -12.318 394 HE2 PHE 901 HE2 PHE 901 -26.078 -8.065 -9.588 395 HZ PHE 901 HZ PHE 901 -26.077 -9.246 -11.777 396 H ALA 902 HN ALA 902 -22.459 -11.101 -4.559 397 HA ALA 902 HA ALA 902 -19.881 -10.034 -3.869 398 HB1 ALA 902 HB1 ALA 902 -22.014 -9.250 -2.836 399 HB2 ALA 902 HB2 ALA 902 -22.253 -10.867 -2.131 400 HB3 ALA 902 HB3 ALA 902 -20.889 -9.856 -1.616 401 H ASP 903 HN ASP 903 -19.461 -12.484 -4.987 402 HA ASP 903 HA ASP 903 -17.596 -13.359 -2.931 403 HB2 ASP 903 HB1 ASP 903 -19.750 -15.018 -3.134 404 HB3 ASP 903 HB2 ASP 903 -18.792 -15.671 -4.425 405 H CYS 904 HN CYS 904 -15.658 -14.187 -3.788 406 HA CYS 904 HA CYS 904 -14.896 -13.679 -6.476 407 HB2 CYS 904 HB1 CYS 904 -13.757 -15.602 -4.397 408 HB3 CYS 904 HB2 CYS 904 -12.925 -15.021 -5.838 409 H SER 905 HN SER 905 -17.010 -16.067 -5.266 410 HA SER 905 HA SER 905 -16.426 -18.110 -7.369 411 HB2 SER 905 HB1 SER 905 -18.317 -18.203 -4.997 412 HB3 SER 905 HB2 SER 905 -18.013 -19.509 -6.160 413 HG SER 905 HG1 SER 905 -16.749 -19.716 -4.232 414 H LYS 906 HN LYS 906 -18.596 -15.479 -6.659 415 HA LYS 906 HA LYS 906 -20.820 -16.451 -8.335 416 HB2 LYS 906 HB1 LYS 906 -20.168 -13.739 -7.148 417 HB3 LYS 906 HB2 LYS 906 -21.660 -14.151 -8.034 418 HG2 LYS 906 HG1 LYS 906 -20.844 -15.047 -5.296 419 HG3 LYS 906 HG2 LYS 906 -22.206 -14.033 -5.784 420 HD2 LYS 906 HD1 LYS 906 -21.818 -16.980 -6.421 421 HD3 LYS 906 HD2 LYS 906 -22.889 -16.323 -5.174 422 HE2 LYS 906 HE1 LYS 906 -24.167 -15.133 -6.980 423 HE3 LYS 906 HE2 LYS 906 -23.165 -15.929 -8.189 424 HZ1 LYS 906 HZ1 LYS 906 -25.233 -17.142 -7.829 425 HZ2 LYS 906 HZ2 LYS 906 -23.984 -18.077 -7.353 426 HZ3 LYS 906 HZ3 LYS 906 -24.919 -17.330 -6.241 427 H SER 907 HN SER 907 -21.667 -14.756 -9.907 428 HA SER 907 HA SER 907 -19.861 -14.634 -12.193 429 HB2 SER 907 HB1 SER 907 -21.968 -14.257 -13.386 430 HB3 SER 907 HB2 SER 907 -22.149 -15.586 -12.221 431 HG SER 907 HG1 SER 907 -23.907 -14.120 -12.121 432 H GLN 908 HN GLN 908 -20.841 -12.611 -13.645 433 HA GLN 908 HA GLN 908 -21.106 -10.046 -12.352 434 HB2 GLN 908 HB1 GLN 908 -19.216 -8.943 -13.344 435 HB3 GLN 908 HB2 GLN 908 -18.604 -10.333 -12.462 436 HG2 GLN 908 HG1 GLN 908 -18.888 -11.498 -14.904 437 HG3 GLN 908 HG2 GLN 908 -18.781 -9.838 -15.401 438 HE21 GLN 908 HE21 GLN 908 -16.672 -9.012 -15.650 439 HE22 GLN 908 HE22 GLN 908 -15.223 -9.852 -15.087 440 H GLU 909 HN GLU 909 -21.743 -8.346 -14.095 441 HA GLU 909 HA GLU 909 -23.564 -9.559 -15.962 442 HB2 GLU 909 HB1 GLU 909 -22.612 -6.666 -16.013 443 HB3 GLU 909 HB2 GLU 909 -24.014 -7.352 -16.797 