NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
10893 | 1qkl | cing | 1-original | 1 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 801 HA MET 801 5.878 16.158 43.818 2 1HB MET 801 1HB MET 801 6.414 13.750 44.192 3 2HB MET 801 2HB MET 801 7.804 14.654 43.593 4 1HG MET 801 1HG MET 801 7.594 14.661 46.524 5 2HG MET 801 2HG MET 801 7.801 13.048 45.845 6 1HE MET 801 3HE MET 801 9.537 12.072 45.693 7 2HE MET 801 2HE MET 801 11.173 12.565 45.234 8 3HE MET 801 1HE MET 801 10.608 12.804 46.885 9 HA SER 802 HA SER 802 3.583 15.404 47.596 10 1HB SER 802 1HB SER 802 2.128 16.423 45.838 11 2HB SER 802 2HB SER 802 1.671 14.804 45.314 12 HG SER 802 HG SER 802 0.209 14.948 46.812 13 HA ASP 803 HA ASP 803 2.581 11.225 48.698 14 1HB ASP 803 1HB ASP 803 -0.249 11.928 47.873 15 2HB ASP 803 2HB ASP 803 0.177 10.427 48.696 16 HA ASN 804 HA ASN 804 2.350 9.396 44.536 17 1HB ASN 804 1HB ASN 804 4.747 10.604 44.891 18 2HB ASN 804 2HB ASN 804 5.268 8.918 44.870 19 2HD2 ASN 804 1HD2 ASN 804 5.958 8.442 42.778 20 1HD2 ASN 804 2HD2 ASN 804 5.144 8.892 41.359 21 HA GLU 805 HA GLU 805 2.982 5.262 46.202 22 1HB GLU 805 1HB GLU 805 0.902 6.364 47.439 23 2HB GLU 805 2HB GLU 805 -0.011 5.298 46.370 24 1HG GLU 805 1HG GLU 805 1.734 3.492 47.200 25 2HG GLU 805 2HG GLU 805 0.326 3.890 48.186 26 HA ASP 806 HA ASP 806 1.401 3.449 42.398 27 1HB ASP 806 1HB ASP 806 4.358 3.726 42.485 28 2HB ASP 806 2HB ASP 806 3.735 2.512 41.367 29 HA ASN 807 HA ASN 807 1.905 -0.507 44.848 30 1HB ASN 807 1HB ASN 807 -0.434 0.714 45.451 31 2HB ASN 807 2HB ASN 807 -1.035 -0.589 44.426 32 2HD2 ASN 807 1HD2 ASN 807 0.309 0.154 47.556 33 1HD2 ASN 807 2HD2 ASN 807 0.338 -1.437 48.146 34 HA PHE 808 HA PHE 808 1.011 -2.734 41.021 35 1HB PHE 808 1HB PHE 808 1.142 -0.010 40.068 36 2HB PHE 808 2HB PHE 808 1.836 -1.089 38.858 37 HD1 PHE 808 HD1 PHE 808 0.421 -3.451 38.733 38 HD2 PHE 808 HD2 PHE 808 -1.127 0.408 39.810 39 HE1 PHE 808 HE1 PHE 808 -1.857 -4.181 38.075 40 HE2 PHE 808 HE2 PHE 808 -3.405 -0.322 39.152 41 HZ PHE 808 HZ PHE 808 -3.769 -2.615 38.285 42 HA ASP 809 HA ASP 809 5.583 -3.037 40.143 43 1HB ASP 809 1HB ASP 809 4.517 -1.848 37.608 44 2HB ASP 809 2HB ASP 809 6.170 -2.465 37.625 45 1HA GLY 810 1HA GLY 810 7.241 1.698 38.208 46 2HA GLY 810 2HA GLY 810 7.235 1.501 39.961 47 HA ASP 811 HA ASP 811 11.007 -0.824 38.815 48 1HB ASP 811 1HB ASP 811 9.217 -2.706 37.390 49 2HB ASP 811 2HB ASP 811 10.938 -2.935 37.080 50 HA ASP 812 HA ASP 812 12.723 0.472 34.897 51 1HB ASP 812 1HB ASP 812 14.760 -1.458 36.045 52 2HB ASP 812 2HB ASP 812 15.139 -0.310 34.760 53 HA PHE 813 HA PHE 813 12.408 -3.234 32.191 54 1HB PHE 813 1HB PHE 813 11.279 -4.486 34.059 55 2HB PHE 813 2HB PHE 813 9.740 -3.815 33.517 56 HD1 PHE 813 HD1 PHE 813 12.743 -5.383 31.884 57 HD2 PHE 813 HD2 PHE 813 8.463 -5.268 32.235 58 HE1 PHE 813 HE1 PHE 813 12.555 -7.177 30.183 59 HE2 PHE 813 HE2 PHE 813 8.276 -7.062 30.533 60 HZ PHE 813 HZ PHE 813 10.321 -8.016 29.507 61 HA ASP 814 HA ASP 814 9.919 -0.989 29.299 62 1HB ASP 814 1HB ASP 814 8.673 -0.563 31.672 63 2HB ASP 814 2HB ASP 814 8.919 1.106 31.156 64 HA ASP 815 HA ASP 815 12.345 2.755 28.673 65 1HB ASP 815 1HB ASP 815 13.812 1.740 31.053 66 2HB ASP 815 2HB ASP 815 14.657 2.935 30.068 67 HA VAL 816 HA VAL 816 15.730 0.450 26.515 68 HB VAL 816 HB VAL 816 18.071 1.198 26.988 69 1HG1 VAL 816 1HG1 VAL 816 16.134 2.738 26.267 70 2HG1 VAL 816 2HG1 VAL 816 16.120 3.298 27.940 71 3HG1 VAL 816 3HG1 VAL 816 17.563 3.515 26.949 72 1HG2 VAL 816 1HG2 VAL 816 17.180 0.904 29.689 73 2HG2 VAL 816 2HG2 VAL 816 18.784 1.367 29.121 74 3HG2 VAL 816 3HG2 VAL 816 17.572 2.606 29.440 75 HA GLU 817 HA GLU 817 17.458 -3.336 28.116 76 1HB GLU 817 1HB GLU 817 15.404 -2.976 29.618 77 2HB GLU 817 2HB GLU 817 14.538 -4.030 28.500 78 1HG GLU 817 1HG GLU 817 15.833 -5.898 29.047 79 2HG GLU 817 2HG GLU 817 17.171 -4.917 29.645 80 HA GLU 818 HA GLU 818 15.967 -5.600 24.435 81 1HB GLU 818 1HB GLU 818 14.751 -2.994 23.741 82 2HB GLU 818 2HB GLU 818 15.098 -4.037 22.361 83 1HG GLU 818 1HG GLU 818 14.005 -5.867 23.999 84 2HG GLU 818 2HG GLU 818 13.033 -4.887 22.901 85 HA ASP 819 HA ASP 819 19.756 -4.884 22.219 86 1HB ASP 819 1HB ASP 819 18.730 -7.596 22.136 87 2HB ASP 819 2HB ASP 819 19.588 -7.222 20.642 88 HA GLU 820 HA GLU 820 18.105 -4.795 17.817 89 1HB GLU 820 1HB GLU 820 19.340 -2.801 19.028 90 2HB GLU 820 2HB GLU 820 20.596 -3.115 17.829 91 1HG GLU 820 1HG GLU 820 18.640 -3.070 16.109 92 2HG GLU 820 2HG GLU 820 17.749 -2.243 17.386 93 1HA GLY 821 1HA GLY 821 20.927 -8.564 16.482 94 2HA GLY 821 2HA GLY 821 20.717 -7.304 15.266 95 HA LEU 822 HA LEU 822 24.922 -6.330 16.448 96 1HB LEU 822 1HB LEU 822 24.143 -5.914 13.885 97 2HB LEU 822 2HB LEU 822 24.684 -4.289 14.299 98 HG LEU 822 HG LEU 822 26.544 -5.582 13.355 99 1HD1 LEU 822 1HD1 LEU 822 26.941 -3.933 15.216 100 2HD1 LEU 822 2HD1 LEU 822 26.905 -5.285 16.351 101 3HD1 LEU 822 3HD1 LEU 822 28.162 -5.202 15.116 102 1HD2 LEU 822 1HD2 LEU 822 25.418 -7.762 14.442 103 2HD2 LEU 822 2HD2 LEU 822 27.137 -7.697 14.054 104 3HD2 LEU 822 3HD2 LEU 822 26.595 -7.416 15.709 105 HA ASP 823 HA ASP 823 23.611 -2.008 18.022 106 1HB ASP 823 1HB ASP 823 26.009 -2.253 17.549 107 2HB ASP 823 2HB ASP 823 25.804 -1.439 15.998 108 HA ASP 824 HA ASP 824 21.333 0.370 14.790 109 1HB ASP 824 1HB ASP 824 22.629 2.074 13.515 110 2HB ASP 824 2HB ASP 824 23.398 1.681 15.052 111 HA LEU 825 HA LEU 825 21.185 -1.594 10.685 112 1HB LEU 825 1HB LEU 825 23.170 -3.145 11.720 113 2HB LEU 825 2HB LEU 825 21.924 -4.365 11.452 114 HG LEU 825 HG LEU 825 21.703 -3.120 9.111 115 1HD1 LEU 825 1HD1 LEU 825 24.402 -2.355 10.192 116 2HD1 LEU 825 2HD1 LEU 825 24.200 -2.626 8.461 117 3HD1 LEU 825 3HD1 LEU 825 23.255 -1.379 9.273 118 1HD2 LEU 825 1HD2 LEU 825 22.593 -5.521 9.864 119 2HD2 LEU 825 2HD2 LEU 825 22.804 -4.947 8.210 120 3HD2 LEU 825 3HD2 LEU 825 24.139 -4.840 9.358 121 HA GLU 826 HA GLU 826 18.492 -5.530 13.276 122 1HB GLU 826 1HB GLU 826 17.998 -2.957 13.738 123 2HB GLU 826 2HB GLU 826 16.965 -3.135 12.320 124 1HG GLU 826 1HG GLU 826 15.997 -5.211 13.480 125 2HG GLU 826 2HG GLU 826 16.805 -4.634 14.938 126 HA ASN 827 HA ASN 827 17.051 -6.333 9.104 127 1HB ASN 827 1HB ASN 827 19.695 -7.458 9.611 128 2HB ASN 827 2HB ASN 827 18.743 -8.502 8.558 129 2HD2 ASN 827 1HD2 ASN 827 18.225 -7.726 6.430 130 1HD2 ASN 827 2HD2 ASN 827 18.845 -6.272 5.811 131 HA ALA 828 HA ALA 828 15.106 -10.054 11.041 132 1HB ALA 828 1HB ALA 828 13.415 -7.636 11.556 133 2HB ALA 828 2HB ALA 828 12.639 -9.219 11.616 134 3HB ALA 828 3HB ALA 828 13.991 -8.858 12.690 135 HA GLU 829 HA GLU 829 12.434 -10.132 7.314 136 1HB GLU 829 1HB GLU 829 10.382 -9.149 9.227 137 2HB GLU 829 2HB GLU 829 9.852 -9.321 7.554 138 1HG GLU 829 1HG GLU 829 10.098 -11.606 7.564 139 2HG GLU 829 2HG GLU 829 11.447 -11.561 8.699 140 HA GLU 830 HA GLU 830 10.179 -5.279 6.559 141 1HB GLU 830 1HB GLU 830 12.996 -5.839 6.960 142 2HB GLU 830 2HB GLU 830 12.752 -5.037 5.408 143 1HG GLU 830 1HG GLU 830 12.009 -3.095 6.372 144 2HG GLU 830 2HG GLU 830 11.232 -3.937 7.713 145 HA GLU 831 HA GLU 831 9.827 -7.152 2.488 146 1HB GLU 831 1HB GLU 831 12.254 -7.875 2.970 147 2HB GLU 831 2HB GLU 831 11.623 -9.520 3.050 148 1HG GLU 831 1HG GLU 831 10.477 -8.710 0.738 149 2HG GLU 831 2HG GLU 831 12.061 -9.485 0.802 150 1HA GLY 832 1HA GLY 832 7.330 -10.890 2.667 151 2HA GLY 832 2HA GLY 832 6.339 -9.775 1.724 152 HA GLN 833 HA GLN 833 7.735 -11.578 -2.112 153 1HB GLN 833 1HB GLN 833 7.704 -13.485 -0.548 154 2HB GLN 833 2HB GLN 833 5.951 -13.604 -0.721 155 1HG GLN 833 1HG GLN 833 6.210 -14.013 -3.137 156 2HG GLN 833 2HG GLN 833 7.962 -13.899 -2.968 157 2HE2 GLN 833 1HE2 GLN 833 9.093 -15.735 -2.126 158 1HE2 GLN 833 2HE2 GLN 833 8.320 -17.192 -1.721 159 HA GLU 834 HA GLU 834 4.363 -11.091 -4.903 160 1HB GLU 834 1HB GLU 834 3.148 -10.752 -2.760 161 2HB GLU 834 2HB GLU 834 3.628 -9.057 -2.762 162 1HG GLU 834 1HG GLU 834 1.977 -8.500 -4.195 163 2HG GLU 834 2HG GLU 834 2.386 -9.821 -5.286 164 HA ASN 835 HA ASN 835 6.456 -7.566 -6.795 165 1HB ASN 835 1HB ASN 835 4.917 -8.592 -9.181 166 2HB ASN 835 2HB ASN 835 6.469 -7.777 -9.145 167 2HD2 ASN 835 1HD2 ASN 835 8.212 -9.147 -7.790 168 1HD2 ASN 835 2HD2 ASN 835 8.256 -10.798 -8.178 169 HA VAL 836 HA VAL 836 2.638 -5.409 -7.298 170 HB VAL 836 HB VAL 836 2.129 -4.616 -5.244 171 1HG1 VAL 836 1HG1 VAL 836 4.957 -5.500 -4.685 172 2HG1 VAL 836 2HG1 VAL 836 3.733 -5.199 -3.452 173 3HG1 VAL 836 3HG1 VAL 836 3.511 -6.505 -4.617 174 1HG2 VAL 836 1HG2 VAL 836 4.675 -3.001 -5.461 175 2HG2 VAL 836 2HG2 VAL 836 3.019 -2.419 -5.616 176 3HG2 VAL 836 3HG2 VAL 836 3.627 -2.948 -4.047 177 HA GLU 837 HA GLU 837 4.157 -1.754 -9.286 178 1HB GLU 837 1HB GLU 837 2.460 -3.488 -10.800 179 2HB GLU 837 2HB GLU 837 1.946 -1.834 -11.107 180 1HG GLU 837 1HG GLU 837 4.618 -1.496 -11.263 181 2HG GLU 837 2HG GLU 837 4.513 -3.179 -11.782 182 HA ILE 838 HA ILE 838 0.428 0.633 -8.316 183 HB ILE 838 HB ILE 838 2.984 1.400 -7.710 184 1HG1 ILE 838 1HG1 ILE 838 0.322 1.890 -6.710 185 2HG1 ILE 838 2HG1 ILE 838 1.373 3.267 -6.379 186 1HG2 ILE 838 1HG2 ILE 838 2.461 3.230 -9.615 187 2HG2 ILE 838 2HG2 ILE 838 1.803 4.065 -8.206 188 3HG2 ILE 838 3HG2 ILE 838 3.489 3.551 -8.227 189 1HD1 ILE 838 2HD1 ILE 838 2.383 0.482 -5.874 190 2HD1 ILE 838 3HD1 ILE 838 2.854 1.991 -5.100 191 3HD1 ILE 838 1HD1 ILE 838 1.313 1.238 -4.698 192 HA LEU 839 HA LEU 839 -0.521 4.004 -11.251 193 1HB LEU 839 1HB LEU 839 -1.477 1.316 -11.533 194 2HB LEU 839 2HB LEU 839 -2.815 2.403 -11.901 195 HG LEU 839 HG LEU 839 -0.778 3.646 -13.225 196 1HD1 LEU 839 1HD1 LEU 839 0.008 0.845 -12.777 197 2HD1 LEU 839 2HD1 LEU 839 0.029 1.326 -14.473 198 3HD1 LEU 839 3HD1 LEU 839 0.986 2.219 -13.292 199 1HD2 LEU 839 3HD2 LEU 839 -2.537 1.396 -14.255 200 2HD2 LEU 839 1HD2 LEU 839 -2.999 3.094 -14.136 201 3HD2 LEU 839 2HD2 LEU 839 -1.735 2.601 -15.262 202 HA PRO 840 HA PRO 840 -3.722 6.394 -9.386 203 1HB PRO 840 1HB PRO 840 -4.228 7.847 -11.037 204 2HB PRO 840 2HB PRO 840 -5.364 6.682 -11.723 205 1HG PRO 840 1HG PRO 840 -2.822 7.488 -12.779 206 2HG PRO 840 2HG PRO 840 -3.929 6.280 -13.440 207 1HD PRO 840 1HD PRO 840 -2.450 4.646 -12.856 208 2HD PRO 840 2HD PRO 840 -1.386 5.852 -12.089 209 HA SER 841 HA SER 841 -6.556 3.180 -8.221 210 1HB SER 841 1HB SER 841 -8.474 4.378 -6.986 211 2HB SER 841 2HB SER 841 -6.856 4.593 -6.338 212 HG SER 841 HG SER 841 -6.963 6.634 -6.822 213 1HA GLY 842 1HA GLY 842 -10.257 2.084 -10.470 214 2HA GLY 842 2HA GLY 842 -10.014 3.752 -10.985 215 HA GLU 843 HA GLU 843 -8.106 1.196 -14.235 216 1HB GLU 843 1HB GLU 843 -6.407 0.267 -12.017 217 2HB GLU 843 2HB GLU 843 -6.208 -0.675 -13.494 218 1HG GLU 843 1HG GLU 843 -6.271 2.310 -13.708 219 2HG GLU 843 2HG GLU 843 -4.801 1.541 -13.107 220 HA ARG 844 HA ARG 844 -10.165 -2.880 -13.973 221 1HB ARG 844 1HB ARG 844 -12.112 -1.037 -13.006 222 2HB ARG 844 2HB ARG 844 -12.865 -2.093 -14.202 223 1HG ARG 844 1HG ARG 844 -11.342 -3.866 -12.736 224 2HG ARG 844 2HG ARG 844 -11.877 -2.724 -11.504 225 1HD ARG 844 1HD ARG 844 -14.008 -3.499 -13.391 226 2HD ARG 844 2HD ARG 844 -13.390 -4.838 -12.405 227 HE ARG 844 HE ARG 844 -13.701 -3.203 -10.425 228 1HH1 ARG 844 1HH1 ARG 844 -14.894 -1.431 -12.841 229 2HH1 ARG 844 2HH1 ARG 844 -16.551 -1.421 -12.338 230 1HH2 ARG 844 1HH2 ARG 844 -16.124 -3.920 -9.972 231 2HH2 ARG 844 2HH2 ARG 844 -17.247 -2.830 -10.714 232 HA PRO 845 HA PRO 845 -12.465 -1.945 -18.112 233 1HB PRO 845 1HB PRO 845 -12.087 0.851 -18.684 234 2HB PRO 845 2HB PRO 845 -13.602 0.002 -18.366 235 1HG PRO 845 1HG PRO 845 -12.293 1.882 -16.672 236 2HG PRO 845 2HG PRO 845 -13.743 0.941 -16.310 237 1HD PRO 845 1HD PRO 845 -12.532 -0.244 -14.766 238 2HD PRO 845 2HD PRO 845 -11.034 0.573 -15.268 239 HA GLN 846 HA GLN 846 -8.648 -2.008 -20.350 240 1HB GLN 846 1HB GLN 846 -8.131 -0.097 -18.851 241 2HB GLN 846 2HB GLN 846 -7.410 -1.219 -17.697 242 1HG GLN 846 1HG GLN 846 -6.192 -1.814 -20.164 243 2HG GLN 846 2HG GLN 846 -5.458 -0.982 -18.794 244 2HE2 GLN 846 1HE2 GLN 846 -4.858 1.176 -19.149 245 1HE2 GLN 846 2HE2 GLN 846 -5.370 2.116 -20.466 246 HA ALA 847 HA ALA 847 -7.114 -5.927 -18.510 247 1HB ALA 847 1HB ALA 847 -5.893 -4.038 -16.545 248 2HB ALA 847 3HB ALA 847 -5.127 -4.948 -17.847 249 3HB ALA 847 2HB ALA 847 -5.546 -5.754 -16.335 250 HA ASN 848 HA ASN 848 -10.236 -6.398 -14.853 251 1HB ASN 848 1HB ASN 848 -12.278 -7.484 -15.766 252 2HB ASN 848 2HB ASN 848 -11.949 -5.949 -16.569 253 2HD2 ASN 848 1HD2 ASN 848 -11.171 -6.022 -18.807 254 1HD2 ASN 848 2HD2 ASN 848 -11.278 -7.442 -19.730 255 HA GLN 849 HA GLN 849 -8.934 -10.668 -14.857 256 1HB GLN 849 1HB GLN 849 -6.449 -10.705 -14.164 257 2HB GLN 849 2HB GLN 849 -6.853 -9.802 -15.620 258 1HG GLN 849 1HG GLN 849 -5.988 -7.941 -14.716 259 2HG GLN 849 2HG GLN 849 -7.140 -8.039 -13.389 260 2HE2 GLN 849 1HE2 GLN 849 -4.104 -7.401 -13.538 261 1HE2 GLN 849 2HE2 GLN 849 -3.460 -8.357 -12.298 262 HA LYS 850 HA LYS 850 -7.704 -10.963 -10.156 263 1HB LYS 850 1HB LYS 850 -9.481 -12.672 -9.672 264 2HB LYS 850 2HB LYS 850 -10.060 -11.378 -10.716 265 1HG LYS 850 1HG LYS 850 -9.268 -13.007 -12.648 266 2HG LYS 850 2HG LYS 850 -10.833 -13.242 -11.871 267 1HD LYS 850 1HD LYS 850 -8.366 -14.881 -11.703 268 2HD LYS 850 2HD LYS 850 -9.238 -14.659 -10.186 269 1HE LYS 850 1HE LYS 850 -11.018 -15.262 -12.452 270 2HE LYS 850 2HE LYS 850 -9.869 -16.564 -12.085 271 1HZ LYS 850 1HZ LYS 850 -11.558 -15.154 -10.087 272 2HZ LYS 850 2HZ LYS 850 -11.862 -16.711 -10.695 273 3HZ LYS 850 3HZ LYS 850 -10.474 -16.417 -9.760 274 HA ARG 851 HA ARG 851 -5.988 -15.217 -9.917 275 1HB ARG 851 1HB ARG 851 -4.491 -13.026 -10.466 276 2HB ARG 851 2HB ARG 851 -3.717 -13.571 -8.977 277 1HG ARG 851 1HG ARG 851 -2.717 -15.272 -10.064 278 2HG ARG 851 2HG ARG 851 -4.269 -15.846 -10.667 279 1HD ARG 851 1HD ARG 851 -3.688 -13.526 -12.180 280 2HD ARG 851 2HD ARG 851 -2.184 -14.465 -12.119 281 HE ARG 851 HE ARG 851 -4.572 -16.088 -12.616 282 1HH1 ARG 851 1HH1 ARG 851 -3.502 -13.673 -14.537 283 2HH1 ARG 851 2HH1 ARG 851 -2.896 -14.665 -15.821 284 1HH2 ARG 851 1HH2 ARG 851 -3.147 -17.616 -14.017 285 2HH2 ARG 851 2HH2 ARG 851 -2.694 -16.897 -15.527 286 HA ILE 852 HA ILE 852 -5.624 -15.236 -5.351 287 HB ILE 852 HB ILE 852 -3.573 -16.094 -4.918 288 1HG1 ILE 852 1HG1 ILE 852 -2.903 -14.056 -3.667 289 2HG1 ILE 852 2HG1 ILE 852 -1.550 -14.769 -4.535 290 1HG2 ILE 852 1HG2 ILE 852 -2.796 -14.503 -7.375 291 2HG2 ILE 852 2HG2 ILE 852 -1.896 -15.869 -6.717 292 3HG2 ILE 852 3HG2 ILE 852 -3.519 -16.112 -7.361 293 1HD1 ILE 852 1HD1 ILE 852 -2.763 -12.954 -6.339 294 2HD1 ILE 852 2HD1 ILE 852 -2.660 -12.117 -4.791 295 3HD1 ILE 852 3HD1 ILE 852 -1.207 -12.772 -5.529 296 HA THR 853 HA THR 853 -4.112 -11.022 -3.341 297 HB THR 853 HB THR 853 -4.930 -8.893 -4.422 298 HG1 THR 853 HG1 THR 853 -6.176 -10.715 -5.963 299 1HG2 THR 853 1HG2 THR 853 -2.624 -9.829 -4.750 300 2HG2 THR 853 2HG2 THR 853 -3.206 -10.627 -6.204 301 3HG2 THR 853 3HG2 THR 853 -3.196 -8.867 -6.114 302 HA THR 854 HA THR 854 -8.216 -11.403 -1.799 303 HB THR 854 HB THR 854 -6.631 -12.168 -0.034 304 HG1 THR 854 HG1 THR 854 -8.547 -12.179 0.862 305 1HG2 THR 854 1HG2 THR 854 -5.815 -9.466 -0.099 306 2HG2 THR 854 2HG2 THR 854 -6.539 -9.714 1.490 307 3HG2 THR 854 3HG2 THR 854 -5.205 -10.739 0.959 308 HA PRO 855 HA PRO 855 -9.789 -7.270 -2.054 309 1HB PRO 855 1HB PRO 855 -12.006 -7.762 -1.804 310 2HB PRO 855 2HB PRO 855 -11.800 -7.780 -0.049 311 1HG PRO 855 1HG PRO 855 -12.266 -10.013 -1.784 312 2HG PRO 855 2HG PRO 855 -11.996 -10.045 -0.039 313 1HD PRO 855 1HD PRO 855 -9.952 -11.014 -0.406 314 2HD PRO 855 2HD PRO 855 -10.171 -10.865 -2.166 315 HA TYR 856 HA TYR 856 -7.909 -5.085 1.272 316 1HB TYR 856 1HB TYR 856 -8.186 -7.795 1.990 317 2HB TYR 856 2HB TYR 856 -6.579 -7.324 2.510 318 HD1 TYR 856 HD1 TYR 856 -9.767 -5.391 2.267 319 HD2 TYR 856 HD2 TYR 856 -6.642 -6.884 4.795 320 HE1 TYR 856 HE1 TYR 856 -10.729 -4.159 4.153 321 HE2 TYR 856 HE2 TYR 856 -7.599 -5.655 6.698 322 HH TYR 856 HH TYR 856 -9.874 -3.229 6.386 323 HA MET 857 HA MET 857 -4.086 -5.196 -1.264 324 1HB MET 857 1HB MET 857 -4.955 -2.849 -1.536 325 2HB MET 857 2HB MET 857 -4.335 -2.470 0.064 326 1HG MET 857 1HG MET 857 -2.247 -2.186 -0.729 327 2HG MET 857 2HG MET 857 -2.294 -3.734 -1.564 328 1HE MET 857 3HE MET 857 -4.935 -0.993 -1.976 329 2HE MET 857 1HE MET 857 -3.497 -0.008 -1.685 330 3HE MET 857 2HE MET 857 -4.298 0.036 -3.253 331 HA THR 858 HA THR 858 -1.683 -5.271 2.570 332 HB THR 858 HB THR 858 0.065 -6.953 2.128 333 HG1 THR 858 HG1 THR 858 0.807 -6.006 0.167 334 1HG2 THR 858 1HG2 THR 858 -2.525 -7.222 0.581 335 2HG2 THR 858 2HG2 THR 858 -1.454 -8.573 0.955 336 3HG2 THR 858 3HG2 THR 858 -2.242 -7.685 2.259 337 HA LYS 859 HA LYS 859 0.883 -1.901 3.516 338 1HB LYS 859 1HB LYS 859 1.251 -3.462 5.370 339 2HB LYS 859 2HB LYS 859 2.764 -2.682 4.911 340 1HG LYS 859 1HG LYS 859 2.031 -5.280 3.606 341 2HG LYS 859 2HG LYS 859 3.627 -4.619 3.962 342 1HD LYS 859 1HD LYS 859 3.131 -4.949 6.412 343 2HD LYS 859 2HD LYS 859 3.235 -6.450 5.489 344 1HE LYS 859 1HE LYS 859 0.754 -5.044 6.510 345 2HE LYS 859 2HE LYS 859 0.673 -6.263 5.223 346 1HZ LYS 859 3HZ LYS 859 1.905 -7.790 6.641 347 2HZ LYS 859 1HZ LYS 859 1.948 -6.632 7.883 348 3HZ LYS 859 2HZ LYS 859 0.466 -7.301 7.401 349 HA TYR 860 HA TYR 860 4.738 -3.027 0.924 350 1HB TYR 860 1HB TYR 860 4.712 -5.442 0.770 351 2HB TYR 860 2HB TYR 860 3.423 -5.401 -0.422 352 HD1 TYR 860 HD1 TYR 860 5.783 -2.668 -0.650 353 HD2 TYR 860 HD2 TYR 860 5.098 -6.726 -1.900 354 HE1 TYR 860 HE1 TYR 860 7.412 -2.365 -2.474 355 HE2 TYR 860 HE2 TYR 860 6.742 -6.413 -3.727 356 HH TYR 860 HH TYR 860 7.642 -4.320 -5.068 357 HA GLU 861 HA GLU 861 2.067 -2.279 -3.124 358 1HB GLU 861 1HB GLU 861 -0.316 -2.728 -1.310 359 2HB GLU 861 2HB GLU 861 -0.465 -1.804 -2.805 360 1HG GLU 861 1HG GLU 861 0.839 -3.936 -3.781 361 2HG GLU 861 2HG GLU 861 -0.920 -3.890 -3.658 362 HA ARG 862 HA ARG 862 0.984 1.583 -0.436 363 1HB ARG 862 1HB ARG 862 0.617 -0.307 1.743 364 2HB ARG 862 2HB ARG 862 1.494 1.123 2.288 365 1HG ARG 862 1HG ARG 862 -0.279 2.539 1.187 366 2HG ARG 862 2HG ARG 862 -0.873 1.577 2.539 367 1HD ARG 862 1HD ARG 862 -1.150 -0.120 0.325 368 2HD ARG 862 2HD ARG 862 -2.457 0.809 1.086 369 HE ARG 862 HE ARG 862 -0.846 1.746 -1.249 370 1HH1 ARG 862 1HH1 ARG 862 -2.806 2.932 1.203 371 2HH1 ARG 862 2HH1 ARG 862 -3.946 3.710 0.157 372 1HH2 ARG 862 1HH2 ARG 862 -2.623 2.346 -2.742 373 2HH2 ARG 862 2HH2 ARG 862 -3.842 3.380 -2.074 374 HA ALA 863 HA ALA 863 5.419 1.401 1.306 375 1HB ALA 863 2HB ALA 863 6.404 -1.297 0.652 376 2HB ALA 863 3HB ALA 863 6.568 -0.380 2.149 377 3HB ALA 863 1HB ALA 863 5.090 -1.286 1.828 378 HA ARG 864 HA ARG 864 6.806 0.517 -3.115 379 1HB ARG 864 1HB ARG 864 4.598 -1.277 -3.326 380 2HB ARG 864 2HB ARG 864 4.458 -0.158 -4.683 381 1HG ARG 864 1HG ARG 864 7.220 -0.987 -4.288 382 2HG ARG 864 2HG ARG 864 6.166 -2.378 -4.523 383 1HD ARG 864 1HD ARG 864 5.193 -1.131 -6.542 384 2HD ARG 864 2HD ARG 864 6.564 -0.017 -6.379 385 HE ARG 864 HE ARG 864 7.163 -2.924 -6.444 386 1HH1 ARG 864 1HH1 ARG 864 9.429 -1.178 -6.783 387 2HH1 ARG 864 2HH1 ARG 864 9.586 -1.007 -8.499 388 1HH2 ARG 864 1HH2 ARG 864 6.374 -2.126 -9.171 389 2HH2 ARG 864 2HH2 ARG 864 7.856 -1.543 -9.851 390 HA VAL 865 HA VAL 865 2.914 3.545 -4.113 391 HB VAL 865 HB VAL 865 2.345 2.282 -1.534 392 1HG1 VAL 865 1HG1 VAL 865 2.003 5.219 -1.794 393 2HG1 VAL 865 2HG1 VAL 865 0.786 4.276 -0.938 394 3HG1 VAL 865 3HG1 VAL 865 2.459 4.256 -0.388 395 1HG2 VAL 865 1HG2 VAL 865 1.005 3.064 -3.962 396 2HG2 VAL 865 2HG2 VAL 865 0.713 1.703 -2.884 397 3HG2 VAL 865 3HG2 VAL 865 0.020 3.279 -2.513 398 HA LEU 866 HA LEU 866 4.929 6.269 -0.562 399 1HB LEU 866 1HB LEU 866 5.219 5.167 1.428 400 2HB LEU 866 2HB LEU 866 5.462 3.627 0.618 401 HG LEU 866 HG LEU 866 7.732 5.534 0.409 402 1HD1 LEU 866 1HD1 LEU 866 6.631 5.576 2.837 403 2HD1 LEU 866 2HD1 LEU 866 7.503 4.050 2.993 404 3HD1 LEU 866 3HD1 LEU 866 8.381 5.534 2.626 405 1HD2 LEU 866 1HD2 LEU 866 7.321 2.587 0.955 406 2HD2 LEU 866 2HD2 LEU 866 8.063 3.335 -0.458 407 3HD2 LEU 866 3HD2 LEU 866 8.907 3.346 1.089 408 1HA GLY 867 1HA GLY 867 9.056 5.072 -2.563 409 2HA GLY 867 2HA GLY 867 8.591 3.574 -3.370 410 HA THR 868 HA THR 868 7.200 5.909 -6.731 411 HB THR 868 HB THR 868 5.431 3.849 -6.574 412 HG1 THR 868 HG1 THR 868 6.409 4.311 -8.444 413 1HG2 THR 868 1HG2 THR 868 3.856 5.961 -5.819 414 2HG2 THR 868 2HG2 THR 868 3.656 6.003 -7.569 415 3HG2 THR 868 3HG2 THR 868 3.247 4.547 -6.663 416 HA ARG 869 HA ARG 869 4.232 9.007 -4.819 417 1HB ARG 869 1HB ARG 869 4.568 7.602 -2.138 418 2HB ARG 869 2HB ARG 869 3.765 9.166 -2.297 419 1HG ARG 869 1HG ARG 869 2.930 6.715 -3.868 420 2HG ARG 869 2HG ARG 869 2.210 7.159 -2.321 421 1HD ARG 869 1HD ARG 869 2.248 9.494 -3.999 422 2HD ARG 869 2HD ARG 869 0.837 8.608 -3.389 423 HE ARG 869 HE ARG 869 1.803 7.016 -5.455 424 1HH1 ARG 869 1HH1 ARG 869 -0.274 9.588 -5.023 425 2HH1 ARG 869 2HH1 ARG 869 -0.314 10.077 -6.685 426 1HH2 ARG 869 1HH2 ARG 869 2.250 7.951 -7.649 427 2HH2 ARG 869 2HH2 ARG 869 1.115 9.151 -8.170 428 HA ALA 870 HA ALA 870 8.050 10.219 -1.934 429 1HB ALA 870 3HB ALA 870 8.763 8.085 -1.109 430 2HB ALA 870 2HB ALA 870 10.135 8.728 -2.013 431 3HB ALA 870 1HB ALA 870 9.097 7.501 -2.739 432 HA LEU 871 HA LEU 871 10.239 10.632 -6.004 433 1HB LEU 871 1HB LEU 871 9.181 9.277 -8.274 434 2HB LEU 871 2HB LEU 871 10.746 9.035 -7.515 435 HG LEU 871 HG LEU 871 8.389 7.705 -6.259 436 1HD1 LEU 871 1HD1 LEU 871 9.583 7.024 -8.931 437 2HD1 LEU 871 2HD1 LEU 871 8.887 5.775 -7.899 438 3HD1 LEU 871 3HD1 LEU 871 7.882 7.108 -8.471 439 1HD2 LEU 871 1HD2 LEU 871 11.333 7.174 -6.691 440 2HD2 LEU 871 2HD2 LEU 871 10.467 7.347 -5.164 441 3HD2 LEU 871 3HD2 LEU 871 10.246 5.897 -6.144 442 HA GLN 872 HA GLN 872 6.107 11.861 -8.371 443 1HB GLN 872 1HB GLN 872 4.999 10.533 -6.027 444 2HB GLN 872 2HB GLN 872 4.310 12.144 -6.196 445 1HG GLN 872 1HG GLN 872 2.999 10.381 -7.404 446 2HG GLN 872 2HG GLN 872 3.583 11.649 -8.474 447 2HE2 GLN 872 1HE2 GLN 872 3.039 9.445 -9.867 448 1HE2 GLN 872 2HE2 GLN 872 4.422 8.529 -10.229 449 HA ILE 873 HA ILE 873 6.289 15.405 -5.043 450 HB ILE 873 HB ILE 873 7.359 14.901 -2.691 451 1HG1 ILE 873 1HG1 ILE 873 6.195 12.334 -2.458 452 2HG1 ILE 873 2HG1 ILE 873 7.198 12.269 -3.897 453 1HG2 ILE 873 1HG2 ILE 873 4.641 14.403 -3.777 454 2HG2 ILE 873 2HG2 ILE 873 4.948 14.021 -2.086 455 3HG2 ILE 873 3HG2 ILE 873 5.200 15.661 -2.676 456 1HD1 ILE 873 1HD1 ILE 873 8.342 13.566 -1.485 457 2HD1 ILE 873 2HD1 ILE 873 8.217 11.810 -1.503 458 3HD1 ILE 873 3HD1 ILE 873 9.136 12.644 -2.754 459 HA ALA 874 HA ALA 874 11.005 14.550 -4.404 460 1HB ALA 874 1HB ALA 874 10.747 12.174 -6.256 461 2HB ALA 874 3HB ALA 874 11.111 12.112 -4.533 462 3HB ALA 874 2HB ALA 874 12.279 12.803 -5.655 463 HA MET 875 HA MET 875 10.770 16.072 -8.781 464 1HB MET 875 1HB MET 875 8.639 14.291 -9.216 465 2HB MET 875 2HB MET 875 7.951 15.873 -9.583 466 1HG MET 875 1HG MET 875 10.040 16.290 -11.004 467 2HG MET 875 2HG MET 875 10.374 14.567 -10.833 468 1HE MET 875 3HE MET 875 9.286 17.101 -12.801 469 2HE MET 875 2HE MET 875 7.959 16.595 -13.855 470 3HE MET 875 1HE MET 875 7.619 17.215 -12.241 471 HA CYS 876 HA CYS 876 7.937 19.125 -6.644 472 1HB CYS 876 1HB CYS 876 7.042 19.318 -8.937 473 2HB CYS 876 2HB CYS 876 5.723 18.221 -8.536 474 HG CYS 876 HG CYS 876 4.676 20.515 -8.141 475 HA ALA 877 HA ALA 877 4.803 16.067 -4.568 476 1HB ALA 877 3HB ALA 877 4.889 18.039 -3.414 477 2HB ALA 877 1HB ALA 877 4.031 18.931 -4.669 478 3HB ALA 877 2HB ALA 877 3.145 17.851 -3.592 479 HA PRO 878 HA PRO 878 1.047 15.623 -7.563 480 1HB PRO 878 1HB PRO 878 1.990 12.961 -8.088 481 2HB PRO 878 2HB PRO 878 1.834 14.294 -9.237 482 1HG PRO 878 1HG PRO 878 4.241 13.179 -8.106 483 2HG PRO 878 2HG PRO 878 4.089 14.419 -9.342 484 1HD PRO 878 1HD PRO 878 4.960 14.766 -6.659 485 2HD PRO 878 2HD PRO 878 4.627 16.033 -7.858 486 HA VAL 879 HA VAL 879 1.347 11.925 -4.178 487 HB VAL 879 HB VAL 879 3.018 14.132 -3.065 488 1HG1 VAL 879 1HG1 VAL 879 1.358 13.485 -1.230 489 2HG1 VAL 879 2HG1 VAL 879 2.172 11.927 -1.213 490 3HG1 VAL 879 3HG1 VAL 879 3.061 13.396 -0.841 491 1HG2 VAL 879 1HG2 VAL 879 3.558 11.748 -4.291 492 2HG2 VAL 879 2HG2 VAL 879 4.694 12.619 -3.285 493 3HG2 VAL 879 3HG2 VAL 879 3.738 11.320 -2.594 494 HA MET 880 HA MET 880 -2.318 13.715 -2.483 495 1HB MET 880 1HB MET 880 -1.795 11.135 -1.636 496 2HB MET 880 2HB MET 880 -2.250 11.946 -0.138 497 1HG MET 880 1HG MET 880 -3.879 12.177 -2.677 498 2HG MET 880 2HG MET 880 -4.175 10.930 -1.467 499 1HE MET 880 1HE MET 880 -5.346 13.564 -2.917 500 2HE MET 880 2HE MET 880 -6.743 13.071 -1.963 501 3HE MET 880 3HE MET 880 -6.105 14.705 -1.799 502 HA VAL 881 HA VAL 881 -0.963 16.426 0.759 503 HB VAL 881 HB VAL 881 0.949 15.897 2.342 504 1HG1 VAL 881 1HG1 VAL 881 -1.443 14.737 2.218 505 2HG1 VAL 881 2HG1 VAL 881 -0.489 13.313 1.804 506 3HG1 VAL 881 3HG1 VAL 881 -0.218 14.143 3.334 507 1HG2 VAL 881 1HG2 VAL 881 2.216 14.785 0.284 508 2HG2 VAL 881 2HG2 VAL 881 2.465 14.194 1.926 509 3HG2 VAL 881 3HG2 VAL 881 1.370 13.340 0.840 510 HA GLU 882 HA GLU 882 2.382 18.731 -1.136 511 1HB GLU 882 1HB GLU 882 -0.017 20.020 -0.230 512 2HB GLU 882 2HB GLU 882 1.315 21.170 -0.115 513 1HG GLU 882 1HG GLU 882 1.159 19.513 -2.589 514 2HG GLU 882 2HG GLU 882 -0.034 20.799 -2.400 515 HA LEU 883 HA LEU 883 4.700 19.419 2.888 516 1HB LEU 883 1HB LEU 883 5.609 17.209 2.342 517 2HB LEU 883 2HB LEU 883 6.446 17.873 0.941 518 HG LEU 883 HG LEU 883 7.242 19.502 3.086 519 1HD1 LEU 883 1HD1 LEU 883 6.241 17.469 4.418 520 2HD1 LEU 883 2HD1 LEU 883 7.724 16.657 3.919 521 3HD1 LEU 883 3HD1 LEU 883 7.807 18.129 4.887 522 1HD2 LEU 883 1HD2 LEU 883 8.428 18.289 1.012 523 2HD2 LEU 883 2HD2 LEU 883 9.353 18.877 2.393 524 3HD2 LEU 883 3HD2 LEU 883 8.926 17.170 2.281 525 HA GLU 884 HA GLU 884 6.782 22.501 0.096 526 1HB GLU 884 1HB GLU 884 8.703 21.023 1.601 527 2HB GLU 884 2HB GLU 884 9.553 21.802 0.267 528 1HG GLU 884 1HG GLU 884 7.549 23.440 1.751 529 2HG GLU 884 2HG GLU 884 9.071 23.086 2.567 530 1HA GLY 885 1HA GLY 885 7.180 19.951 -4.115 531 2HA GLY 885 2HA GLY 885 8.551 21.031 -3.853 532 HA GLU 886 HA GLU 886 10.095 16.639 -2.019 533 1HB GLU 886 1HB GLU 886 10.649 16.889 -4.326 534 2HB GLU 886 2HB GLU 886 11.597 18.342 -4.019 535 1HG GLU 886 1HG GLU 886 13.185 16.906 -2.668 536 2HG GLU 886 2HG GLU 886 12.293 15.497 -3.241 537 HA THR 887 HA THR 887 13.715 17.736 0.399 538 HB THR 887 HB THR 887 11.095 18.065 1.906 539 HG1 THR 887 HG1 THR 887 11.324 20.127 1.358 540 1HG2 THR 887 1HG2 THR 887 13.822 18.012 2.958 541 2HG2 THR 887 2HG2 THR 887 13.029 19.560 3.255 542 3HG2 THR 887 3HG2 THR 887 12.288 18.066 3.827 543 HA ASP 888 HA ASP 888 12.854 14.145 3.253 544 1HB ASP 888 1HB ASP 888 10.445 15.146 3.657 545 2HB ASP 888 2HB ASP 888 9.955 13.673 2.825 546 HA PRO 889 HA PRO 889 13.153 11.026 0.097 547 1HB PRO 889 1HB PRO 889 13.512 8.948 2.050 548 2HB PRO 889 2HB PRO 889 14.753 9.766 1.097 549 1HG PRO 889 1HG PRO 889 14.312 10.003 3.895 550 2HG PRO 889 2HG PRO 889 15.448 10.930 2.911 551 1HD PRO 889 1HD PRO 889 14.179 12.782 3.306 552 2HD PRO 889 2HD PRO 889 12.912 11.802 4.087 553 HA LEU 890 HA LEU 890 8.816 9.685 0.973 554 1HB LEU 890 1HB LEU 890 10.341 7.812 1.626 555 2HB LEU 890 2HB LEU 890 8.698 7.585 2.199 556 HG LEU 890 HG LEU 890 10.497 7.017 3.880 557 1HD1 LEU 890 1HD1 LEU 890 11.949 9.008 3.241 558 2HD1 LEU 890 2HD1 LEU 890 10.829 10.001 4.173 559 3HD1 LEU 890 3HD1 LEU 890 11.743 8.722 4.967 560 1HD2 LEU 890 1HD2 LEU 890 8.036 8.004 4.292 561 2HD2 LEU 890 2HD2 LEU 890 9.125 7.600 5.617 562 3HD2 LEU 890 3HD2 LEU 890 8.975 9.272 5.081 563 HA LEU 891 HA LEU 891 7.618 11.456 5.491 564 1HB LEU 891 1HB LEU 891 8.627 13.530 5.615 565 2HB LEU 891 2HB LEU 891 8.536 13.760 3.879 566 HG LEU 891 HG LEU 891 7.133 15.343 5.258 567 1HD1 LEU 891 1HD1 LEU 891 6.627 14.330 2.773 568 2HD1 LEU 891 2HD1 LEU 891 5.111 13.974 3.604 569 3HD1 LEU 891 3HD1 LEU 891 5.702 15.630 3.521 570 1HD2 LEU 891 1HD2 LEU 891 6.296 12.982 6.491 571 2HD2 LEU 891 2HD2 LEU 891 5.611 14.589 6.734 572 3HD2 LEU 891 3HD2 LEU 891 4.906 13.502 5.539 573 HA ILE 892 HA ILE 892 4.212 12.771 2.326 574 HB ILE 892 HB ILE 892 6.511 12.566 0.493 575 1HG1 ILE 892 1HG1 ILE 892 4.169 14.239 -0.118 576 2HG1 ILE 892 2HG1 ILE 892 4.937 14.553 1.437 577 1HG2 ILE 892 1HG2 ILE 892 3.812 11.547 -0.252 578 2HG2 ILE 892 2HG2 ILE 892 4.706 12.505 -1.417 579 3HG2 ILE 892 3HG2 ILE 892 5.407 11.021 -0.794 580 1HD1 ILE 892 1HD1 ILE 892 6.677 14.142 -0.927 581 2HD1 ILE 892 2HD1 ILE 892 5.829 15.680 -0.791 582 3HD1 ILE 892 3HD1 ILE 892 6.932 15.161 0.484 583 HA ALA 893 HA ALA 893 4.291 8.346 0.568 584 1HB ALA 893 3HB ALA 893 6.232 7.590 -0.308 585 2HB ALA 893 1HB ALA 893 7.193 8.378 0.938 586 3HB ALA 893 2HB ALA 893 6.459 6.813 1.252 587 HA MET 894 HA MET 894 4.673 7.015 5.121 588 1HB MET 894 1HB MET 894 6.770 7.946 5.808 589 2HB MET 894 2HB MET 894 6.202 9.594 5.564 590 1HG MET 894 1HG MET 894 4.686 9.376 7.485 591 2HG MET 894 2HG MET 894 5.199 7.705 7.717 592 1HE MET 894 1HE MET 894 6.344 11.032 6.870 593 2HE MET 894 2HE MET 894 6.866 11.653 8.433 594 3HE MET 894 3HE MET 894 8.063 11.052 7.289 595 HA LYS 895 HA LYS 895 1.962 10.814 6.550 596 1HB LYS 895 1HB LYS 895 3.130 12.759 5.863 597 2HB LYS 895 2HB LYS 895 3.166 12.245 4.178 598 1HG LYS 895 1HG LYS 895 1.547 13.994 4.305 599 2HG LYS 895 2HG LYS 895 0.630 12.495 4.179 600 1HD LYS 895 1HD LYS 895 0.525 12.488 6.724 601 2HD LYS 895 2HD LYS 895 1.160 14.132 6.670 602 1HE LYS 895 1HE LYS 895 -0.784 14.999 5.721 603 2HE LYS 895 2HE LYS 895 -1.230 13.450 4.977 604 1HZ LYS 895 1HZ LYS 895 -1.121 13.909 7.910 605 2HZ LYS 895 2HZ LYS 895 -2.547 14.007 6.998 606 3HZ LYS 895 3HZ LYS 895 -1.712 12.532 7.109 607 HA GLU 896 HA GLU 896 -0.360 10.064 2.261 608 1HB GLU 896 1HB GLU 896 2.204 8.700 1.485 609 2HB GLU 896 2HB GLU 896 0.705 8.185 0.723 610 1HG GLU 896 1HG GLU 896 0.930 11.092 0.811 611 2HG GLU 896 2HG GLU 896 2.273 10.349 -0.057 612 HA LEU 897 HA LEU 897 -0.677 5.574 3.601 613 1HB LEU 897 1HB LEU 897 1.657 4.751 3.337 614 2HB LEU 897 2HB LEU 897 2.034 5.367 4.946 615 HG LEU 897 HG LEU 897 1.228 2.812 4.489 616 1HD1 LEU 897 1HD1 LEU 897 0.938 4.671 6.824 617 2HD1 LEU 897 2HD1 LEU 897 0.313 3.028 6.956 618 3HD1 LEU 897 3HD1 LEU 897 2.024 3.297 6.620 619 1HD2 LEU 897 1HD2 LEU 897 -1.044 3.871 3.733 620 2HD2 LEU 897 2HD2 LEU 897 -1.088 2.508 4.842 621 3HD2 LEU 897 3HD2 LEU 897 -1.309 4.139 5.453 622 HA LYS 898 HA LYS 898 -0.053 6.835 8.340 623 1HB LYS 898 1HB LYS 898 1.929 8.258 8.003 624 2HB LYS 898 2HB LYS 898 0.938 9.416 7.120 625 1HG LYS 898 1HG LYS 898 1.349 10.113 9.488 626 2HG LYS 898 2HG LYS 898 -0.361 9.914 9.111 627 1HD LYS 898 1HD LYS 898 -0.280 7.626 10.087 628 2HD LYS 898 2HD LYS 898 0.123 8.873 11.266 629 1HE LYS 898 1HE LYS 898 2.120 7.169 9.723 630 2HE LYS 898 2HE LYS 898 2.539 8.434 10.895 631 1HZ LYS 898 3HZ LYS 898 1.213 7.273 12.560 632 2HZ LYS 898 1HZ LYS 898 0.855 6.045 11.442 633 3HZ LYS 898 2HZ LYS 898 2.452 6.272 11.975 634 HA ALA 899 HA ALA 899 -3.368 9.827 6.877 635 1HB ALA 899 2HB ALA 899 -3.592 10.906 4.651 636 2HB ALA 899 3HB ALA 899 -1.942 11.066 5.252 637 3HB ALA 899 1HB ALA 899 -2.316 9.864 4.018 638 HA ARG 900 HA ARG 900 -3.660 5.355 3.937 639 1HB ARG 900 1HB ARG 900 -4.926 4.440 5.616 640 2HB ARG 900 2HB ARG 900 -4.517 5.878 6.543 641 1HG ARG 900 1HG ARG 900 -6.582 6.951 5.378 642 2HG ARG 900 2HG ARG 900 -7.032 5.293 4.990 643 1HD ARG 900 1HD ARG 900 -6.359 6.171 7.813 644 2HD ARG 900 2HD ARG 900 -8.013 6.174 7.169 645 HE ARG 900 HE ARG 900 -7.582 3.706 6.616 646 1HH1 ARG 900 1HH1 ARG 900 -4.708 3.808 7.601 647 2HH1 ARG 900 2HH1 ARG 900 -4.862 3.096 9.172 648 1HH2 ARG 900 1HH2 ARG 900 -8.307 3.471 9.296 649 2HH2 ARG 900 2HH2 ARG 900 -6.898 2.905 10.132 650 HA LYS 901 HA LYS 901 -6.559 8.315 2.018 651 1HB LYS 901 1HB LYS 901 -4.339 10.064 2.698 652 2HB LYS 901 2HB LYS 901 -5.010 10.453 1.114 653 1HG LYS 901 1HG LYS 901 -6.233 11.714 2.751 654 2HG LYS 901 2HG LYS 901 -7.289 10.426 2.165 655 1HD LYS 901 1HD LYS 901 -6.688 9.044 4.118 656 2HD LYS 901 2HD LYS 901 -5.651 10.340 4.713 657 1HE LYS 901 1HE LYS 901 -8.111 11.601 4.233 658 2HE LYS 901 2HE LYS 901 -7.484 11.111 5.820 659 1HZ LYS 901 1HZ LYS 901 -8.969 9.338 3.943 660 2HZ LYS 901 2HZ LYS 901 -8.444 8.933 5.503 661 3HZ LYS 901 3HZ LYS 901 -9.662 10.099 5.294 662 HA ILE 902 HA ILE 902 -3.014 8.023 -1.568 663 HB ILE 902 HB ILE 902 -2.649 5.344 -0.198 664 1HG1 ILE 902 1HG1 ILE 902 -0.343 7.131 -0.560 665 2HG1 ILE 902 2HG1 ILE 902 -1.579 7.789 0.512 666 1HG2 ILE 902 1HG2 ILE 902 -1.547 6.535 -2.745 667 2HG2 ILE 902 2HG2 ILE 902 -0.681 5.268 -1.874 668 3HG2 ILE 902 3HG2 ILE 902 -2.298 4.957 -2.507 669 1HD1 ILE 902 1HD1 ILE 902 -0.697 4.934 0.818 670 2HD1 ILE 902 2HD1 ILE 902 0.267 6.235 1.515 671 3HD1 ILE 902 3HD1 ILE 902 -1.408 6.013 2.016 672 HA PRO 903 HA PRO 903 -6.810 5.897 -3.101 673 1HB PRO 903 1HB PRO 903 -7.022 7.992 -5.061 674 2HB PRO 903 2HB PRO 903 -8.029 7.767 -3.626 675 1HG PRO 903 1HG PRO 903 -6.257 9.896 -4.046 676 2HG PRO 903 2HG PRO 903 -6.954 9.433 -2.488 677 1HD PRO 903 1HD PRO 903 -4.750 9.094 -1.860 678 2HD PRO 903 2HD PRO 903 -4.208 8.917 -3.549 679 HA ILE 904 HA ILE 904 -4.952 4.733 -6.934 680 HB ILE 904 HB ILE 904 -2.862 5.349 -5.068 681 1HG1 ILE 904 1HG1 ILE 904 -2.372 5.515 -7.974 682 2HG1 ILE 904 2HG1 ILE 904 -3.859 6.285 -7.430 683 1HG2 ILE 904 1HG2 ILE 904 -2.321 3.146 -7.051 684 2HG2 ILE 904 2HG2 ILE 904 -1.051 4.254 -6.539 685 3HG2 ILE 904 3HG2 ILE 904 -1.862 3.235 -5.352 686 1HD1 ILE 904 2HD1 ILE 904 -2.312 7.290 -5.550 687 2HD1 ILE 904 3HD1 ILE 904 -1.021 6.931 -6.696 688 3HD1 ILE 904 1HD1 ILE 904 -2.329 8.023 -7.154 689 HA ILE 905 HA ILE 905 -5.182 0.373 -6.986 690 HB ILE 905 HB ILE 905 -6.252 1.259 -9.048 691 1HG1 ILE 905 1HG1 ILE 905 -4.864 -0.876 -10.379 692 2HG1 ILE 905 2HG1 ILE 905 -5.051 -1.299 -8.677 693 1HG2 ILE 905 1HG2 ILE 905 -3.431 1.090 -10.157 694 2HG2 ILE 905 2HG2 ILE 905 -4.878 1.368 -11.126 695 3HG2 ILE 905 3HG2 ILE 905 -4.376 2.560 -9.931 696 1HD1 ILE 905 1HD1 ILE 905 -7.347 -0.197 -10.281 697 2HD1 ILE 905 2HD1 ILE 905 -6.984 -1.922 -10.256 698 3HD1 ILE 905 3HD1 ILE 905 -7.401 -1.083 -8.759 699 HA ILE 906 HA ILE 906 -0.929 -0.813 -8.034 700 HB ILE 906 HB ILE 906 -1.994 -1.714 -5.377 701 1HG1 ILE 906 1HG1 ILE 906 0.237 0.045 -6.381 702 2HG1 ILE 906 2HG1 ILE 906 0.080 -0.388 -4.680 703 1HG2 ILE 906 1HG2 ILE 906 0.418 -2.833 -6.749 704 2HG2 ILE 906 2HG2 ILE 906 0.543 -2.459 -5.032 705 3HG2 ILE 906 3HG2 ILE 906 -0.673 -3.604 -5.598 706 1HD1 ILE 906 1HD1 ILE 906 -2.475 0.403 -5.289 707 2HD1 ILE 906 2HD1 ILE 906 -1.255 1.451 -4.565 708 3HD1 ILE 906 3HD1 ILE 906 -1.519 1.476 -6.306 709 HA ARG 907 HA ARG 907 -1.695 -4.987 -9.415 710 1HB ARG 907 1HB ARG 907 0.822 -3.898 -10.619 711 2HB ARG 907 2HB ARG 907 0.201 -5.476 -11.083 712 1HG ARG 907 1HG ARG 907 -0.686 -3.831 -12.621 713 2HG ARG 907 2HG ARG 907 -1.993 -4.403 -11.588 714 1HD ARG 907 1HD ARG 907 -2.300 -2.345 -10.640 715 2HD ARG 907 2HD ARG 907 -0.555 -2.039 -10.533 716 HE ARG 907 HE ARG 907 -0.665 -1.005 -12.655 717 1HH1 ARG 907 1HH1 ARG 907 -1.434 -2.706 -14.635 718 2HH1 ARG 907 2HH1 ARG 907 -3.104 -2.396 -14.973 719 1HH2 ARG 907 1HH2 ARG 907 -3.674 -0.733 -11.985 720 2HH2 ARG 907 2HH2 ARG 907 -4.372 -1.280 -13.472 721 HA ARG 908 HA ARG 908 1.103 -7.077 -6.626 722 1HB ARG 908 1HB ARG 908 -1.324 -8.797 -6.220 723 2HB ARG 908 2HB ARG 908 -0.107 -8.320 -5.052 724 1HG ARG 908 1HG ARG 908 -1.077 -5.964 -5.171 725 2HG ARG 908 2HG ARG 908 -2.413 -6.651 -6.097 726 1HD ARG 908 1HD ARG 908 -2.992 -6.548 -3.649 727 2HD ARG 908 2HD ARG 908 -2.892 -8.230 -4.198 728 HE ARG 908 HE ARG 908 -0.316 -7.225 -3.299 729 1HH1 ARG 908 1HH1 ARG 908 -3.367 -7.855 -1.899 730 2HH1 ARG 908 2HH1 ARG 908 -2.745 -8.871 -0.643 731 1HH2 ARG 908 1HH2 ARG 908 0.503 -8.842 -1.849 732 2HH2 ARG 908 2HH2 ARG 908 -0.560 -9.427 -0.613 733 HA TYR 909 HA TYR 909 1.133 -10.273 -9.866 734 1HB TYR 909 1HB TYR 909 4.030 -9.547 -9.947 735 2HB TYR 909 2HB TYR 909 3.027 -10.205 -11.220 736 HD1 TYR 909 HD1 TYR 909 4.044 -7.103 -9.477 737 HD2 TYR 909 HD2 TYR 909 1.626 -8.782 -12.589 738 HE1 TYR 909 HE1 TYR 909 3.799 -4.877 -10.468 739 HE2 TYR 909 HE2 TYR 909 1.365 -6.553 -13.582 740 HH TYR 909 HH TYR 909 2.834 -4.335 -13.535 741 HA LEU 910 HA LEU 910 3.773 -12.651 -7.111 742 1HB LEU 910 1HB LEU 910 1.929 -14.423 -8.718 743 2HB LEU 910 2HB LEU 910 2.612 -14.865 -7.151 744 HG LEU 910 HG LEU 910 0.750 -12.547 -7.752 745 1HD1 LEU 910 1HD1 LEU 910 0.295 -15.273 -7.120 746 2HD1 LEU 910 2HD1 LEU 910 -0.106 -14.342 -5.681 747 3HD1 LEU 910 3HD1 LEU 910 -0.892 -13.975 -7.214 748 1HD2 LEU 910 1HD2 LEU 910 2.674 -12.860 -5.646 749 2HD2 LEU 910 2HD2 LEU 910 1.493 -11.570 -5.867 750 3HD2 LEU 910 3HD2 LEU 910 1.059 -13.014 -4.956 751 HA PRO 911 HA PRO 911 7.203 -14.044 -9.672 752 1HB PRO 911 1HB PRO 911 8.555 -14.663 -7.208 753 2HB PRO 911 2HB PRO 911 8.851 -13.292 -8.282 754 1HG PRO 911 1HG PRO 911 7.946 -11.899 -6.741 755 2HG PRO 911 2HG PRO 911 7.616 -13.272 -5.683 756 1HD PRO 911 1HD PRO 911 5.388 -13.068 -6.132 757 2HD PRO 911 2HD PRO 911 5.726 -11.722 -7.242 758 HA ASP 912 HA ASP 912 6.365 -18.187 -7.304 759 1HB ASP 912 1HB ASP 912 3.952 -16.734 -6.349 760 2HB ASP 912 2HB ASP 912 3.758 -18.473 -6.576 761 1HA GLY 913 1HA GLY 913 3.932 -17.466 -11.599 762 2HA GLY 913 2HA GLY 913 3.449 -18.951 -10.783 763 HA SER 914 HA SER 914 -0.145 -15.901 -11.489 764 1HB SER 914 1HB SER 914 -0.745 -15.316 -8.804 765 2HB SER 914 2HB SER 914 -1.114 -16.808 -9.658 766 HG SER 914 HG SER 914 0.521 -17.765 -8.701 767 HA TYR 915 HA TYR 915 0.068 -11.621 -9.484 768 1HB TYR 915 1HB TYR 915 1.273 -11.357 -11.430 769 2HB TYR 915 2HB TYR 915 0.134 -12.304 -12.377 770 HD1 TYR 915 HD1 TYR 915 -0.209 -9.096 -10.406 771 HD2 TYR 915 HD2 TYR 915 -0.618 -11.076 -14.199 772 HE1 TYR 915 HE1 TYR 915 -1.114 -7.016 -11.399 773 HE2 TYR 915 HE2 TYR 915 -1.523 -8.994 -15.187 774 HH TYR 915 HH TYR 915 -1.237 -6.376 -14.535 775 HA GLU 916 HA GLU 916 -4.090 -9.968 -10.449 776 1HB GLU 916 1HB GLU 916 -3.603 -10.984 -7.914 777 2HB GLU 916 2HB GLU 916 -4.256 -9.372 -7.614 778 1HG GLU 916 1HG GLU 916 -5.608 -11.079 -9.659 779 2HG GLU 916 2HG GLU 916 -5.870 -11.449 -7.954 780 HA ASP 917 HA ASP 917 -3.347 -5.617 -9.770 781 1HB ASP 917 1HB ASP 917 -3.458 -6.046 -12.184 782 2HB ASP 917 2HB ASP 917 -4.130 -4.494 -11.761 783 HA TRP 918 HA TRP 918 -6.630 -2.672 -8.704 784 1HB TRP 918 1HB TRP 918 -8.100 -3.863 -7.095 785 2HB TRP 918 2HB TRP 918 -8.018 -4.629 -8.661 786 HD1 TRP 918 HD1 TRP 918 -4.924 -5.815 -7.328 787 HE1 TRP 918 HE1 TRP 918 -5.233 -8.124 -6.221 788 HE3 TRP 918 HE3 TRP 918 -9.881 -5.643 -6.567 789 HZ2 TRP 918 HZ2 TRP 918 -7.386 -9.611 -4.971 790 HZ3 TRP 918 HZ3 TRP 918 -11.061 -7.400 -5.349 791 HH2 TRP 918 HH2 TRP 918 -9.838 -9.428 -4.556 792 1HA GLY 919 1HA GLY 919 -5.035 -2.530 -4.401 793 2HA GLY 919 2HA GLY 919 -4.819 -0.968 -5.171 794 HA VAL 920 HA VAL 920 -8.045 0.117 -2.384 795 HB VAL 920 HB VAL 920 -6.846 2.599 -3.657 796 1HG1 VAL 920 1HG1 VAL 920 -8.763 2.207 -1.397 797 2HG1 VAL 920 2HG1 VAL 920 -7.495 3.414 -1.189 798 3HG1 VAL 920 3HG1 VAL 920 -8.630 3.551 -2.532 799 1HG2 VAL 920 1HG2 VAL 920 -6.012 0.627 -1.612 800 2HG2 VAL 920 2HG2 VAL 920 -5.026 1.681 -2.625 801 3HG2 VAL 920 3HG2 VAL 920 -5.770 2.314 -1.158 802 HA ASP 921 HA ASP 921 -10.872 1.861 -5.642 803 1HB ASP 921 1HB ASP 921 -9.103 2.069 -7.456 804 2HB ASP 921 2HB ASP 921 -9.523 0.423 -7.939 805 HA GLU 922 HA GLU 922 -12.468 -2.395 -5.803 806 1HB GLU 922 1HB GLU 922 -10.551 -2.758 -7.535 807 2HB GLU 922 2HB GLU 922 -9.908 -3.873 -6.333 808 1HG GLU 922 1HG GLU 922 -11.817 -5.282 -6.448 809 2HG GLU 922 2HG GLU 922 -12.784 -4.041 -7.245 810 HA LEU 923 HA LEU 923 -10.923 -3.741 -1.730 811 1HB LEU 923 1HB LEU 923 -8.572 -4.756 -1.358 812 2HB LEU 923 2HB LEU 923 -9.540 -5.346 -2.689 813 HG LEU 923 HG LEU 923 -8.055 -3.098 -3.630 814 1HD1 LEU 923 1HD1 LEU 923 -6.396 -5.258 -2.295 815 2HD1 LEU 923 2HD1 LEU 923 -5.774 -4.037 -3.404 816 3HD1 LEU 923 3HD1 LEU 923 -6.426 -3.556 -1.840 817 1HD2 LEU 923 1HD2 LEU 923 -8.455 -5.965 -4.085 818 2HD2 LEU 923 2HD2 LEU 923 -8.555 -4.602 -5.204 819 3HD2 LEU 923 3HD2 LEU 923 -6.983 -5.266 -4.756 820 HA ILE 924 HA ILE 924 -8.935 -1.171 1.220 821 HB ILE 924 HB ILE 924 -8.763 -3.740 1.905 822 1HG1 ILE 924 1HG1 ILE 924 -8.092 -1.250 3.389 823 2HG1 ILE 924 2HG1 ILE 924 -9.386 -2.427 3.676 824 1HG2 ILE 924 1HG2 ILE 924 -6.246 -3.520 1.113 825 2HG2 ILE 924 2HG2 ILE 924 -6.020 -2.787 2.685 826 3HG2 ILE 924 3HG2 ILE 924 -6.620 -4.438 2.564 827 1HD1 ILE 924 1HD1 ILE 924 -7.445 -4.094 4.075 828 2HD1 ILE 924 2HD1 ILE 924 -6.466 -2.658 4.319 829 3HD1 ILE 924 3HD1 ILE 924 -7.850 -2.969 5.363 830 HA ILE 925 HA ILE 925 -4.807 0.303 0.416 831 HB ILE 925 HB ILE 925 -4.339 2.049 2.119 832 1HG1 ILE 925 1HG1 ILE 925 -6.796 1.615 3.651 833 2HG1 ILE 925 2HG1 ILE 925 -5.658 0.283 3.834 834 1HG2 ILE 925 1HG2 ILE 925 -6.971 1.708 0.801 835 2HG2 ILE 925 2HG2 ILE 925 -6.907 2.936 2.065 836 3HG2 ILE 925 3HG2 ILE 925 -5.814 3.034 0.684 837 1HD1 ILE 925 1HD1 ILE 925 -4.617 3.085 4.010 838 2HD1 ILE 925 2HD1 ILE 925 -5.488 2.420 5.391 839 3HD1 ILE 925 3HD1 ILE 925 -4.029 1.623 4.802 840 HA THR 926 HA THR 926 -1.760 -1.627 3.079 841 HB THR 926 HB THR 926 -1.915 0.920 4.521 842 HG1 THR 926 HG1 THR 926 0.316 0.727 4.292 843 1HG2 THR 926 1HG2 THR 926 -1.020 -1.566 5.985 844 2HG2 THR 926 2HG2 THR 926 -0.405 0.035 6.397 845 3HG2 THR 926 3HG2 THR 926 -2.128 -0.313 6.542 846 HA ASP 927 HA ASP 927 -5.252 -3.256 5.765 847 1HB ASP 927 1HB ASP 927 -3.160 -3.014 7.114 848 2HB ASP 927 2HB ASP 927 -4.582 -3.227 8.131 No H/Q in entry = 848 Start of MODEL 2 1 H1 MET 801 H3 MET 801 32.103 -0.796 19.389 2 H2 MET 801 H1 MET 801 32.803 -2.107 18.566 3 H3 MET 801 H2 MET 801 33.691 -1.279 19.751 4 HA MET 801 HA MET 801 33.772 0.703 18.393 5 1HB MET 801 1HB MET 801 34.665 -1.999 17.522 6 2HB MET 801 2HB MET 801 34.854 -0.699 16.345 7 1HG MET 801 1HG MET 801 36.071 0.643 18.031 8 2HG MET 801 2HG MET 801 35.901 -0.674 19.191 9 1HE MET 801 1HE MET 801 37.172 -2.274 19.595 10 2HE MET 801 2HE MET 801 36.959 -3.416 18.270 11 3HE MET 801 3HE MET 801 38.583 -2.906 18.751 12 HA SER 802 HA SER 802 31.055 0.028 14.707 13 1HB SER 802 1HB SER 802 31.639 -2.933 14.389 14 2HB SER 802 2HB SER 802 30.849 -1.931 13.175 15 HG SER 802 HG SER 802 33.136 -2.149 12.869 16 HA ASP 803 HA ASP 803 27.515 -2.052 16.693 17 1HB ASP 803 1HB ASP 803 29.110 -1.475 19.187 18 2HB ASP 803 2HB ASP 803 27.448 -2.058 19.290 19 HA ASN 804 HA ASN 804 25.938 2.173 17.489 20 1HB ASN 804 1HB ASN 804 25.771 1.565 14.857 21 2HB ASN 804 2HB ASN 804 24.056 1.546 15.270 22 2HD2 ASN 804 1HD2 ASN 804 23.669 3.578 17.012 23 1HD2 ASN 804 2HD2 ASN 804 24.209 5.062 16.389 24 HA GLU 805 HA GLU 805 22.219 0.549 19.379 25 1HB GLU 805 1HB GLU 805 23.780 2.483 20.962 26 2HB GLU 805 2HB GLU 805 22.084 2.384 21.435 27 1HG GLU 805 1HG GLU 805 22.255 -0.027 21.726 28 2HG GLU 805 2HG GLU 805 23.911 -0.014 21.120 29 HA ASP 806 HA ASP 806 19.310 3.263 17.317 30 1HB ASP 806 1HB ASP 806 18.183 1.079 17.303 31 2HB ASP 806 2HB ASP 806 17.730 1.286 18.996 32 HA ASN 807 HA ASN 807 17.462 5.206 21.167 33 1HB ASN 807 1HB ASN 807 16.737 2.754 22.074 34 2HB ASN 807 2HB ASN 807 17.816 3.246 23.381 35 2HD2 ASN 807 1HD2 ASN 807 16.556 4.114 25.035 36 1HD2 ASN 807 2HD2 ASN 807 15.258 5.184 24.811 37 HA PHE 808 HA PHE 808 21.405 5.369 23.679 38 1HB PHE 808 1HB PHE 808 19.966 7.499 23.225 39 2HB PHE 808 2HB PHE 808 19.740 7.523 24.974 40 HD1 PHE 808 HD1 PHE 808 21.974 7.179 26.383 41 HD2 PHE 808 HD2 PHE 808 21.814 8.605 22.334 42 HE1 PHE 808 HE1 PHE 808 24.212 8.212 26.658 43 HE2 PHE 808 HE2 PHE 808 24.052 9.638 22.610 44 HZ PHE 808 HZ PHE 808 25.251 9.441 24.771 45 HA ASP 809 HA ASP 809 20.114 4.129 27.968 46 1HB ASP 809 1HB ASP 809 21.156 6.387 28.233 47 2HB ASP 809 2HB ASP 809 19.559 7.050 28.581 48 1HA GLY 810 1HA GLY 810 16.339 2.833 29.933 49 2HA GLY 810 2HA GLY 810 15.751 4.207 28.995 50 HA ASP 811 HA ASP 811 13.864 0.754 26.819 51 1HB ASP 811 1HB ASP 811 16.584 -0.047 27.115 52 2HB ASP 811 2HB ASP 811 15.621 -1.521 27.020 53 HA ASP 812 HA ASP 812 12.037 -2.439 29.356 54 1HB ASP 812 1HB ASP 812 10.765 -2.387 27.246 55 2HB ASP 812 2HB ASP 812 10.711 -3.999 27.959 56 HA PHE 813 HA PHE 813 14.917 -5.973 29.387 57 1HB PHE 813 1HB PHE 813 16.315 -4.777 27.650 58 2HB PHE 813 2HB PHE 813 17.235 -4.064 28.974 59 HD1 PHE 813 HD1 PHE 813 15.886 -7.474 28.143 60 HD2 PHE 813 HD2 PHE 813 19.255 -5.125 29.402 61 HE1 PHE 813 HE1 PHE 813 17.264 -9.532 28.297 62 HE2 PHE 813 HE2 PHE 813 20.632 -7.182 29.555 63 HZ PHE 813 HZ PHE 813 19.636 -9.386 29.003 64 HA ASP 814 HA ASP 814 16.790 -4.351 33.374 65 1HB ASP 814 1HB ASP 814 15.741 -1.734 32.563 66 2HB ASP 814 2HB ASP 814 15.692 -1.972 34.309 67 HA ASP 815 HA ASP 815 12.494 -6.692 34.041 68 1HB ASP 815 1HB ASP 815 14.609 -6.669 35.643 69 2HB ASP 815 2HB ASP 815 13.650 -5.487 36.534 70 HA VAL 816 HA VAL 816 10.153 -2.963 34.989 71 HB VAL 816 HB VAL 816 9.031 -3.432 32.238 72 1HG1 VAL 816 1HG1 VAL 816 8.662 -1.449 34.005 73 2HG1 VAL 816 2HG1 VAL 816 10.121 -0.835 33.226 74 3HG1 VAL 816 3HG1 VAL 816 8.676 -1.155 32.266 75 1HG2 VAL 816 1HG2 VAL 816 11.859 -2.545 32.882 76 2HG2 VAL 816 2HG2 VAL 816 11.363 -3.869 31.826 77 3HG2 VAL 816 3HG2 VAL 816 11.071 -2.197 31.343 78 HA GLU 817 HA GLU 817 6.228 -5.235 35.139 79 1HB GLU 817 1HB GLU 817 5.387 -2.391 34.534 80 2HB GLU 817 2HB GLU 817 4.272 -3.580 35.209 81 1HG GLU 817 1HG GLU 817 5.780 -3.931 37.121 82 2HG GLU 817 2HG GLU 817 6.920 -2.767 36.444 83 HA GLU 818 HA GLU 818 4.543 -5.844 30.975 84 1HB GLU 818 1HB GLU 818 5.421 -3.038 30.311 85 2HB GLU 818 2HB GLU 818 4.571 -4.005 29.106 86 1HG GLU 818 1HG GLU 818 3.068 -4.399 31.409 87 2HG GLU 818 2HG GLU 818 2.662 -3.300 30.092 88 HA ASP 819 HA ASP 819 7.828 -6.747 28.003 89 1HB ASP 819 1HB ASP 819 6.545 -8.969 29.470 90 2HB ASP 819 2HB ASP 819 7.377 -9.458 27.993 91 HA GLU 820 HA GLU 820 7.283 -8.160 23.639 92 1HB GLU 820 1HB GLU 820 6.041 -9.910 25.349 93 2HB GLU 820 2HB GLU 820 4.656 -9.144 24.571 94 1HG GLU 820 1HG GLU 820 5.413 -9.770 22.391 95 2HG GLU 820 2HG GLU 820 6.998 -10.243 23.004 96 1HA GLY 821 1HA GLY 821 3.024 -6.141 22.664 97 2HA GLY 821 2HA GLY 821 4.322 -4.963 22.864 98 HA LEU 822 HA LEU 822 4.877 -4.495 18.535 99 1HB LEU 822 1HB LEU 822 7.537 -5.625 19.364 100 2HB LEU 822 2HB LEU 822 7.230 -5.296 17.658 101 HG LEU 822 HG LEU 822 6.836 -3.265 19.873 102 1HD1 LEU 822 1HD1 LEU 822 9.244 -4.062 19.423 103 2HD1 LEU 822 2HD1 LEU 822 9.070 -3.305 17.840 104 3HD1 LEU 822 3HD1 LEU 822 8.942 -2.328 19.302 105 1HD2 LEU 822 1HD2 LEU 822 6.477 -3.315 16.907 106 2HD2 LEU 822 2HD2 LEU 822 5.540 -2.464 18.135 107 3HD2 LEU 822 3HD2 LEU 822 7.106 -1.832 17.625 108 HA ASP 823 HA ASP 823 5.026 -8.989 17.093 109 1HB ASP 823 1HB ASP 823 6.711 -9.784 18.782 110 2HB ASP 823 2HB ASP 823 5.373 -10.191 19.858 111 HA ASP 824 HA ASP 824 0.988 -9.948 19.244 112 1HB ASP 824 1HB ASP 824 2.145 -9.343 21.620 113 2HB ASP 824 2HB ASP 824 0.878 -8.115 21.583 114 HA LEU 825 HA LEU 825 -0.716 -5.858 18.106 115 1HB LEU 825 1HB LEU 825 2.061 -5.389 17.493 116 2HB LEU 825 2HB LEU 825 1.067 -4.725 16.197 117 HG LEU 825 HG LEU 825 -0.330 -3.576 17.935 118 1HD1 LEU 825 1HD1 LEU 825 0.761 -5.320 19.690 119 2HD1 LEU 825 2HD1 LEU 825 1.835 -3.943 19.941 120 3HD1 LEU 825 3HD1 LEU 825 0.097 -3.761 20.181 121 1HD2 LEU 825 1HD2 LEU 825 2.623 -3.026 17.655 122 2HD2 LEU 825 2HD2 LEU 825 1.269 -2.175 16.913 123 3HD2 LEU 825 3HD2 LEU 825 1.600 -1.974 18.633 124 HA GLU 826 HA GLU 826 -1.300 -7.201 13.753 125 1HB GLU 826 1HB GLU 826 0.176 -6.765 11.790 126 2HB GLU 826 2HB GLU 826 0.233 -5.456 12.969 127 1HG GLU 826 1HG GLU 826 2.369 -6.039 13.715 128 2HG GLU 826 2HG GLU 826 2.217 -7.705 13.160 129 HA ASN 827 HA ASN 827 2.140 -11.122 14.746 130 1HB ASN 827 1HB ASN 827 -0.033 -11.348 15.932 131 2HB ASN 827 2HB ASN 827 0.306 -12.741 14.908 132 2HD2 ASN 827 1HD2 ASN 827 -0.988 -13.005 12.950 133 1HD2 ASN 827 2HD2 ASN 827 -2.413 -12.118 12.704 134 HA ALA 828 HA ALA 828 1.099 -10.984 10.073 135 1HB ALA 828 1HB ALA 828 2.205 -8.628 10.352 136 2HB ALA 828 2HB ALA 828 3.715 -9.478 10.023 137 3HB ALA 828 3HB ALA 828 2.423 -9.480 8.824 138 HA GLU 829 HA GLU 829 4.627 -13.839 9.811 139 1HB GLU 829 1HB GLU 829 4.252 -12.945 6.937 140 2HB GLU 829 2HB GLU 829 5.016 -14.469 7.390 141 1HG GLU 829 1HG GLU 829 2.339 -13.815 8.563 142 2HG GLU 829 2HG GLU 829 2.413 -14.361 6.888 143 HA GLU 830 HA GLU 830 7.778 -9.746 9.496 144 1HB GLU 830 1HB GLU 830 7.928 -12.111 10.854 145 2HB GLU 830 2HB GLU 830 9.153 -12.368 9.611 146 1HG GLU 830 1HG GLU 830 10.121 -10.116 10.223 147 2HG GLU 830 2HG GLU 830 10.248 -11.331 11.495 148 HA GLU 831 HA GLU 831 8.772 -10.532 5.179 149 1HB GLU 831 1HB GLU 831 9.071 -12.855 4.321 150 2HB GLU 831 2HB GLU 831 9.515 -12.718 6.022 151 1HG GLU 831 1HG GLU 831 7.864 -14.124 6.676 152 2HG GLU 831 2HG GLU 831 6.674 -13.344 5.633 153 1HA GLY 832 1HA GLY 832 5.235 -11.891 2.422 154 2HA GLY 832 2HA GLY 832 5.779 -10.276 1.964 155 HA GLN 833 HA GLN 833 7.191 -11.801 -1.888 156 1HB GLN 833 1HB GLN 833 7.145 -13.974 -0.709 157 2HB GLN 833 2HB GLN 833 5.457 -14.193 -1.178 158 1HG GLN 833 1HG GLN 833 6.055 -14.208 -3.530 159 2HG GLN 833 2HG GLN 833 7.731 -13.818 -3.144 160 2HE2 GLN 833 1HE2 GLN 833 8.495 -15.850 -4.113 161 1HE2 GLN 833 2HE2 GLN 833 8.247 -17.337 -3.334 162 HA GLU 834 HA GLU 834 4.094 -11.134 -4.960 163 1HB GLU 834 1HB GLU 834 2.699 -10.958 -2.889 164 2HB GLU 834 2HB GLU 834 3.134 -9.254 -2.769 165 1HG GLU 834 1HG GLU 834 1.528 -8.690 -4.238 166 2HG GLU 834 2HG GLU 834 2.171 -9.819 -5.429 167 HA ASN 835 HA ASN 835 6.381 -7.489 -6.333 168 1HB ASN 835 1HB ASN 835 5.053 -8.282 -8.925 169 2HB ASN 835 2HB ASN 835 6.603 -7.498 -8.680 170 2HD2 ASN 835 1HD2 ASN 835 8.211 -9.005 -7.310 171 1HD2 ASN 835 2HD2 ASN 835 8.271 -10.619 -7.828 172 HA VAL 836 HA VAL 836 2.646 -5.228 -6.996 173 HB VAL 836 HB VAL 836 1.956 -4.627 -4.933 174 1HG1 VAL 836 1HG1 VAL 