444 HG2 GLU 909 HG1 GLU 909 -25.023 -6.387 -15.016 445 HG3 GLU 909 HG2 GLU 909 -24.824 -8.032 -14.417 446 H MET 910 HN MET 910 -20.215 -8.463 -16.405 447 HA MET 910 HA MET 910 -20.242 -9.680 -19.104 448 HB2 MET 910 HB1 MET 910 -19.143 -6.879 -18.658 449 HB3 MET 910 HB2 MET 910 -18.964 -7.885 -20.104 450 HG2 MET 910 HG1 MET 910 -21.419 -7.798 -20.450 451 HG3 MET 910 HG2 MET 910 -21.576 -6.767 -19.019 452 HE1 MET 910 HE1 MET 910 -22.904 -4.951 -20.362 453 HE2 MET 910 HE2 MET 910 -22.359 -4.260 -21.906 454 HE3 MET 910 HE3 MET 910 -22.806 -5.977 -21.811 455 H SER 911 HN SER 911 -18.537 -10.941 -19.326 456 HA SER 911 HA SER 911 -16.546 -11.263 -17.270 457 HB2 SER 911 HB1 SER 911 -16.233 -12.281 -20.076 458 HB3 SER 911 HB2 SER 911 -15.585 -12.950 -18.582 459 HG SER 911 HG1 SER 911 -17.442 -14.110 -19.356 460 H ASN 912 HN ASN 912 -14.202 -11.184 -17.662 461 HA ASN 912 HA ASN 912 -13.595 -8.446 -17.752 462 HB2 ASN 912 HB1 ASN 912 -11.796 -10.911 -17.767 463 HB3 ASN 912 HB2 ASN 912 -11.173 -9.268 -17.678 464 HD21 ASN 912 HD21 ASN 912 -10.268 -9.523 -15.612 465 HD22 ASN 912 HD22 ASN 912 -11.316 -9.454 -14.200 466 H GLU 913 HN GLU 913 -13.340 -10.758 -20.366 467 HA GLU 913 HA GLU 913 -11.960 -8.884 -22.174 468 HB2 GLU 913 HB1 GLU 913 -11.929 -10.700 -23.738 469 HB3 GLU 913 HB2 GLU 913 -11.297 -11.218 -22.191 470 HG2 GLU 913 HG1 GLU 913 -14.211 -11.746 -22.780 471 HG3 GLU 913 HG2 GLU 913 -13.006 -12.671 -23.659 472 H GLU 914 HN GLU 914 -15.188 -9.181 -21.291 473 HA GLU 914 HA GLU 914 -16.171 -7.985 -23.852 474 HB2 GLU 914 HB1 GLU 914 -17.580 -9.470 -21.610 475 HB3 GLU 914 HB2 GLU 914 -18.424 -8.263 -22.560 476 HG2 GLU 914 HG1 GLU 914 -18.933 -10.227 -23.629 477 HG3 GLU 914 HG2 GLU 914 -17.745 -9.443 -24.659 478 H ILE 915 HN ILE 915 -15.927 -7.356 -20.283 479 HA ILE 915 HA ILE 915 -17.167 -4.752 -20.513 480 HB ILE 915 HB ILE 915 -17.181 -5.498 -18.357 481 HG12 ILE 915 HG11 ILE 915 -15.889 -3.918 -16.986 482 HG13 ILE 915 HG12 ILE 915 -14.844 -3.529 -18.343 483 HG21 ILE 915 HG21 ILE 915 -15.191 -6.116 -16.975 484 HG22 ILE 915 HG22 ILE 915 -15.687 -7.258 -18.178 485 HG23 ILE 915 HG23 ILE 915 -14.254 -6.238 -18.488 486 HD11 ILE 915 HD1 ILE 915 -16.698 -2.574 -19.582 487 HD12 ILE 915 HD2 ILE 915 -17.843 -3.096 -18.350 488 HD13 ILE 915 HD3 ILE 915 -16.589 -1.863 -17.994 489 H ASN 916 HN ASN 916 -13.695 -5.612 -20.421 490 HA ASN 916 HA ASN 916 -12.699 -3.030 -20.805 491 HB2 ASN 916 HB1 ASN 916 -10.600 -4.049 -21.404 492 HB3 ASN 916 HB2 ASN 916 -11.343 -5.032 -20.158 493 HD21 ASN 916 HD21 ASN 