836 4.720 -5.597 -4.210 175 2HG1 VAL 836 2HG1 VAL 836 3.397 -5.389 -3.062 176 3HG1 VAL 836 3HG1 VAL 836 3.261 -6.578 -4.356 177 1HG2 VAL 836 1HG2 VAL 836 4.476 -2.977 -4.841 178 2HG2 VAL 836 2HG2 VAL 836 2.807 -2.421 -4.919 179 3HG2 VAL 836 3HG2 VAL 836 3.434 -3.137 -3.434 180 HA GLU 837 HA GLU 837 4.318 -1.395 -8.480 181 1HB GLU 837 1HB GLU 837 2.881 -3.027 -10.319 182 2HB GLU 837 2HB GLU 837 2.306 -1.381 -10.537 183 1HG GLU 837 1HG GLU 837 4.236 -1.772 -11.989 184 2HG GLU 837 2HG GLU 837 4.664 -0.612 -10.731 185 HA ILE 838 HA ILE 838 0.495 0.894 -7.716 186 HB ILE 838 HB ILE 838 3.127 2.050 -7.283 187 1HG1 ILE 838 1HG1 ILE 838 0.571 1.683 -5.792 188 2HG1 ILE 838 2HG1 ILE 838 1.757 2.810 -5.146 189 1HG2 ILE 838 1HG2 ILE 838 0.820 3.966 -7.612 190 2HG2 ILE 838 2HG2 ILE 838 2.209 4.334 -6.595 191 3HG2 ILE 838 3HG2 ILE 838 2.430 4.070 -8.323 192 1HD1 ILE 838 1HD1 ILE 838 2.887 0.227 -6.023 193 2HD1 ILE 838 2HD1 ILE 838 3.194 1.145 -4.555 194 3HD1 ILE 838 3HD1 ILE 838 1.775 0.107 -4.661 195 HA LEU 839 HA LEU 839 -0.360 4.328 -10.608 196 1HB LEU 839 1HB LEU 839 -1.330 1.634 -10.991 197 2HB LEU 839 2HB LEU 839 -2.586 2.775 -11.468 198 HG LEU 839 HG LEU 839 -0.340 3.930 -12.556 199 1HD1 LEU 839 1HD1 LEU 839 0.376 1.245 -11.946 200 2HD1 LEU 839 2HD1 LEU 839 0.156 1.334 -13.693 201 3HD1 LEU 839 3HD1 LEU 839 1.292 2.417 -12.892 202 1HD2 LEU 839 1HD2 LEU 839 -2.495 2.113 -13.585 203 2HD2 LEU 839 2HD2 LEU 839 -2.224 3.824 -13.918 204 3HD2 LEU 839 3HD2 LEU 839 -1.204 2.604 -14.682 205 HA PRO 840 HA PRO 840 -3.639 6.617 -8.755 206 1HB PRO 840 1HB PRO 840 -4.062 8.158 -10.349 207 2HB PRO 840 2HB PRO 840 -5.162 7.035 -11.153 208 1HG PRO 840 1HG PRO 840 -2.577 7.895 -12.044 209 2HG PRO 840 2HG PRO 840 -3.641 6.713 -12.813 210 1HD PRO 840 1HD PRO 840 -2.163 5.068 -12.244 211 2HD PRO 840 2HD PRO 840 -1.166 6.239 -11.345 212 HA SER 841 HA SER 841 -6.541 3.321 -8.048 213 1HB SER 841 1HB SER 841 -7.353 3.987 -6.051 214 2HB SER 841 2HB SER 841 -6.903 5.651 -6.401 215 HG SER 841 HG SER 841 -9.343 4.411 -6.512 216 1HA GLY 842 1HA GLY 842 -10.420 3.850 -10.270 217 2HA GLY 842 2HA GLY 842 -9.152 4.119 -11.461 218 HA GLU 843 HA GLU 843 -7.913 -0.549 -12.091 219 1HB GLU 843 1HB GLU 843 -9.822 -0.359 -10.215 220 2HB GLU 843 2HB GLU 843 -10.868 -0.604 -11.614 221 1HG GLU 843 1HG GLU 843 -8.524 -2.394 -10.914 222 2HG GLU 843 2HG GLU 843 -10.199 -2.744 -10.488 223 HA ARG 844 HA ARG 844 -9.225 1.202 -16.121 224 1HB ARG 844 1HB ARG 844 -6.810 0.540 -16.347 225 2HB ARG 844 2HB ARG 844 -7.343 -1.122 -16.604 226 1HG ARG 844 1HG ARG 844 -8.917 0.308 -18.379 227 2HG ARG 844 2HG ARG 844 -7.454 -0.584 -18.799 228 1HD ARG 844 1HD ARG 844 -6.882 2.079 -17.690 229 2HD ARG 844 2HD ARG 844 -7.817 2.134 -19.197 230 HE ARG 844 HE ARG 844 -5.912 0.244 -19.762 231 1HH1 ARG 844 1HH1 ARG 844 -3.738 0.835 -18.276 232 2HH1 ARG 844 2HH1 ARG 844 -3.042 2.295 -18.896 233 1HH2 ARG 844 1HH2 ARG 844 -5.901 3.240 -20.616 234 2HH2 ARG 844 2HH2 ARG 844 -4.267 3.657 -20.221 235 HA PRO 845 HA PRO 845 -12.499 -1.932 -16.160 236 1HB PRO 845 1HB PRO 845 -13.826 -0.338 -18.155 237 2HB PRO 845 2HB PRO 845 -14.237 -0.500 -16.446 238 1HG PRO 845 1HG PRO 845 -13.126 1.781 -17.756 239 2HG PRO 845 2HG PRO 845 -13.467 1.586 -16.034 240 1HD PRO 845 1HD PRO 845 -11.227 1.542 -15.619 241 2HD PRO 845 2HD PRO 845 -10.884 1.623 -17.365 242 HA GLN 846 HA GLN 846 -11.399 -4.092 -19.861 243 1HB GLN 846 1HB GLN 846 -10.903 -1.816 -20.685 244 2HB GLN 846 2HB GLN 846 -9.264 -1.943 -20.047 245 1HG GLN 846 1HG GLN 846 -8.644 -3.579 -21.626 246 2HG GLN 846 2HG GLN 846 -10.320 -3.973 -22.007 247 2HE2 GLN 846 1HE2 GLN 846 -8.198 -3.093 -23.915 248 1HE2 GLN 846 2HE2 GLN 846 -8.779 -1.669 -24.632 249 HA ALA 847 HA ALA 847 -7.181 -5.669 -18.647 250 1HB ALA 847 1HB ALA 847 -6.544 -3.032 -17.347 251 2HB ALA 847 3HB ALA 847 -5.746 -3.817 -18.711 252 3HB ALA 847 2HB ALA 847 -5.476 -4.408 -17.071 253 HA ASN 848 HA ASN 848 -8.744 -5.760 -14.028 254 1HB ASN 848 1HB ASN 848 -10.939 -4.761 -14.722 255 2HB ASN 848 2HB ASN 848 -11.392 -6.325 -15.400 256 2HD2 ASN 848 1HD2 ASN 848 -12.694 -4.927 -13.113 257 1HD2 ASN 848 2HD2 ASN 848 -12.554 -5.974 -11.784 258 HA GLN 849 HA GLN 849 -8.695 -10.171 -14.850 259 1HB GLN 849 1HB GLN 849 -6.425 -9.270 -15.516 260 2HB GLN 849 2HB GLN 849 -6.385 -10.902 -14.856 261 1HG GLN 849 1HG GLN 849 -6.155 -8.979 -12.709 262 2HG GLN 849 2HG GLN 849 -5.023 -10.243 -13.185 263 2HE2 GLN 849 1HE2 GLN 849 -3.454 -8.368 -12.508 264 1HE2 GLN 849 2HE2 GLN 849 -3.011 -7.280 -13.724 265 HA LYS 850 HA LYS 850 -7.454 -11.257 -10.321 266 1HB LYS 850 1HB LYS 850 -9.158 -13.039 -10.065 267 2HB LYS 850 2HB LYS 850 -9.739 -11.745 -11.112 268 1HG LYS 850 1HG LYS 850 -8.651 -13.287 -13.002 269 2HG LYS 850 2HG LYS 850 -10.294 -13.568 -12.423 270 1HD LYS 850 1HD LYS 850 -7.794 -15.118 -11.889 271 2HD LYS 850 2HD LYS 850 -8.992 -15.025 -10.598 272 1HE LYS 850 1HE LYS 850 -10.562 -15.560 -12.814 273 2HE LYS 850 2HE LYS 850 -9.103 -16.520 -13.126 274 1HZ LYS 850 1HZ LYS 850 -9.225 -17.326 -10.823 275 2HZ LYS 850 2HZ LYS 850 -10.684 -16.488 -10.608 276 3HZ LYS 850 3HZ LYS 850 -10.597 -17.769 -11.722 277 HA ARG 851 HA ARG 851 -5.516 -15.413 -10.201 278 1HB ARG 851 1HB ARG 851 -4.108 -13.143 -10.816 279 2HB ARG 851 2HB ARG 851 -3.264 -13.697 -9.369 280 1HG ARG 851 1HG ARG 851 -3.356 -16.044 -10.530 281 2HG ARG 851 2HG ARG 851 -2.150 -14.873 -11.062 282 1HD ARG 851 1HD ARG 851 -4.844 -15.396 -12.376 283 2HD ARG 851 2HD ARG 851 -3.675 -14.169 -12.902 284 HE ARG 851 HE ARG 851 -2.039 -16.103 -13.179 285 1HH1 ARG 851 1HH1 ARG 851 -5.077 -16.024 -14.489 286 2HH1 ARG 851 2HH1 ARG 851 -5.190 -17.718 -14.834 287 1HH2 ARG 851 1HH2 ARG 851 -2.329 -18.541 -13.055 288 2HH2 ARG 851 2HH2 ARG 851 -3.634 -19.142 -14.022 289 HA ILE 852 HA ILE 852 -5.126 -15.157 -5.619 290 HB ILE 852 HB ILE 852 -3.006 -15.769 -4.988 291 1HG1 ILE 852 1HG1 ILE 852 -2.323 -13.492 -4.315 292 2HG1 ILE 852 2HG1 ILE 852 -1.014 -14.327 -5.139 293 1HG2 ILE 852 1HG2 ILE 852 -3.171 -16.346 -7.378 294 2HG2 ILE 852 2HG2 ILE 852 -2.436 -14.799 -7.800 295 3HG2 ILE 852 3HG2 ILE 852 -1.506 -16.005 -6.911 296 1HD1 ILE 852 1HD1 ILE 852 -2.455 -13.053 -7.187 297 2HD1 ILE 852 2HD1 ILE 852 -2.367 -11.870 -5.884 298 3HD1 ILE 852 3HD1 ILE 852 -0.892 -12.565 -6.541 299 HA THR 853 HA THR 853 -3.779 -10.700 -3.990 300 HB THR 853 HB THR 853 -5.055 -8.775 -5.134 301 HG1 THR 853 HG1 THR 853 -5.965 -10.802 -6.544 302 1HG2 THR 853 1HG2 THR 853 -2.585 -9.419 -5.271 303 2HG2 THR 853 2HG2 THR 853 -2.978 -10.147 -6.821 304 3HG2 THR 853 3HG2 THR 853 -3.219 -8.419 -6.579 305 HA THR 854 HA THR 854 -7.540 -12.105 -2.012 306 HB THR 854 HB THR 854 -5.800 -12.305 -0.256 307 HG1 THR 854 HG1 THR 854 -7.973 -10.696 0.593 308 1HG2 THR 854 1HG2 THR 854 -5.018 -9.850 -0.803 309 2HG2 THR 854 2HG2 THR 854 -6.188 -9.413 0.441 310 3HG2 THR 854 3HG2 THR 854 -4.843 -10.485 0.833 311 HA PRO 855 HA PRO 855 -9.663 -8.342 -3.170 312 1HB PRO 855 1HB PRO 855 -11.773 -9.210 -3.229 313 2HB PRO 855 2HB PRO 855 -11.875 -9.092 -1.470 314 1HG PRO 855 1HG PRO 855 -11.688 -11.470 -3.026 315 2HG PRO 855 2HG PRO 855 -11.610 -11.345 -1.265 316 1HD PRO 855 1HD PRO 855 -9.422 -12.029 -1.407 317 2HD PRO 855 2HD PRO 855 -9.423 -11.846 -3.181 318 HA TYR 856 HA TYR 856 -8.695 -5.664 0.219 319 1HB TYR 856 1HB TYR 856 -9.365 -7.649 1.489 320 2HB TYR 856 2HB TYR 856 -7.772 -8.351 1.279 321 HD1 TYR 856 HD1 TYR 856 -5.763 -6.934 2.233 322 HD2 TYR 856 HD2 TYR 856 -9.859 -6.402 3.392 323 HE1 TYR 856 HE1 TYR 856 -5.026 -5.847 4.323 324 HE2 TYR 856 HE2 TYR 856 -9.125 -5.314 5.486 325 HH TYR 856 HH TYR 856 -7.366 -4.458 6.606 326 HA MET 857 HA MET 857 -4.541 -5.247 -1.567 327 1HB MET 857 1HB MET 857 -5.611 -3.013 -1.789 328 2HB MET 857 2HB MET 857 -5.288 -2.710 -0.088 329 1HG MET 857 1HG MET 857 -3.274 -1.937 -0.634 330 2HG MET 857 2HG MET 857 -2.842 -3.528 -1.236 331 1HE MET 857 3HE MET 857 -5.419 -0.845 -2.300 332 2HE MET 857 1HE MET 857 -3.937 0.050 -1.998 333 3HE MET 857 2HE MET 857 -4.587 -0.039 -3.632 334 HA THR 858 HA THR 858 -2.551 -5.289 2.540 335 HB THR 858 HB THR 858 -0.806 -7.040 2.234 336 HG1 THR 858 HG1 THR 858 0.070 -6.299 0.290 337 1HG2 THR 858 1HG2 THR 858 -3.308 -7.406 2.237 338 2HG2 THR 858 2HG2 THR 858 -3.232 -7.419 0.476 339 3HG2 THR 858 3HG2 THR 858 -2.379 -8.652 1.404 340 HA LYS 859 HA LYS 859 -0.101 -1.821 3.582 341 1HB LYS 859 1HB LYS 859 1.569 -2.654 5.247 342 2HB LYS 859 2HB LYS 859 -0.076 -3.202 5.568 343 1HG LYS 859 1HG LYS 859 0.782 -5.228 3.985 344 2HG LYS 859 2HG LYS 859 0.939 -5.244 5.741 345 1HD LYS 859 1HD LYS 859 3.139 -3.780 4.557 346 2HD LYS 859 2HD LYS 859 3.022 -5.384 3.837 347 1HE LYS 859 1HE LYS 859 2.791 -6.237 6.287 348 2HE LYS 859 2HE LYS 859 4.396 -5.684 5.772 349 1HZ LYS 859 1HZ LYS 859 3.648 -3.407 6.537 350 2HZ LYS 859 2HZ LYS 859 2.362 -4.190 7.325 351 3HZ LYS 859 3HZ LYS 859 3.962 -4.539 7.763 352 HA TYR 860 HA TYR 860 4.110 -3.339 1.730 353 1HB TYR 860 1HB TYR 860 3.975 -5.727 1.566 354 2HB TYR 860 2HB TYR 860 2.767 -5.646 0.295 355 HD1 TYR 860 HD1 TYR 860 5.444 -3.156 0.338 356 HD2 TYR 860 HD2 TYR 860 4.297 -6.994 -1.229 357 HE1 TYR 860 HE1 TYR 860 7.216 -2.971 -1.371 358 HE2 TYR 860 HE2 TYR 860 6.082 -6.800 -2.940 359 HH TYR 860 HH TYR 860 8.605 -4.844 -2.770 360 HA GLU 861 HA GLU 861 1.854 -2.512 -2.622 361 1HB GLU 861 1HB GLU 861 -0.550 -1.787 -2.553 362 2HB GLU 861 2HB GLU 861 -0.358 -3.473 -2.084 363 1HG GLU 861 1HG GLU 861 -1.605 -2.879 -0.278 364 2HG GLU 861 2HG GLU 861 -0.104 -2.224 0.328 365 HA ARG 862 HA ARG 862 1.076 1.570 -0.101 366 1HB ARG 862 1HB ARG 862 -0.087 0.186 1.807 367 2HB ARG 862 2HB ARG 862 1.484 0.331 2.599 368 1HG ARG 862 1HG ARG 862 0.877 2.891 1.543 369 2HG ARG 862 2HG ARG 862 -0.579 2.323 2.349 370 1HD ARG 862 1HD ARG 862 0.968 3.555 3.891 371 2HD ARG 862 2HD ARG 862 0.707 1.880 4.406 372 HE ARG 862 HE ARG 862 3.038 2.523 2.661 373 1HH1 ARG 862 1HH1 ARG 862 3.255 -0.145 3.405 374 2HH1 ARG 862 2HH1 ARG 862 4.025 -0.161 4.955 375 1HH2 ARG 862 1HH2 ARG 862 3.348 3.172 5.624 376 2HH2 ARG 862 2HH2 ARG 862 4.080 1.717 6.210 377 HA ALA 863 HA ALA 863 5.390 1.070 1.882 378 1HB ALA 863 2HB ALA 863 6.273 -1.656 1.305 379 2HB ALA 863 3HB ALA 863 6.319 -0.772 2.830 380 3HB ALA 863 1HB ALA 863 4.852 -1.624 2.350 381 HA ARG 864 HA ARG 864 6.876 0.025 -2.452 382 1HB ARG 864 1HB ARG 864 4.500 -1.618 -2.758 383 2HB ARG 864 2HB ARG 864 4.741 -0.642 -4.208 384 1HG ARG 864 1HG ARG 864 7.202 -1.860 -3.109 385 2HG ARG 864 2HG ARG 864 6.026 -3.010 -3.740 386 1HD ARG 864 1HD ARG 864 5.936 -1.265 -5.764 387 2HD ARG 864 2HD ARG 864 7.577 -0.906 -5.193 388 HE ARG 864 HE ARG 864 6.975 -3.771 -5.408 389 1HH1 ARG 864 1HH1 ARG 864 9.399 -1.660 -5.903 390 2HH1 ARG 864 2HH1 ARG 864 9.831 -2.179 -7.497 391 1HH2 ARG 864 1HH2 ARG 864 7.001 -4.137 -7.915 392 2HH2 ARG 864 2HH2 ARG 864 8.473 -3.581 -8.637 393 HA VAL 865 HA VAL 865 3.169 3.083 -3.845 394 HB VAL 865 HB VAL 865 2.358 2.030 -1.200 395 1HG1 VAL 865 1HG1 VAL 865 2.074 4.886 -1.877 396 2HG1 VAL 865 2HG1 VAL 865 0.706 4.073 -1.117 397 3HG1 VAL 865 3HG1 VAL 865 2.270 4.106 -0.309 398 1HG2 VAL 865 1HG2 VAL 865 1.303 1.342 -3.256 399 2HG2 VAL 865 2HG2 VAL 865 0.159 2.118 -2.168 400 3HG2 VAL 865 3HG2 VAL 865 0.799 3.005 -3.551 401 HA LEU 866 HA LEU 866 4.901 5.887 -0.082 402 1HB LEU 866 1HB LEU 866 5.610 3.189 0.933 403 2HB LEU 866 2HB LEU 866 6.825 4.425 1.237 404 HG LEU 866 HG LEU 866 5.333 5.735 2.517 405 1HD1 LEU 866 1HD1 LEU 866 3.122 4.013 1.379 406 2HD1 LEU 866 2HD1 LEU 866 2.889 5.200 2.659 407 3HD1 LEU 866 3HD1 LEU 866 3.396 5.724 1.054 408 1HD2 LEU 866 1HD2 LEU 866 5.115 2.795 2.992 409 2HD2 LEU 866 2HD2 LEU 866 5.909 4.032 3.967 410 3HD2 LEU 866 3HD2 LEU 866 4.152 3.888 3.984 411 1HA GLY 867 1HA GLY 867 9.056 4.652 -2.079 412 2HA GLY 867 2HA GLY 867 8.551 3.178 -2.909 413 HA THR 868 HA THR 868 7.030 5.628 -6.257 414 HB THR 868 HB THR 868 5.005 4.941 -7.241 415 HG1 THR 868 HG1 THR 868 4.137 4.677 -4.564 416 1HG2 THR 868 1HG2 THR 868 6.688 3.176 -6.099 417 2HG2 THR 868 2HG2 THR 868 5.154 2.692 -5.374 418 3HG2 THR 868 3HG2 THR 868 5.331 2.724 -7.128 419 HA ARG 869 HA ARG 869 3.967 8.578 -4.129 420 1HB ARG 869 1HB ARG 869 4.627 7.112 -1.552 421 2HB ARG 869 2HB ARG 869 3.951 8.741 -1.505 422 1HG ARG 869 1HG ARG 869 2.674 6.444 -3.012 423 2HG ARG 869 2HG ARG 869 2.228 6.900 -1.368 424 1HD ARG 869 1HD ARG 869 0.928 8.589 -2.135 425 2HD ARG 869 2HD ARG 869 2.268 9.238 -3.100 426 HE ARG 869 HE ARG 869 1.137 6.807 -4.243 427 1HH1 ARG 869 1HH1 ARG 869 -0.730 9.370 -3.649 428 2HH1 ARG 869 2HH1 ARG 869 -0.863 9.954 -5.275 429 1HH2 ARG 869 1HH2 ARG 869 1.669 7.921 -6.492 430 2HH2 ARG 869 2HH2 ARG 869 0.496 9.132 -6.884 431 HA ALA 870 HA ALA 870 8.091 9.922 -1.898 432 1HB ALA 870 3HB ALA 870 8.812 7.926 -0.818 433 2HB ALA 870 2HB ALA 870 10.122 8.327 -1.930 434 3HB ALA 870 1HB ALA 870 8.960 7.069 -2.353 435 HA LEU 871 HA LEU 871 10.060 9.810 -6.069 436 1HB LEU 871 1HB LEU 871 9.057 8.079 -8.098 437 2HB LEU 871 2HB LEU 871 10.651 8.063 -7.363 438 HG LEU 871 HG LEU 871 8.431 6.764 -5.868 439 1HD1 LEU 871 1HD1 LEU 871 8.156 6.044 -8.236 440 2HD1 LEU 871 2HD1 LEU 871 9.829 5.486 -8.221 441 3HD1 LEU 871 3HD1 LEU 871 8.637 4.726 -7.167 442 1HD2 LEU 871 1HD2 LEU 871 11.379 6.253 -6.349 443 2HD2 LEU 871 2HD2 LEU 871 10.629 6.821 -4.857 444 3HD2 LEU 871 3HD2 LEU 871 10.350 5.170 -5.412 445 HA GLN 872 HA GLN 872 5.868 10.438 -8.564 446 1HB GLN 872 1HB GLN 872 4.785 9.494 -6.043 447 2HB GLN 872 2HB GLN 872 4.114 11.074 -6.421 448 1HG GLN 872 1HG GLN 872 2.626 9.822 -7.642 449 2HG GLN 872 2HG GLN 872 3.901 9.919 -8.856 450 2HE2 GLN 872 1HE2 GLN 872 5.472 8.041 -8.909 451 1HE2 GLN 872 2HE2 GLN 872 4.923 6.510 -8.426 452 HA ILE 873 HA ILE 873 6.030 14.495 -5.874 453 HB ILE 873 HB ILE 873 7.174 14.415 -3.498 454 1HG1 ILE 873 1HG1 ILE 873 6.070 11.928 -2.788 455 2HG1 ILE 873 2HG1 ILE 873 7.006 11.618 -4.244 456 1HG2 ILE 873 1HG2 ILE 873 4.435 13.735 -4.414 457 2HG2 ILE 873 2HG2 ILE 873 4.787 13.585 -2.695 458 3HG2 ILE 873 3HG2 ILE 873 5.004 15.133 -3.506 459 1HD1 ILE 873 1HD1 ILE 873 8.163 13.244 -2.013 460 2HD1 ILE 873 2HD1 ILE 873 8.217 11.487 -1.980 461 3HD1 ILE 873 3HD1 ILE 873 8.989 12.366 -3.294 462 HA ALA 874 HA ALA 874 10.786 13.855 -5.228 463 1HB ALA 874 1HB ALA 874 10.798 11.353 -5.044 464 2HB ALA 874 2HB ALA 874 10.690 11.276 -6.802 465 3HB ALA 874 3HB ALA 874 12.108 11.984 -6.033 466 HA MET 875 HA MET 875 10.433 14.682 -9.769 467 1HB MET 875 1HB MET 875 8.053 12.988 -9.770 468 2HB MET 875 2HB MET 875 7.790 14.427 -10.756 469 1HG MET 875 1HG MET 875 10.165 13.871 -11.721 470 2HG MET 875 2HG MET 875 8.766 12.965 -12.297 471 1HE MET 875 1HE MET 875 9.794 11.431 -13.219 472 2HE MET 875 2HE MET 875 11.322 10.704 -12.726 473 3HE MET 875 3HE MET 875 9.810 9.852 -12.423 474 HA CYS 876 HA CYS 876 7.572 17.964 -8.060 475 1HB CYS 876 1HB CYS 876 5.717 16.667 -10.028 476 2HB CYS 876 2HB CYS 876 5.095 18.048 -9.123 477 HG CYS 876 HG CYS 876 6.279 19.064 -11.188 478 HA ALA 877 HA ALA 877 4.542 15.190 -5.490 479 1HB ALA 877 1HB ALA 877 4.026 18.018 -5.921 480 2HB ALA 877 3HB ALA 877 4.432 17.157 -4.437 481 3HB ALA 877 2HB ALA 877 2.760 17.214 -4.991 482 HA PRO 878 HA PRO 878 0.780 14.242 -8.327 483 1HB PRO 878 1HB PRO 878 1.747 11.539 -8.429 484 2HB PRO 878 2HB PRO 878 1.574 12.671 -9.773 485 1HG PRO 878 1HG PRO 878 3.994 11.767 -8.506 486 2HG PRO 878 2HG PRO 878 3.825 12.816 -9.907 487 1HD PRO 878 1HD PRO 878 4.689 13.549 -7.291 488 2HD PRO 878 2HD PRO 878 4.377 14.623 -8.670 489 HA VAL 879 HA VAL 879 1.102 11.138 -4.396 490 HB VAL 879 HB VAL 879 2.746 13.518 -3.593 491 1HG1 VAL 879 1HG1 VAL 879 1.132 12.960 -1.689 492 2HG1 VAL 879 2HG1 VAL 879 2.010 11.442 -1.551 493 3HG1 VAL 879 3HG1 VAL 879 2.841 12.971 -1.313 494 1HG2 VAL 879 1HG2 VAL 879 3.435 11.128 -4.649 495 2HG2 VAL 879 2HG2 VAL 879 4.500 12.049 -3.611 496 3HG2 VAL 879 3HG2 VAL 879 3.544 10.742 -2.937 497 HA MET 880 HA MET 880 -2.515 13.308 -3.085 498 1HB MET 880 1HB MET 880 -2.182 10.827 -1.894 499 2HB MET 880 2HB MET 880 -2.662 11.853 -0.543 500 1HG MET 880 1HG MET 880 -4.141 11.669 -3.186 501 2HG MET 880 2HG MET 880 -4.621 10.848 -1.702 502 1HE MET 880 1HE MET 880 -4.763 11.786 0.355 503 2HE MET 880 2HE MET 880 -4.253 13.434 0.712 504 3HE MET 880 3HE MET 880 -5.971 13.050 0.623 505 HA VAL 881 HA VAL 881 -1.131 16.265 -0.080 506 HB VAL 881 HB VAL 881 0.845 15.937 1.493 507 1HG1 VAL 881 1HG1 VAL 881 -1.583 14.637 1.420 508 2HG1 VAL 881 2HG1 VAL 881 -0.458 13.284 1.525 509 3HG1 VAL 881 3HG1 VAL 881 -0.443 14.543 2.758 510 1HG2 VAL 881 1HG2 VAL 881 2.004 14.541 -0.467 511 2HG2 VAL 881 2HG2 VAL 881 2.352 14.209 1.230 512 3HG2 VAL 881 3HG2 VAL 881 1.203 13.200 0.352 513 HA GLU 882 HA GLU 882 2.120 18.360 -2.336 514 1HB GLU 882 1HB GLU 882 1.309 20.712 -2.398 515 2HB GLU 882 2HB GLU 882 -0.008 19.543 -2.506 516 1HG GLU 882 1HG GLU 882 0.660 20.263 0.261 517 2HG GLU 882 2HG GLU 882 0.123 21.640 -0.702 518 HA LEU 883 HA LEU 883 4.639 19.413 1.484 519 1HB LEU 883 1HB LEU 883 5.479 17.133 1.114 520 2HB LEU 883 2HB LEU 883 6.280 17.649 -0.367 521 HG LEU 883 HG LEU 883 7.584 19.311 1.028 522 1HD1 LEU 883 1HD1 LEU 883 6.028 17.880 3.159 523 2HD1 LEU 883 2HD1 LEU 883 7.655 18.456 3.524 524 3HD1 LEU 883 3HD1 LEU 883 6.408 19.597 3.018 525 1HD2 LEU 883 1HD2 LEU 883 7.792 16.327 1.352 526 2HD2 LEU 883 2HD2 LEU 883 8.830 17.417 0.435 527 3HD2 LEU 883 3HD2 LEU 883 8.928 17.380 2.195 528 HA GLU 884 HA GLU 884 6.628 22.135 -1.722 529 1HB GLU 884 1HB GLU 884 8.582 20.816 -0.120 530 2HB GLU 884 2HB GLU 884 9.397 21.415 -1.563 531 1HG GLU 884 1HG GLU 884 7.465 23.253 -0.225 532 2HG GLU 884 2HG GLU 884 9.007 22.972 0.583 533 1HA GLY 885 1HA GLY 885 6.871 19.080 -5.617 534 2HA GLY 885 2HA GLY 885 8.216 20.221 -5.545 535 HA GLU 886 HA GLU 886 9.905 16.099 -3.205 536 1HB GLU 886 1HB GLU 886 10.411 16.033 -5.525 537 2HB GLU 886 2HB GLU 886 11.274 17.567 -5.466 538 1HG GLU 886 1HG GLU 886 12.986 16.437 -3.978 539 2HG GLU 886 2HG GLU 886 12.168 14.911 -4.311 540 HA THR 887 HA THR 887 13.549 17.582 -1.051 541 HB THR 887 HB THR 887 10.971 18.053 0.493 542 HG1 THR 887 HG1 THR 887 11.056 19.972 -0.414 543 1HG2 THR 887 1HG2 THR 887 13.810 18.459 1.305 544 2HG2 THR 887 2HG2 THR 887 12.684 19.765 1.671 545 3HG2 THR 887 3HG2 THR 887 12.388 18.145 2.300 546 HA ASP 888 HA ASP 888 12.833 14.376 2.267 547 1HB ASP 888 1HB ASP 888 10.427 15.403 2.617 548 2HB ASP 888 2HB ASP 888 9.928 13.831 1.999 549 HA PRO 889 HA PRO 889 13.052 10.864 -0.457 550 1HB PRO 889 1HB PRO 889 13.498 9.064 1.739 551 2HB PRO 889 2HB PRO 889 14.698 9.757 0.645 552 1HG PRO 889 1HG PRO 889 14.355 10.355 3.400 553 2HG PRO 889 2HG PRO 889 15.437 11.162 2.260 554 1HD PRO 889 1HD PRO 889 14.152 13.033 2.475 555 2HD PRO 889 2HD PRO 889 12.924 12.140 3.406 556 HA LEU 890 HA LEU 890 8.760 9.622 0.735 557 1HB LEU 890 1HB LEU 890 10.320 7.859 1.579 558 2HB LEU 890 2HB LEU 890 8.703 7.704 2.238 559 HG LEU 890 HG LEU 890 10.560 7.372 3.913 560 1HD1 LEU 890 1HD1 LEU 890 11.980 9.256 2.952 561 2HD1 LEU 890 2HD1 LEU 890 10.898 10.366 3.790 562 3HD1 LEU 890 3HD1 LEU 890 11.848 9.200 4.708 563 1HD2 LEU 890 1HD2 LEU 890 8.116 8.405 4.286 564 2HD2 LEU 890 2HD2 LEU 890 9.262 8.197 5.609 565 3HD2 LEU 890 3HD2 LEU 890 9.075 9.775 4.846 566 HA LEU 891 HA LEU 891 7.724 12.021 5.003 567 1HB LEU 891 1HB LEU 891 8.691 14.101 4.746 568 2HB LEU 891 2HB LEU 891 8.525 14.045 3.002 569 HG LEU 891 HG LEU 891 7.153 15.816 4.159 570 1HD1 LEU 891 1HD1 LEU 891 6.558 14.403 1.904 571 2HD1 LEU 891 2HD1 LEU 891 5.087 14.169 2.851 572 3HD1 LEU 891 3HD1 LEU 891 5.641 15.794 2.471 573 1HD2 LEU 891 1HD2 LEU 891 6.406 13.672 5.795 574 2HD2 LEU 891 2HD2 LEU 891 5.727 15.300 5.819 575 3HD2 LEU 891 3HD2 LEU 891 4.968 14.044 4.845 576 HA ILE 892 HA ILE 892 4.143 12.759 1.860 577 HB ILE 892 HB ILE 892 6.343 12.320 -0.050 578 1HG1 ILE 892 1HG1 ILE 892 3.992 13.842 -0.856 579 2HG1 ILE 892 2HG1 ILE 892 4.649 14.354 0.697 580 1HG2 ILE 892 1HG2 ILE 892 3.615 11.183 -0.497 581 2HG2 ILE 892 2HG2 ILE 892 4.464 11.943 -1.831 582 3HG2 ILE 892 3HG2 ILE 892 5.187 10.569 -1.011 583 1HD1 ILE 892 1HD1 ILE 892 6.510 13.787 -1.546 584 2HD1 ILE 892 2HD1 ILE 892 5.632 15.311 -1.546 585 3HD1 ILE 892 3HD1 ILE 892 6.698 14.903 -0.199 586 HA ALA 893 HA ALA 893 4.174 8.129 0.848 587 1HB ALA 893 3HB ALA 893 6.110 7.282 -0.001 588 2HB ALA 893 1HB ALA 893 7.108 8.117 1.182 589 3HB ALA 893 2HB ALA 893 6.294 6.622 1.617 590 HA MET 894 HA MET 894 4.765 7.667 5.555 591 1HB MET 894 1HB MET 894 6.910 8.749 5.855 592 2HB MET 894 2HB MET 894 6.226 10.327 5.480 593 1HG MET 894 1HG MET 894 4.930 10.308 7.541 594 2HG MET 894 2HG MET 894 5.468 8.667 7.902 595 1HE MET 894 2HE MET 894 6.576 11.853 6.576 596 2HE MET 894 1HE MET 894 7.346 12.646 7.947 597 3HE MET 894 3HE MET 894 8.333 11.784 6.770 598 HA LYS 895 HA LYS 895 2.058 11.609 6.328 599 1HB LYS 895 1HB LYS 895 3.201 13.417 5.303 600 2HB LYS 895 2HB LYS 895 3.142 12.661 3.712 601 1HG LYS 895 1HG LYS 895 1.142 13.586 3.246 602 2HG LYS 895 2HG LYS 895 0.472 13.109 4.806 603 1HD LYS 895 1HD LYS 895 2.326 15.476 4.416 604 2HD LYS 895 2HD LYS 895 0.567 15.600 4.473 605 1HE LYS 895 1HE LYS 895 1.956 14.151 6.706 606 2HE LYS 895 2HE LYS 895 1.981 15.926 6.692 607 1HZ LYS 895 1HZ LYS 895 -0.489 14.344 6.256 608 2HZ LYS 895 2HZ LYS 895 -0.015 14.896 7.791 609 3HZ LYS 895 3HZ LYS 895 -0.363 16.008 6.556 610 HA GLU 896 HA GLU 896 -0.481 10.204 2.364 611 1HB GLU 896 1HB GLU 896 2.022 8.678 1.630 612 2HB GLU 896 2HB GLU 896 0.463 8.199 0.978 613 1HG GLU 896 1HG GLU 896 1.679 10.961 0.725 614 2HG GLU 896 2HG GLU 896 1.619 9.751 -0.555 615 HA LEU 897 HA LEU 897 -0.603 6.011 4.476 616 1HB LEU 897 1HB LEU 897 1.752 5.214 4.331 617 2HB LEU 897 2HB LEU 897 2.133 6.143 5.780 618 HG LEU 897 HG LEU 897 1.416 3.538 5.884 619 1HD1 LEU 897 1HD1 LEU 897 1.962 5.462 7.680 620 2HD1 LEU 897 2HD1 LEU 897 0.249 5.236 8.033 621 3HD1 LEU 897 3HD1 LEU 897 1.361 3.873 8.156 622 1HD2 LEU 897 1HD2 LEU 897 -0.880 4.327 4.888 623 2HD2 LEU 897 2HD2 LEU 897 -0.896 3.208 6.246 624 3HD2 LEU 897 3HD2 LEU 897 -1.195 4.920 6.516 625 HA LYS 898 HA LYS 898 0.083 8.192 8.865 626 1HB LYS 898 1HB LYS 898 1.992 9.605 8.175 627 2HB LYS 898 2HB LYS 898 0.903 10.547 7.158 628 1HG LYS 898 1HG LYS 898 -0.152 11.555 8.963 629 2HG LYS 898 2HG LYS 898 0.273 10.253 10.074 630 1HD LYS 898 1HD LYS 898 2.679 11.463 9.028 631 2HD LYS 898 2HD LYS 898 1.633 12.707 9.712 632 1HE LYS 898 1HE LYS 898 2.000 10.181 11.285 633 2HE LYS 898 2HE LYS 898 3.321 11.367 11.275 634 1HZ LYS 898 1HZ LYS 898 0.480 12.072 11.771 635 2HZ LYS 898 2HZ LYS 898 1.599 11.775 13.014 636 3HZ LYS 898 3HZ LYS 898 1.833 13.079 11.950 637 HA ALA 899 HA ALA 899 -3.388 10.705 6.930 638 1HB ALA 899 2HB ALA 899 -3.694 10.932 4.314 639 2HB ALA 899 3HB ALA 899 -2.408 11.844 5.107 640 3HB ALA 899 1HB ALA 899 -2.031 10.346 4.254 641 HA ARG 900 HA ARG 900 -3.494 5.738 4.901 642 1HB ARG 900 1HB ARG 900 -4.556 5.063 6.815 643 2HB ARG 900 2HB ARG 900 -4.226 6.676 7.433 644 1HG ARG 900 1HG ARG 900 -6.442 7.363 6.288 645 2HG ARG 900 2HG ARG 900 -6.763 5.634 6.174 646 1HD ARG 900 1HD ARG 900 -6.084 5.699 8.759 647 2HD ARG 900 2HD ARG 900 -7.734 6.109 8.246 648 HE ARG 900 HE ARG 900 -5.655 8.252 8.448 649 1HH1 ARG 900 1HH1 ARG 900 -8.453 8.983 7.784 650 2HH1 ARG 900 2HH1 ARG 900 -9.108 9.419 9.327 651 1HH2 ARG 900 1HH2 ARG 900 -6.578 7.881 11.133 652 2HH2 ARG 900 2HH2 ARG 900 -8.047 8.796 11.223 653 HA LYS 901 HA LYS 901 -6.718 7.897 2.645 654 1HB LYS 901 1HB LYS 901 -6.222 10.093 3.547 655 2HB LYS 901 2HB LYS 901 -4.806 10.233 2.506 656 1HG LYS 901 1HG LYS 901 -6.885 11.478 1.708 657 2HG LYS 901 2HG LYS 901 -6.155 10.384 0.533 658 1HD LYS 901 1HD LYS 901 -7.938 8.972 0.548 659 2HD LYS 901 2HD LYS 901 -8.173 9.132 2.289 660 1HE LYS 901 1HE LYS 901 -9.812 10.670 1.983 661 2HE LYS 901 2HE LYS 901 -8.772 11.638 0.918 662 1HZ LYS 901 1HZ LYS 901 -9.194 10.026 -0.860 663 2HZ LYS 901 2HZ LYS 901 -10.265 9.182 0.155 664 3HZ LYS 901 3HZ LYS 901 -10.630 10.765 -0.335 665 HA ILE 902 HA ILE 902 -3.112 7.868 -0.904 666 HB ILE 902 HB ILE 902 -2.779 5.144 0.387 667 1HG1 ILE 902 1HG1 ILE 902 -0.389 6.713 0.389 668 2HG1 ILE 902 2HG1 ILE 902 -1.675 7.685 1.106 669 1HG2 ILE 902 1HG2 ILE 902 -2.331 5.784 -2.213 670 2HG2 ILE 902 2HG2 ILE 902 -0.781 6.245 -1.510 671 3HG2 ILE 902 3HG2 ILE 902 -1.374 4.595 -1.329 672 1HD1 ILE 902 1HD1 ILE 902 -1.505 4.831 1.943 673 2HD1 ILE 902 2HD1 ILE 902 -0.253 5.918 2.542 674 3HD1 ILE 902 3HD1 ILE 902 -1.951 6.254 2.885 675 HA PRO 903 HA PRO 903 -6.862 5.697 -2.531 676 1HB PRO 903 1HB PRO 903 -7.130 7.856 -4.411 677 2HB PRO 903 2HB PRO 903 -8.131 7.552 -2.986 678 1HG PRO 903 1HG PRO 903 -6.431 9.747 -3.323 679 2HG PRO 903 2HG PRO 903 -7.090 9.194 -1.777 680 1HD PRO 903 1HD PRO 903 -4.854 8.921 -1.207 681 2HD PRO 903 2HD PRO 903 -4.347 8.785 -2.912 682 HA ILE 904 HA ILE 904 -5.017 4.803 -6.448 683 HB ILE 904 HB ILE 904 -2.953 5.224 -4.500 684 1HG1 ILE 904 1HG1 ILE 904 -2.380 5.625 -7.364 685 2HG1 ILE 904 2HG1 ILE 904 -3.880 6.363 -6.808 686 1HG2 ILE 904 1HG2 ILE 904 -2.442 3.121 -6.584 687 2HG2 ILE 904 2HG2 ILE 904 -1.152 4.221 -6.106 688 3HG2 ILE 904 3HG2 ILE 904 -1.911 3.181 -4.905 689 1HD1 ILE 904 2HD1 ILE 904 -2.262 7.089 -4.775 690 2HD1 ILE 904 3HD1 ILE 904 -1.072 7.005 -6.074 691 3HD1 ILE 904 1HD1 ILE 904 -2.466 8.073 -6.224 692 HA ILE 905 HA ILE 905 -5.300 0.466 -6.877 693 HB ILE 905 HB ILE 905 -6.173 1.489 -8.963 694 1HG1 ILE 905 1HG1 ILE 905 -4.658 -0.530 -10.327 695 2HG1 ILE 905 2HG1 ILE 905 -4.975 -1.087 -8.684 696 1HG2 ILE 905 1HG2 ILE 905 -3.254 1.433 -9.788 697 2HG2 ILE 905 2HG2 ILE 905 -4.593 1.729 -10.895 698 3HG2 ILE 905 3HG2 ILE 905 -4.263 2.861 -9.590 699 1HD1 ILE 905 1HD1 ILE 905 -7.167 0.151 -10.312 700 2HD1 ILE 905 2HD1 ILE 905 -6.761 -1.551 -10.517 701 3HD1 ILE 905 3HD1 ILE 905 -7.297 -0.950 -8.944 702 HA ILE 906 HA ILE 906 -0.944 -0.625 -7.587 703 HB ILE 906 HB ILE 906 -2.288 -1.717 -5.163 704 1HG1 ILE 906 1HG1 ILE 906 0.199 -0.113 -5.747 705 2HG1 ILE 906 2HG1 ILE 906 -0.267 -0.604 -4.120 706 1HG2 ILE 906 1HG2 ILE 906 0.337 -2.781 -6.221 707 2HG2 ILE 906 2HG2 ILE 906 -0.082 -2.837 -4.508 708 3HG2 ILE 906 3HG2 ILE 906 -1.069 -3.703 -5.686 709 1HD1 ILE 906 1HD1 ILE 906 -2.607 0.468 -5.094 710 2HD1 ILE 906 2HD1 ILE 906 -1.444 1.339 -4.095 711 3HD1 ILE 906 3HD1 ILE 906 -1.388 1.492 -5.849 712 HA ARG 907 HA ARG 907 -1.463 -4.658 -9.429 713 1HB ARG 907 1HB ARG 907 1.109 -3.391 -10.294 714 2HB ARG 907 2HB ARG 907 0.607 -4.953 -10.936 715 1HG ARG 907 1HG ARG 907 -0.212 -3.207 -12.413 716 2HG ARG 907 2HG ARG 907 -1.572 -3.946 -11.575 717 1HD ARG 907 1HD ARG 907 -2.072 -2.027 -10.418 718 2HD ARG 907 2HD ARG 907 -0.364 -1.585 -10.223 719 HE ARG 907 HE ARG 907 -0.413 -0.546 -12.378 720 1HH1 ARG 907 1HH1 ARG 907 -1.787 -2.445 -14.072 721 2HH1 ARG 907 2HH1 ARG 907 -3.343 -1.731 -14.331 722 1HH2 ARG 907 1HH2 ARG 907 -3.077 0.461 -11.657 723 2HH2 ARG 907 2HH2 ARG 907 -4.074 -0.085 -12.964 724 HA ARG 908 HA ARG 908 1.155 -6.925 -6.607 725 1HB ARG 908 1HB ARG 908 -1.250 -8.676 -6.383 726 2HB ARG 908 2HB ARG 908 -0.153 -8.145 -5.124 727 1HG ARG 908 1HG ARG 908 -1.219 -5.808 -5.418 728 2HG ARG 908 2HG ARG 908 -2.486 -6.632 -6.324 729 1HD ARG 908 1HD ARG 908 -2.473 -8.235 -4.133 730 2HD ARG 908 2HD ARG 908 -3.422 -6.728 -4.146 731 HE ARG 908 HE ARG 908 -1.521 -5.642 -2.989 732 1HH1 ARG 908 1HH1 ARG 908 0.920 -6.466 -2.926 733 2HH1 ARG 908 2HH1 ARG 908 1.083 -7.839 -1.881 734 1HH2 ARG 908 1HH2 ARG 908 -2.313 -8.538 -1.831 735 2HH2 ARG 908 2HH2 ARG 908 -0.747 -9.012 -1.262 736 HA TYR 909 HA TYR 909 1.367 -9.867 -10.076 737 1HB TYR 909 1HB TYR 909 4.268 -9.171 -9.889 738 2HB TYR 909 2HB TYR 909 3.353 -9.695 -11.284 739 HD1 TYR 909 HD1 TYR 909 4.193 -6.772 -9.153 740 HD2 TYR 909 HD2 TYR 909 2.140 -8.133 -12.656 741 HE1 TYR 909 HE1 TYR 909 4.051 -4.465 -9.951 742 HE2 TYR 909 HE2 TYR 909 1.980 -5.820 -13.458 743 HH TYR 909 HH TYR 909 3.160 -3.689 -13.159 744 HA LEU 910 HA LEU 910 3.812 -12.529 -7.399 745 1HB LEU 910 1HB LEU 910 2.256 -14.113 -9.445 746 2HB LEU 910 2HB LEU 910 2.780 -14.756 -7.889 747 HG LEU 910 HG LEU 910 0.893 -12.432 -8.362 748 1HD1 LEU 910 1HD1 LEU 910 0.501 -15.245 -8.199 749 2HD1 LEU 910 2HD1 LEU 910 -0.138 -14.541 -6.721 750 3HD1 LEU 910 3HD1 LEU 910 -0.724 -13.984 -8.286 751 1HD2 LEU 910 1HD2 LEU 910 2.563 -13.049 -6.102 752 2HD2 LEU 910 2HD2 LEU 910 1.390 -11.745 -6.278 753 3HD2 LEU 910 3HD2 LEU 910 0.880 -13.312 -5.657 754 HA PRO 911 HA PRO 911 7.582 -13.458 -9.676 755 1HB PRO 911 1HB PRO 911 8.648 -14.404 -7.175 756 2HB PRO 911 2HB PRO 911 9.016 -12.884 -7.996 757 1HG PRO 911 1HG PRO 911 7.874 -11.752 -6.400 758 2HG PRO 911 2HG PRO 911 7.477 -13.273 -5.598 759 1HD PRO 911 1HD PRO 911 5.312 -13.060 -6.291 760 2HD PRO 911 2HD PRO 911 5.724 -11.557 -7.144 761 HA ASP 912 HA ASP 912 6.630 -17.927 -8.068 762 1HB ASP 912 1HB ASP 912 4.067 -16.688 -7.202 763 2HB ASP 912 2HB ASP 912 3.973 -18.377 -7.701 764 1HA GLY 913 1HA GLY 913 4.649 -16.626 -12.460 765 2HA GLY 913 2HA GLY 913 4.153 -18.233 -11.935 766 HA SER 914 HA SER 914 0.515 -15.220 -12.615 767 1HB SER 914 1HB SER 914 -0.415 -15.080 -9.960 768 2HB SER 914 2HB SER 914 -0.622 -16.424 -11.074 769 HG SER 914 HG SER 914 0.413 -17.168 -9.238 770 HA TYR 915 HA TYR 915 0.338 -11.297 -10.009 771 1HB TYR 915 1HB TYR 915 1.700 -10.754 -11.789 772 2HB TYR 915 2HB TYR 915 0.646 -11.530 -12.961 773 HD1 TYR 915 HD1 TYR 915 0.157 -8.658 -10.548 774 HD2 TYR 915 HD2 TYR 915 0.019 -10.035 -14.616 775 HE1 TYR 915 HE1 TYR 915 -0.655 -6.438 -11.274 776 HE2 TYR 915 HE2 TYR 915 -0.790 -7.810 -15.338 777 HH TYR 915 HH TYR 915 -0.744 -5.496 -14.552 778 HA GLU 916 HA GLU 916 -3.782 -9.588 -11.104 779 1HB GLU 916 1HB GLU 916 -3.366 -10.778 -8.623 780 2HB GLU 916 2HB GLU 916 -4.059 -9.202 -8.234 781 1HG GLU 916 1HG GLU 916 -5.306 -10.755 -10.455 782 2HG GLU 916 2HG GLU 916 -5.618 -11.285 -8.802 783 HA ASP 917 HA ASP 917 -3.136 -5.290 -9.998 784 1HB ASP 917 1HB ASP 917 -3.936 -3.993 -11.974 785 2HB ASP 917 2HB ASP 917 -2.909 -5.357 -12.374 786 HA TRP 918 HA TRP 918 -6.590 -2.510 -9.035 787 1HB TRP 918 1HB TRP 918 -8.085 -3.850 -7.538 788 2HB TRP 918 2HB TRP 918 -7.930 -4.475 -9.158 789 HD1 TRP 918 HD1 TRP 918 -4.846 -5.680 -7.727 790 HE1 TRP 918 HE1 TRP 918 -5.154 -8.097 -6.862 791 HE3 TRP 918 HE3 TRP 918 -9.845 -5.722 -7.376 792 HZ2 TRP 918 HZ2 TRP 918 -7.365 -9.783 -5.983 793 HZ3 TRP 918 HZ3 TRP 918 -11.068 -7.617 -6.449 794 HH2 TRP 918 HH2 TRP 918 -9.850 -9.693 -5.760 795 1HA GLY 919 1HA GLY 919 -5.345 -2.546 -4.615 796 2HA GLY 919 2HA GLY 919 -5.132 -0.937 -5.288 797 HA VAL 920 HA VAL 920 -8.525 -0.080 -2.654 798 HB VAL 920 HB VAL 920 -7.430 2.540 -3.732 799 1HG1 VAL 920 1HG1 VAL 920 -9.181 1.849 -1.367 800 2HG1 VAL 920 2HG1 VAL 920 -8.182 3.303 -1.375 801 3HG1 VAL 920 3HG1 VAL 920 -9.440 3.090 -2.593 802 1HG2 VAL 920 1HG2 VAL 920 -6.551 0.534 -1.701 803 2HG2 VAL 920 2HG2 VAL 920 -5.580 1.534 -2.781 804 3HG2 VAL 920 3HG2 VAL 920 -6.287 2.236 -1.328 805 HA ASP 921 HA ASP 921 -11.189 1.706 -6.036 806 1HB ASP 921 1HB ASP 921 -9.430 2.103 -7.747 807 2HB ASP 921 2HB ASP 921 -9.526 0.403 -8.210 808 HA GLU 922 HA GLU 922 -12.664 -2.582 -6.413 809 1HB GLU 922 1HB GLU 922 -10.631 -2.836 -8.036 810 2HB GLU 922 2HB GLU 922 -10.039 -3.980 -6.833 811 1HG GLU 922 1HG GLU 922 -11.766 -5.494 -7.216 812 2HG GLU 922 2HG GLU 922 -12.879 -4.238 -7.758 813 HA LEU 923 HA LEU 923 -11.269 -4.021 -2.301 814 1HB LEU 923 1HB LEU 923 -8.942 -5.118 -1.962 815 2HB LEU 923 2HB LEU 923 -9.910 -5.610 -3.335 816 HG LEU 923 HG LEU 923 -8.418 -3.372 -4.202 817 1HD1 LEU 923 1HD1 LEU 923 -6.700 -5.450 -2.827 818 2HD1 LEU 923 2HD1 LEU 923 -6.117 -4.157 -3.875 819 3HD1 LEU 923 3HD1 LEU 923 -6.869 -3.770 -2.330 820 1HD2 LEU 923 1HD2 LEU 923 -8.873 -6.158 -4.768 821 2HD2 LEU 923 2HD2 LEU 923 -8.587 -4.803 -5.863 822 3HD2 LEU 923 3HD2 LEU 923 -7.224 -5.667 -5.152 823 HA ILE 924 HA ILE 924 -9.281 -1.747 0.885 824 HB ILE 924 HB ILE 924 -7.995 -4.382 1.072 825 1HG1 ILE 924 1HG1 ILE 924 -8.973 -3.943 3.445 826 2HG1 ILE 924 2HG1 ILE 924 -9.730 -2.557 2.665 827 1HG2 ILE 924 1HG2 ILE 924 -6.040 -2.944 1.618 828 2HG2 ILE 924 2HG2 ILE 924 -7.002 -2.187 2.886 829 3HG2 ILE 924 3HG2 ILE 924 -6.608 -3.899 2.983 830 1HD1 ILE 924 3HD1 ILE 924 -9.893 -5.390 1.626 831 2HD1 ILE 924 1HD1 ILE 924 -11.158 -4.597 2.562 832 3HD1 ILE 924 2HD1 ILE 924 -10.718 -3.979 0.970 833 HA ILE 925 HA ILE 925 -5.517 0.393 -0.075 834 HB ILE 925 HB ILE 925 -5.357 2.184 1.658 835 1HG1 ILE 925 1HG1 ILE 925 -7.711 1.195 3.139 836 2HG1 ILE 925 2HG1 ILE 925 -6.259 0.224 3.376 837 1HG2 ILE 925 1HG2 ILE 925 -7.757 1.426 0.173 838 2HG2 ILE 925 2HG2 ILE 925 -8.131 2.421 1.582 839 3HG2 ILE 925 3HG2 ILE 925 -7.007 3.011 0.360 840 1HD1 ILE 925 2HD1 ILE 925 -5.143 2.642 3.627 841 2HD1 ILE 925 3HD1 ILE 925 -6.782 3.065 4.125 842 3HD1 ILE 925 1HD1 ILE 925 -5.888 1.819 4.998 843 HA THR 926 HA THR 926 -2.079 -0.778 2.633 844 HB THR 926 HB THR 926 -3.024 0.780 5.048 845 HG1 THR 926 HG1 THR 926 -2.147 2.569 4.143 846 1HG2 THR 926 1HG2 THR 926 -1.069 -0.742 5.298 847 2HG2 THR 926 2HG2 THR 926 -0.249 0.146 4.014 848 3HG2 THR 926 3HG2 THR 926 -0.644 0.954 5.530 849 HA ASP 927 HA ASP 927 -5.156 -3.513 4.957 850 1HB ASP 927 1HB ASP 927 -4.592 -3.488 7.401 851 2HB ASP 927 2HB ASP 927 -3.213 -3.064 6.387 No H/Q in entry = 851 Start of MODEL 3 1 H1 MET 801 H3 MET 801 28.067 -9.375 52.074 2 H2 MET 801 H1 MET 801 29.069 -10.438 51.211 3 H3 MET 801 H2 MET 801 29.687 -9.582 52.543 4 HA MET 801 HA MET 801 29.480 -7.494 51.372 5 1HB MET 801 1HB MET 801 31.432 -9.140 51.169 6 2HB MET 801 2HB MET 801 30.756 -9.594 49.604 7 1HG MET 801 1HG MET 801 31.420 -7.657 48.614 8 2HG MET 801 2HG MET 801 31.003 -6.683 50.023 9 1HE MET 801 2HE MET 801 33.026 -9.084 48.359 10 2HE MET 801 1HE MET 801 34.620 -8.333 48.373 11 3HE MET 801 3HE MET 801 34.243 -9.605 49.533 12 HA SER 802 HA SER 802 26.471 -8.304 48.035 13 1HB SER 802 1HB SER 802 25.103 -7.355 50.476 14 2HB SER 802 2HB SER 802 24.321 -6.884 48.969 15 HG SER 802 HG SER 802 23.814 -8.900 48.617 16 HA ASP 803 HA ASP 803 27.173 -3.942 46.963 17 1HB ASP 803 1HB ASP 803 29.744 -5.425 46.498 18 2HB ASP 803 2HB ASP 803 29.529 -3.823 45.789 19 HA ASN 804 HA ASN 804 26.129 -5.391 42.741 20 1HB ASN 804 1HB ASN 804 23.890 -5.034 44.076 21 2HB ASN 804 2HB ASN 804 23.843 -3.494 43.216 22 2HD2 ASN 804 1HD2 ASN 804 23.258 -3.528 40.997 23 1HD2 ASN 804 2HD2 ASN 804 22.920 -4.952 40.138 24 HA GLU 805 HA GLU 805 27.652 -1.730 40.762 25 1HB GLU 805 1HB GLU 805 27.696 -3.981 39.195 26 2HB GLU 805 2HB GLU 805 26.778 -2.871 38.177 27 1HG GLU 805 1HG GLU 805 28.564 -1.476 37.851 28 2HG GLU 805 2HG GLU 805 29.202 -1.746 39.473 29 HA ASP 806 HA ASP 806 23.797 0.485 40.196 30 1HB ASP 806 1HB ASP 806 25.589 1.963 41.413 31 2HB ASP 806 2HB ASP 806 25.802 2.702 39.825 32 HA ASN 807 HA ASN 807 24.286 0.245 35.698 33 1HB ASN 807 1HB ASN 807 22.004 -0.895 36.644 34 2HB ASN 807 2HB ASN 807 21.324 0.488 35.786 35 2HD2 ASN 807 1HD2 ASN 807 21.303 -2.468 35.052 36 1HD2 ASN 807 2HD2 ASN 807 21.972 -2.529 33.493 37 HA PHE 808 HA PHE 808 22.300 4.485 35.293 38 1HB PHE 808 1HB PHE 808 23.446 3.311 32.758 39 2HB PHE 808 2HB PHE 808 23.070 5.031 32.870 40 HD1 PHE 808 HD1 PHE 808 23.856 6.044 35.310 41 HD2 PHE 808 HD2 PHE 808 25.661 2.767 33.198 42 HE1 PHE 808 HE1 PHE 808 25.982 6.430 36.528 43 HE2 PHE 808 HE2 PHE 808 27.786 3.154 34.417 44 HZ PHE 808 HZ PHE 808 27.947 4.984 36.081 45 HA ASP 809 HA ASP 809 18.603 3.317 32.447 46 1HB ASP 809 1HB ASP 809 19.494 5.754 32.572 47 2HB ASP 809 2HB ASP 809 19.753 5.597 30.834 48 1HA GLY 810 1HA GLY 810 19.581 1.705 28.363 49 2HA GLY 810 2HA GLY 810 21.224 1.199 28.758 50 HA ASP 811 HA ASP 811 19.593 -2.764 30.003 51 1HB ASP 811 1HB ASP 811 18.911 -3.926 27.904 52 2HB ASP 811 2HB ASP 811 18.372 -2.249 27.930 53 HA ASP 812 HA ASP 812 23.201 -5.309 29.249 54 1HB ASP 812 1HB ASP 812 20.968 -7.315 28.810 55 2HB ASP 812 2HB ASP 812 22.622 -7.763 29.223 56 HA PHE 813 HA PHE 813 23.572 -6.178 24.817 57 1HB PHE 813 1HB PHE 813 21.113 -5.190 24.710 58 2HB PHE 813 2HB PHE 813 21.921 -3.838 23.916 59 HD1 PHE 813 HD1 PHE 813 23.064 -4.129 21.767 60 HD2 PHE 813 HD2 PHE 813 21.036 -7.398 23.677 61 HE1 PHE 813 HE1 PHE 813 23.162 -5.424 19.654 62 HE2 PHE 813 HE2 PHE 813 21.134 -8.694 21.564 63 HZ PHE 813 HZ PHE 813 22.197 -7.707 19.553 64 HA ASP 814 HA ASP 814 26.075 -2.327 24.276 65 1HB ASP 814 1HB ASP 814 25.051 -1.408 26.455 66 2HB ASP 814 2HB ASP 814 26.485 -2.045 27.260 67 HA ASP 815 HA ASP 815 29.646 -4.888 25.626 68 1HB ASP 815 1HB ASP 815 27.972 -6.465 26.786 69 2HB ASP 815 2HB ASP 815 28.052 -7.440 25.318 70 HA VAL 816 HA VAL 816 31.036 -6.072 21.613 71 HB VAL 816 HB VAL 816 28.629 -6.372 21.207 72 1HG1 VAL 816 1HG1 VAL 816 28.020 -4.011 21.856 73 2HG1 VAL 816 2HG1 VAL 816 28.617 -3.486 20.281 74 3HG1 VAL 816 3HG1 VAL 816 27.236 -4.578 20.382 75 1HG2 VAL 816 1HG2 VAL 816 30.312 -6.531 19.315 76 2HG2 VAL 816 2HG2 VAL 816 28.659 -6.192 18.806 77 3HG2 VAL 816 3HG2 VAL 816 29.846 -4.891 18.861 78 HA GLU 817 HA GLU 817 32.577 -2.130 20.131 79 1HB GLU 817 1HB GLU 817 34.197 -3.177 21.837 80 2HB GLU 817 2HB GLU 817 35.060 -3.829 20.444 81 1HG GLU 817 1HG GLU 817 34.808 -1.267 19.639 82 2HG GLU 817 2HG GLU 817 34.836 -1.018 21.384 83 HA GLU 818 HA GLU 818 33.742 -3.932 16.081 84 1HB GLU 818 1HB GLU 818 32.407 -6.342 17.154 85 2HB GLU 818 2HB GLU 818 32.387 -6.216 15.394 86 1HG GLU 818 1HG GLU 818 34.943 -5.561 15.774 87 2HG GLU 818 2HG GLU 818 34.435 -7.248 15.675 88 HA ASP 819 HA ASP 819 