916 -9.280 -6.141 -21.606 494 HD22 ASN 916 HD22 ASN 916 -9.936 -7.308 -22.736 495 H GLU 917 HN GLU 917 -13.956 -5.151 -23.317 496 HA GLU 917 HA GLU 917 -13.297 -3.583 -25.613 497 HB2 GLU 917 HB1 GLU 917 -15.210 -5.754 -24.912 498 HB3 GLU 917 HB2 GLU 917 -15.576 -4.790 -26.346 499 HG2 GLU 917 HG1 GLU 917 -13.247 -5.244 -27.177 500 HG3 GLU 917 HG2 GLU 917 -12.982 -6.297 -25.787 501 H GLU 918 HN GLU 918 -16.028 -3.283 -23.333 502 HA GLU 918 HA GLU 918 -17.484 -1.310 -24.883 503 HB2 GLU 918 HB1 GLU 918 -18.392 -2.687 -22.901 504 HB3 GLU 918 HB2 GLU 918 -17.527 -1.573 -21.843 505 HG2 GLU 918 HG1 GLU 918 -19.889 -0.948 -22.050 506 HG3 GLU 918 HG2 GLU 918 -18.841 0.323 -22.636 507 H LEU 919 HN LEU 919 -14.879 -1.079 -22.471 508 HA LEU 919 HA LEU 919 -14.836 1.857 -22.456 509 HB2 LEU 919 HB1 LEU 919 -12.969 -0.289 -21.417 510 HB3 LEU 919 HB2 LEU 919 -12.698 1.428 -21.162 511 HG LEU 919 HG LEU 919 -15.420 0.642 -20.353 512 HD11 LEU 919 HD11 LEU 919 -13.075 -0.818 -19.112 513 HD12 LEU 919 HD12 LEU 919 -14.683 -0.659 -18.344 514 HD13 LEU 919 HD13 LEU 919 -14.501 -1.508 -19.885 515 HD21 LEU 919 HD21 LEU 919 -13.067 1.834 -18.854 516 HD22 LEU 919 HD22 LEU 919 -14.376 2.722 -19.657 517 HD23 LEU 919 HD23 LEU 919 -14.740 1.698 -18.246 518 H GLY 920 HN GLY 920 -13.204 -0.735 -24.175 519 HA2 GLY 920 HA1 GLY 920 -12.303 -0.573 -26.361 520 HA3 GLY 920 HA2 GLY 920 -12.115 1.174 -26.187 521 H ILE 921 HN ILE 921 -11.028 -1.404 -23.978 522 HA ILE 921 HA ILE 921 -8.165 -0.622 -24.319 523 HB ILE 921 HB ILE 921 -7.926 -0.436 -21.901 524 HG12 ILE 921 HG11 ILE 921 -10.929 -0.905 -21.781 525 HG13 ILE 921 HG12 ILE 921 -9.671 -1.990 -21.190 526 HG21 ILE 921 HG21 ILE 921 -10.164 1.409 -22.796 527 HG22 ILE 921 HG22 ILE 921 -8.896 1.723 -21.593 528 HG23 ILE 921 HG23 ILE 921 -8.463 1.561 -23.296 529 HD11 ILE 921 HD1 ILE 921 -8.959 -0.261 -19.554 530 HD12 ILE 921 HD2 ILE 921 -10.376 0.719 -20.041 531 HD13 ILE 921 HD3 ILE 921 -10.614 -0.878 -19.320 532 H GLY 922 HN GLY 922 -6.736 -2.018 -22.930 533 HA2 GLY 922 HA1 GLY 922 -7.308 -4.882 -23.476 534 HA3 GLY 922 HA2 GLY 922 -5.767 -4.166 -23.018 535 H GLN 923 HN GLN 923 -6.800 -2.763 -20.722 536 HA GLN 923 HA GLN 923 -6.760 -2.917 -18.524 537 HB2 GLN 923 HB1 GLN 923 -8.495 -5.236 -19.015 538 HB3 GLN 923 HB2 GLN 923 -7.492 -5.461 -17.599 539 HG2 GLN 923 HG1 GLN 923 -9.294 -3.114 -18.168 540 HG3 GLN 923 HG2 GLN 923 -9.602 -4.470 -17.041 541 HE21 GLN 923 HE21 GLN 923 -9.628 -1.508 -16.450 542 HE22 GLN 923 HE22 GLN 923 -8.399 -1.375 -15.211 543 H ASP 924 HN ASP 924 -5.792 -3.822 -16.708 544 HA ASP 924 HA ASP 924 -2.976 -4.027 -17.347 545 HB2 ASP 924 HB1 ASP 924 -4.480 -4.207 -14.716 546 HB3 ASP 924 HB2 ASP 924 -2.744 -4.443 -14.808 547 H GLU 925 HN GLU 925 -5.271 -6.513 -16.207 548 HA GLU 925 HA GLU 925 -3.295 -8.454 -15.542 549 HB2 GLU 925 HB1 GLU 925 -5.887 -8.164 -14.998 550 HB3 GLU 925 HB2 GLU 925 -6.115 -9.123 -16.442 551 HG2 GLU 925 HG1 GLU 925 -6.139 -10.514 -14.443 552 HG3 GLU 925 HG2 GLU 925 -4.794 -10.941 -15.505 553 H ALA 926 HN ALA 926 -4.982 -7.728 -18.520 554 HA ALA 926 HA ALA 926 -3.909 -9.986 -20.065 555 HB1 ALA 926 HB1 ALA 926 -5.273 -7.415 -20.947 556 HB2 ALA 926 HB2 ALA 926 -5.021 -8.864 -21.940 557 HB3 ALA 926 HB3 ALA 926 -6.122 -8.931 -20.547 558 H ASP 927 HN ASP 927 -3.250 -6.475 -19.809 559 HA ASP 927 HA ASP 927 -1.055 -6.516 -21.693 560 HB2 ASP 927 HB1 ASP 927 -1.965 -4.386 -19.729 561 HB3 ASP 927 HB2 ASP 927 -0.753 -4.142 -20.980 562 H ALA 928 HN ALA 928 -0.954 -7.958 -18.868 563 HA ALA 928 HA ALA 928 1.363 -7.003 -17.509 564 HB1 ALA 928 HB1 ALA 928 0.090 -9.773 -17.548 565 HB2 ALA 928 HB2 ALA 928 1.256 -9.181 -16.348 566 HB3 ALA 928 HB3 ALA 928 -0.346 -8.430 -16.467 567 H1 ALA 1 HT1 ALA 1 -8.575 -1.528 -5.949 568 H2 ALA 1 HT2 ALA 1 -7.164 -0.704 -5.770 569 H3 ALA 1 HT3 ALA 1 -7.351 -2.212 -5.106 570 HA ALA 1 HA ALA 1 -5.976 -2.315 -7.066 571 HB1 ALA 1 HB1 ALA 1 -8.708 -3.654 -7.276 572 HB2 ALA 1 HB2 ALA 1 -7.328 -4.045 -8.329 573 HB3 ALA 1 HB3 ALA 1 -7.217 -4.339 -6.600 574 H ARG 2 HN ARG 2 -5.755 -2.064 -9.297 575 HA ARG 2 HA ARG 2 -6.397 0.212 -10.659 576 HB2 ARG 2 HB1 ARG 2 -4.777 -1.329 -11.544 577 HB3 ARG 2 HB2 ARG 2 -5.939 -2.659 -11.566 578 HG2 ARG 2 HG1 ARG 2 -5.548 -2.048 -13.813 579 HG3 ARG 2 HG2 ARG 2 -7.167 -1.568 -13.430 580 HD2 ARG 2 HD1 ARG 2 -5.685 0.730 -12.787 581 HD3 ARG 2 HD2 ARG 2 -4.794 0.086 -14.149 582 HE ARG 2 HE ARG 2 -7.605 1.094 -14.099 583 HH11 ARG 2 HH11 ARG 2 -5.105 -0.297 -16.201 584 HH12 ARG 2 HH12 ARG 2 -5.763 0.534 -17.585 585 HH21 ARG 2 HH21 ARG 2 -8.317 2.065 -15.845 586 HH22 ARG 2 HH22 ARG 2 -7.585 1.794 -17.407 587 H THR 3 HN THR 3 -8.171 1.127 -11.656 588 HA THR 3 HA THR 3 -10.075 -0.642 -12.935 589 HB THR 3 HB THR 3 -10.898 -0.541 -10.534 590 HG1 THR 3 HG1 THR 3 -12.471 -1.012 -11.940 591 HG21 THR 3 HG21 THR 3 -12.057 1.422 -9.719 592 HG22 THR 3 HG22 THR 3 -10.355 1.821 -10.002 593 HG23 THR 3 HG23 THR 3 -11.605 2.358 -11.151 594 H MLZ 4 HN MLZ 4 -12.194 1.121 -13.343 595 HA MLZ 4 HA MLZ 4 -11.288 3.261 -15.089 596 HB2 MLZ 4 HB1 MLZ 4 -11.475 2.055 -17.161 597 HB3 MLZ 4 HB2 MLZ 4 -10.423 1.100 -16.157 598 HG2 MLZ 4 HG1 MLZ 4 -13.320 0.545 -16.827 599 HG3 MLZ 4 HG2 MLZ 4 -11.871 -0.298 -17.390 600 HD2 MLZ 4 HD1 MLZ 4 -11.543 -1.019 -14.945 601 HD3 MLZ 4 HD2 MLZ 4 -13.172 -0.412 -14.680 602 HE2 MLZ 4 HE1 MLZ 4 -13.575 -2.683 -15.103 603 HE3 MLZ 4 HE2 MLZ 4 -13.892 -1.956 -16.672 604 HZ MLZ 4 HZ1 MLZ 4 -11.385 -3.315 -15.783 605 HCM1 MLZ 4 HC1 MLZ 4 -11.873 -5.029 -17.294 606 HCM2 MLZ 4 HC2 MLZ 4 -13.406 -4.668 -16.491 607 HCM3 MLZ 4 HC3 MLZ 4 -13.055 -4.022 -18.117 608 HZ2 MLZ 4 HZ2 MLZ 4 -11.499 -2.544 -17.239 609 H GLN 5 HN GLN 5 -13.204 3.783 -16.703 610 HA GLN 5 HA GLN 5 -15.825 3.467 -15.339 611 HB2 GLN 5 HB1 GLN 5 -14.722 5.411 -14.358 612 HB3 GLN 5 HB2 GLN 5 -14.460 6.107 -15.966 613 HG2 GLN 5 HG1 GLN 5 -16.835 6.434 -16.295 614 HG3 GLN 5 HG2 GLN 5 -17.233 5.441 -14.904 615 HE21 GLN 5 HE21 GLN 5 -18.272 6.940 -13.594 616 HE22 GLN 5 HE22 GLN 5 -17.527 8.406 -13.007 617 H THR 6 HN THR 6 -17.111 2.652 -16.772 618 HA THR 6 HA THR 6 -16.943 2.948 -19.613 619 HB THR 6 HB THR 6 -19.451 2.193 -19.420 620 HG1 THR 6 HG1 THR 6 -19.539 2.586 -17.136 621 HG21 THR 6 HG21 THR 6 -17.140 0.422 -18.581 622 HG22 THR 6 HG22 THR 6 -18.743 -0.146 -19.128 623 HG23 THR 6 HG23 THR 6 -17.704 0.744 -20.240 624 H ALA 7 HN ALA 7 -17.664 4.452 -20.968 625 HA ALA 7 HA ALA 7 -19.111 6.819 -20.052 626 HB1 ALA 7 HB1 ALA 7 -18.213 5.948 -22.832 627 HB2 ALA 7 HB2 ALA 7 -18.768 7.569 -22.363 628 HB3 ALA 7 HB3 ALA 7 -17.260 6.927 -21.691 629 H ARG 8 HN ARG 8 -20.323 3.884 -20.393 630 HA ARG 8 HA ARG 8 -23.008 4.734 -21.059 631 HB2 ARG 8 HB1 ARG 8 -21.717 3.921 -23.270 632 HB3 ARG 8 HB2 ARG 8 -21.931 2.324 -22.581 633 HG2 ARG 8 HG1 ARG 8 -23.874 2.448 -23.817 634 HG3 ARG 8 HG2 ARG 8 -24.491 3.165 -22.333 635 HD2 ARG 8 HD1 ARG 8 -23.622 4.540 -24.901 636 HD3 ARG 8 HD2 ARG 8 -25.229 4.537 -24.186 637 HE ARG 8 HE ARG 8 -22.869 6.154 -23.386 638 HH11 ARG 8 HH11 ARG 8 -26.218 5.445 -22.537 639 HH12 ARG 8 HH12 ARG 8 -26.212 6.698 -21.317 640 HH21 ARG 8 HH21 ARG 8 -22.942 7.538 -21.786 641 HH22 ARG 8 HH22 ARG 8 -24.397 7.793 -20.856 642 H TYR 9 HN TYR 9 -24.083 4.031 -19.391 643 HA TYR 9 HA TYR 9 -23.416 1.925 -17.657 644 HB2 TYR 9 HB1 TYR 9 -25.035 3.799 -17.241 645 HB3 TYR 9 HB2 TYR 9 -26.230 2.922 -18.185 646 HD1 TYR 9 HD1 TYR 9 -27.097 0.695 -17.337 647 HD2 TYR 9 HD2 TYR 9 -24.434 3.161 -15.017 648 HE1 TYR 9 HE1 TYR 9 -27.658 -0.625 -15.300 649 HE2 TYR 9 HE2 TYR 9 -25.014 1.849 -12.962 650 HH TYR 9 HH TYR 9 -27.327 -0.879 -13.043
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