30.169 -1.901 14.312 89 1HB ASP 819 1HB ASP 819 32.511 -1.319 13.067 90 2HB ASP 819 2HB ASP 819 31.683 -2.180 11.768 91 HA GLU 820 HA GLU 820 28.564 -5.771 12.648 92 1HB GLU 820 1HB GLU 820 26.468 -4.049 13.946 93 2HB GLU 820 2HB GLU 820 25.970 -5.455 13.004 94 1HG GLU 820 1HG GLU 820 28.165 -5.818 14.998 95 2HG GLU 820 2HG GLU 820 26.516 -5.662 15.604 96 1HA GLY 821 1HA GLY 821 27.834 -2.249 9.196 97 2HA GLY 821 2HA GLY 821 26.608 -3.515 9.118 98 HA LEU 822 HA LEU 822 24.273 0.126 11.220 99 1HB LEU 822 1HB LEU 822 25.119 2.414 11.691 100 2HB LEU 822 2HB LEU 822 26.113 1.188 12.474 101 HG LEU 822 HG LEU 822 27.379 1.386 10.070 102 1HD1 LEU 822 1HD1 LEU 822 26.060 4.031 10.675 103 2HD1 LEU 822 2HD1 LEU 822 27.591 3.957 9.803 104 3HD1 LEU 822 3HD1 LEU 822 26.156 3.178 9.135 105 1HD2 LEU 822 1HD2 LEU 822 27.733 2.779 12.710 106 2HD2 LEU 822 2HD2 LEU 822 28.710 1.502 11.985 107 3HD2 LEU 822 3HD2 LEU 822 28.832 3.155 11.382 108 HA ASP 823 HA ASP 823 24.695 2.446 7.072 109 1HB ASP 823 1HB ASP 823 27.320 1.158 6.811 110 2HB ASP 823 2HB ASP 823 26.479 1.319 5.269 111 HA ASP 824 HA ASP 824 23.358 -1.522 4.961 112 1HB ASP 824 1HB ASP 824 25.197 -2.865 6.628 113 2HB ASP 824 2HB ASP 824 23.682 -3.752 6.790 114 HA LEU 825 HA LEU 825 19.712 -1.761 7.575 115 1HB LEU 825 1HB LEU 825 21.515 -1.038 9.483 116 2HB LEU 825 2HB LEU 825 20.362 0.289 9.620 117 HG LEU 825 HG LEU 825 18.623 -1.756 9.496 118 1HD1 LEU 825 1HD1 LEU 825 20.791 -3.256 9.408 119 2HD1 LEU 825 2HD1 LEU 825 20.806 -2.985 11.150 120 3HD1 LEU 825 3HD1 LEU 825 19.415 -3.758 10.390 121 1HD2 LEU 825 1HD2 LEU 825 20.133 -0.637 11.862 122 2HD2 LEU 825 2HD2 LEU 825 18.520 -0.205 11.292 123 3HD2 LEU 825 3HD2 LEU 825 18.792 -1.765 12.070 124 HA GLU 826 HA GLU 826 18.230 2.399 6.304 125 1HB GLU 826 1HB GLU 826 20.221 2.202 4.613 126 2HB GLU 826 2HB GLU 826 18.980 1.663 3.481 127 1HG GLU 826 1HG GLU 826 17.718 3.819 4.443 128 2HG GLU 826 2HG GLU 826 18.845 3.929 3.092 129 HA ASN 827 HA ASN 827 14.553 -0.017 5.252 130 1HB ASN 827 1HB ASN 827 13.947 1.242 7.316 131 2HB ASN 827 2HB ASN 827 13.644 2.673 6.331 132 2HD2 ASN 827 1HD2 ASN 827 11.388 2.885 6.294 133 1HD2 ASN 827 2HD2 ASN 827 10.310 1.634 5.899 134 HA ALA 828 HA ALA 828 14.076 2.561 1.534 135 1HB ALA 828 1HB ALA 828 16.152 0.456 0.891 136 2HB ALA 828 2HB ALA 828 15.520 1.547 -0.342 137 3HB ALA 828 3HB ALA 828 16.383 2.197 1.052 138 HA GLU 829 HA GLU 829 11.702 -0.716 -0.598 139 1HB GLU 829 1HB GLU 829 14.252 -1.278 -1.937 140 2HB GLU 829 2HB GLU 829 13.075 -2.575 -2.144 141 1HG GLU 829 1HG GLU 829 11.390 -0.758 -2.773 142 2HG GLU 829 2HG GLU 829 12.677 -1.055 -3.941 143 HA GLU 830 HA GLU 830 14.395 -4.634 1.968 144 1HB GLU 830 1HB GLU 830 12.626 -3.052 3.064 145 2HB GLU 830 2HB GLU 830 11.444 -4.154 2.356 146 1HG GLU 830 1HG GLU 830 12.882 -6.031 3.445 147 2HG GLU 830 2HG GLU 830 11.815 -5.082 4.483 148 HA GLU 831 HA GLU 831 12.285 -6.047 -2.532 149 1HB GLU 831 1HB GLU 831 14.208 -7.201 -0.864 150 2HB GLU 831 2HB GLU 831 12.880 -8.362 -0.847 151 1HG GLU 831 1HG GLU 831 13.044 -8.794 -3.113 152 2HG GLU 831 2HG GLU 831 13.695 -7.195 -3.478 153 1HA GLY 832 1HA GLY 832 9.165 -8.634 0.088 154 2HA GLY 832 2HA GLY 832 8.433 -7.827 -1.300 155 HA GLN 833 HA GLN 833 8.166 -12.001 -2.827 156 1HB GLN 833 1HB GLN 833 7.951 -12.622 -0.433 157 2HB GLN 833 2HB GLN 833 6.833 -13.560 -1.428 158 1HG GLN 833 1HG GLN 833 6.147 -11.032 0.106 159 2HG GLN 833 2HG GLN 833 5.027 -11.966 -0.886 160 2HE2 GLN 833 1HE2 GLN 833 7.362 -12.600 1.808 161 1HE2 GLN 833 2HE2 GLN 833 6.337 -13.672 2.633 162 HA GLU 834 HA GLU 834 4.627 -11.096 -5.307 163 1HB GLU 834 1HB GLU 834 3.506 -10.658 -3.160 164 2HB GLU 834 2HB GLU 834 4.037 -8.977 -3.205 165 1HG GLU 834 1HG GLU 834 2.428 -8.373 -4.699 166 2HG GLU 834 2HG GLU 834 2.568 -9.879 -5.605 167 HA ASN 835 HA ASN 835 6.695 -7.816 -7.663 168 1HB ASN 835 1HB ASN 835 4.837 -9.452 -9.423 169 2HB ASN 835 2HB ASN 835 5.781 -8.090 -10.026 170 2HD2 ASN 835 1HD2 ASN 835 6.053 -11.049 -10.647 171 1HD2 ASN 835 2HD2 ASN 835 7.669 -11.417 -10.284 172 HA VAL 836 HA VAL 836 2.973 -5.424 -7.335 173 HB VAL 836 HB VAL 836 4.816 -5.315 -5.229 174 1HG1 VAL 836 3HG1 VAL 836 5.515 -3.077 -5.968 175 2HG1 VAL 836 1HG1 VAL 836 3.837 -2.537 -5.924 176 3HG1 VAL 836 2HG1 VAL 836 4.654 -2.999 -4.432 177 1HG2 VAL 836 1HG2 VAL 836 1.994 -4.278 -5.495 178 2HG2 VAL 836 2HG2 VAL 836 2.500 -5.867 -4.921 179 3HG2 VAL 836 3HG2 VAL 836 2.838 -4.431 -3.955 180 HA GLU 837 HA GLU 837 4.240 -1.800 -9.631 181 1HB GLU 837 1HB GLU 837 2.494 -3.400 -11.048 182 2HB GLU 837 2HB GLU 837 1.562 -1.920 -10.883 183 1HG GLU 837 1HG GLU 837 4.355 -1.401 -11.573 184 2HG GLU 837 2HG GLU 837 3.539 -2.394 -12.779 185 HA ILE 838 HA ILE 838 1.028 0.842 -7.892 186 HB ILE 838 HB ILE 838 3.555 2.471 -8.385 187 1HG1 ILE 838 1HG1 ILE 838 3.957 0.208 -7.355 188 2HG1 ILE 838 2HG1 ILE 838 4.428 1.551 -6.323 189 1HG2 ILE 838 1HG2 ILE 838 1.212 2.819 -6.562 190 2HG2 ILE 838 2HG2 ILE 838 2.804 3.340 -6.013 191 3HG2 ILE 838 3HG2 ILE 838 2.110 4.027 -7.480 192 1HD1 ILE 838 1HD1 ILE 838 1.771 1.120 -5.631 193 2HD1 ILE 838 2HD1 ILE 838 2.396 -0.509 -5.872 194 3HD1 ILE 838 3HD1 ILE 838 3.171 0.573 -4.716 195 HA LEU 839 HA LEU 839 -0.019 4.295 -10.685 196 1HB LEU 839 1HB LEU 839 -0.329 2.209 -11.899 197 2HB LEU 839 2HB LEU 839 -1.762 1.821 -10.952 198 HG LEU 839 HG LEU 839 -2.522 4.222 -11.942 199 1HD1 LEU 839 1HD1 LEU 839 -0.240 4.164 -13.217 200 2HD1 LEU 839 2HD1 LEU 839 -1.051 3.007 -14.271 201 3HD1 LEU 839 3HD1 LEU 839 -1.691 4.641 -14.098 202 1HD2 LEU 839 1HD2 LEU 839 -2.795 1.403 -12.884 203 2HD2 LEU 839 2HD2 LEU 839 -4.034 2.522 -12.315 204 3HD2 LEU 839 3HD2 LEU 839 -3.391 2.674 -13.950 205 HA PRO 840 HA PRO 840 -3.115 6.543 -8.410 206 1HB PRO 840 1HB PRO 840 -3.284 8.375 -9.732 207 2HB PRO 840 2HB PRO 840 -4.374 7.503 -10.815 208 1HG PRO 840 1HG PRO 840 -1.714 8.314 -11.372 209 2HG PRO 840 2HG PRO 840 -2.724 7.253 -12.359 210 1HD PRO 840 1HD PRO 840 -1.211 5.595 -11.898 211 2HD PRO 840 2HD PRO 840 -0.446 6.558 -10.614 212 HA SER 841 HA SER 841 -6.461 3.668 -7.909 213 1HB SER 841 1HB SER 841 -8.407 4.783 -7.252 214 2HB SER 841 2HB SER 841 -7.179 6.004 -6.941 215 HG SER 841 HG SER 841 -9.115 6.642 -8.200 216 1HA GLY 842 1HA GLY 842 -7.658 3.352 -12.138 217 2HA GLY 842 2HA GLY 842 -7.670 1.668 -11.615 218 HA GLU 843 HA GLU 843 -12.077 1.972 -10.263 219 1HB GLU 843 1HB GLU 843 -11.276 2.176 -13.073 220 2HB GLU 843 2HB GLU 843 -12.798 1.305 -12.899 221 1HG GLU 843 1HG GLU 843 -13.095 3.424 -11.133 222 2HG GLU 843 2HG GLU 843 -12.229 4.151 -12.487 223 HA ARG 844 HA ARG 844 -11.969 -2.522 -9.793 224 1HB ARG 844 1HB ARG 844 -12.674 -2.427 -7.638 225 2HB ARG 844 2HB ARG 844 -13.780 -1.103 -7.977 226 1HG ARG 844 1HG ARG 844 -15.422 -2.649 -8.901 227 2HG ARG 844 2HG ARG 844 -14.292 -3.994 -8.742 228 1HD ARG 844 1HD ARG 844 -14.476 -2.735 -6.181 229 2HD ARG 844 2HD ARG 844 -15.063 -4.346 -6.641 230 HE ARG 844 HE ARG 844 -16.663 -1.826 -6.971 231 1HH1 ARG 844 1HH1 ARG 844 -17.836 -3.883 -8.598 232 2HH1 ARG 844 2HH1 ARG 844 -18.869 -4.756 -7.516 233 1HH2 ARG 844 1HH2 ARG 844 -17.351 -3.525 -4.651 234 2HH2 ARG 844 2HH2 ARG 844 -18.594 -4.554 -5.282 235 HA PRO 845 HA PRO 845 -16.311 -2.853 -11.911 236 1HB PRO 845 1HB PRO 845 -17.055 -0.172 -12.656 237 2HB PRO 845 2HB PRO 845 -17.879 -1.253 -11.529 238 1HG PRO 845 1HG PRO 845 -16.408 1.110 -10.898 239 2HG PRO 845 2HG PRO 845 -17.160 -0.022 -9.770 240 1HD PRO 845 1HD PRO 845 -15.077 -0.704 -9.115 241 2HD PRO 845 2HD PRO 845 -14.321 0.333 -10.345 242 HA GLN 846 HA GLN 846 -14.398 -2.391 -15.885 243 1HB GLN 846 1HB GLN 846 -13.562 -0.280 -14.895 244 2HB GLN 846 2HB GLN 846 -12.126 -1.132 -14.326 245 1HG GLN 846 1HG GLN 846 -11.363 -1.543 -16.549 246 2HG GLN 846 2HG GLN 846 -12.916 -1.076 -17.244 247 2HE2 GLN 846 1HE2 GLN 846 -9.831 0.122 -16.188 248 1HE2 GLN 846 2HE2 GLN 846 -10.147 1.770 -16.451 249 HA ALA 847 HA ALA 847 -10.742 -5.203 -15.655 250 1HB ALA 847 1HB ALA 847 -9.465 -3.265 -13.812 251 2HB ALA 847 2HB ALA 847 -8.754 -4.879 -13.795 252 3HB ALA 847 3HB ALA 847 -8.841 -3.969 -15.304 253 HA ASN 848 HA ASN 848 -12.590 -7.130 -11.774 254 1HB ASN 848 1HB ASN 848 -14.491 -7.121 -13.679 255 2HB ASN 848 2HB ASN 848 -13.957 -8.794 -13.843 256 2HD2 ASN 848 1HD2 ASN 848 -15.505 -10.007 -12.714 257 1HD2 ASN 848 2HD2 ASN 848 -16.010 -9.681 -11.127 258 HA GLN 849 HA GLN 849 -9.710 -10.361 -13.242 259 1HB GLN 849 1HB GLN 849 -8.282 -8.040 -13.167 260 2HB GLN 849 2HB GLN 849 -7.572 -8.881 -11.791 261 1HG GLN 849 1HG GLN 849 -7.138 -10.851 -13.248 262 2HG GLN 849 2HG GLN 849 -7.789 -9.957 -14.620 263 2HE2 GLN 849 1HE2 GLN 849 -5.834 -8.341 -12.131 264 1HE2 GLN 849 2HE2 GLN 849 -4.484 -8.065 -13.109 265 HA LYS 850 HA LYS 850 -8.092 -11.455 -8.842 266 1HB LYS 850 1HB LYS 850 -9.738 -13.280 -8.430 267 2HB LYS 850 2HB LYS 850 -10.498 -11.883 -9.185 268 1HG LYS 850 1HG LYS 850 -9.844 -13.204 -11.415 269 2HG LYS 850 2HG LYS 850 -11.339 -13.552 -10.546 270 1HD LYS 850 1HD LYS 850 -8.824 -15.147 -10.726 271 2HD LYS 850 2HD LYS 850 -9.687 -15.177 -9.187 272 1HE LYS 850 1HE LYS 850 -11.382 -16.440 -10.043 273 2HE LYS 850 2HE LYS 850 -11.446 -15.487 -11.540 274 1HZ LYS 850 1HZ LYS 850 -9.290 -16.547 -12.154 275 2HZ LYS 850 2HZ LYS 850 -9.479 -17.596 -10.831 276 3HZ LYS 850 3HZ LYS 850 -10.601 -17.622 -12.107 277 HA ARG 851 HA ARG 851 -6.298 -15.667 -9.330 278 1HB ARG 851 1HB ARG 851 -4.981 -13.249 -10.148 279 2HB ARG 851 2HB ARG 851 -3.786 -14.324 -9.424 280 1HG ARG 851 1HG ARG 851 -5.747 -15.548 -11.306 281 2HG ARG 851 2HG ARG 851 -4.497 -14.520 -12.005 282 1HD ARG 851 1HD ARG 851 -2.738 -15.867 -11.012 283 2HD ARG 851 2HD ARG 851 -3.927 -16.819 -10.102 284 HE ARG 851 HE ARG 851 -4.342 -16.758 -13.017 285 1HH1 ARG 851 1HH1 ARG 851 -4.572 -18.707 -10.386 286 2HH1 ARG 851 2HH1 ARG 851 -3.804 -20.095 -11.082 287 1HH2 ARG 851 1HH2 ARG 851 -2.670 -18.394 -13.882 288 2HH2 ARG 851 2HH2 ARG 851 -2.727 -19.918 -13.062 289 HA ILE 852 HA ILE 852 -4.437 -15.424 -5.139 290 HB ILE 852 HB ILE 852 -2.022 -14.724 -4.952 291 1HG1 ILE 852 1HG1 ILE 852 -1.451 -13.586 -7.379 292 2HG1 ILE 852 2HG1 ILE 852 -2.987 -12.822 -7.012 293 1HG2 ILE 852 1HG2 ILE 852 -2.984 -16.637 -6.410 294 2HG2 ILE 852 2HG2 ILE 852 -2.665 -15.568 -7.775 295 3HG2 ILE 852 3HG2 ILE 852 -1.339 -16.102 -6.743 296 1HD1 ILE 852 2HD1 ILE 852 -2.037 -12.303 -4.702 297 2HD1 ILE 852 3HD1 ILE 852 -0.471 -12.785 -5.343 298 3HD1 ILE 852 1HD1 ILE 852 -1.322 -11.414 -6.046 299 HA THR 853 HA THR 853 -3.611 -10.979 -3.307 300 HB THR 853 HB THR 853 -4.637 -8.950 -4.344 301 HG1 THR 853 HG1 THR 853 -5.853 -10.885 -5.801 302 1HG2 THR 853 1HG2 THR 853 -2.319 -9.707 -4.896 303 2HG2 THR 853 2HG2 THR 853 -2.977 -10.575 -6.276 304 3HG2 THR 853 3HG2 THR 853 -3.099 -8.824 -6.204 305 HA THR 854 HA THR 854 -7.597 -11.758 -1.599 306 HB THR 854 HB THR 854 -5.975 -12.335 0.185 307 HG1 THR 854 HG1 THR 854 -8.047 -10.598 1.038 308 1HG2 THR 854 1HG2 THR 854 -5.294 -9.591 -0.033 309 2HG2 THR 854 2HG2 THR 854 -5.937 -9.823 1.593 310 3HG2 THR 854 3HG2 THR 854 -4.575 -10.795 1.035 311 HA PRO 855 HA PRO 855 -9.444 -7.781 -2.178 312 1HB PRO 855 1HB PRO 855 -11.624 -8.416 -1.958 313 2HB PRO 855 2HB PRO 855 -11.478 -8.311 -0.201 314 1HG PRO 855 1HG PRO 855 -11.730 -10.675 -1.794 315 2HG PRO 855 2HG PRO 855 -11.493 -10.579 -0.046 316 1HD PRO 855 1HD PRO 855 -9.384 -11.433 -0.330 317 2HD PRO 855 2HD PRO 855 -9.565 -11.371 -2.101 318 HA TYR 856 HA TYR 856 -7.850 -5.286 1.112 319 1HB TYR 856 1HB TYR 856 -8.517 -7.274 2.402 320 2HB TYR 856 2HB TYR 856 -6.952 -8.004 2.096 321 HD1 TYR 856 HD1 TYR 856 -4.854 -6.584 2.888 322 HD2 TYR 856 HD2 TYR 856 -8.857 -6.001 4.330 323 HE1 TYR 856 HE1 TYR 856 -3.966 -5.486 4.910 324 HE2 TYR 856 HE2 TYR 856 -7.965 -4.902 6.353 325 HH TYR 856 HH TYR 856 -5.499 -5.125 7.630 326 HA MET 857 HA MET 857 -3.820 -5.205 -0.983 327 1HB MET 857 1HB MET 857 -4.735 -2.912 -1.318 328 2HB MET 857 2HB MET 857 -4.314 -2.526 0.348 329 1HG MET 857 1HG MET 857 -1.911 -3.181 -0.263 330 2HG MET 857 2HG MET 857 -2.433 -3.145 -1.942 331 1HE MET 857 1HE MET 857 -3.522 -1.364 -3.034 332 2HE MET 857 2HE MET 857 -4.596 -0.637 -1.848 333 3HE MET 857 3HE MET 857 -3.409 0.363 -2.678 334 HA THR 858 HA THR 858 -1.599 -5.131 2.954 335 HB THR 858 HB THR 858 0.102 -6.917 2.673 336 HG1 THR 858 HG1 THR 858 -0.584 -6.697 -0.068 337 1HG2 THR 858 1HG2 THR 858 -2.533 -7.204 1.212 338 2HG2 THR 858 2HG2 THR 858 -1.533 -8.562 1.727 339 3HG2 THR 858 3HG2 THR 858 -2.244 -7.484 2.927 340 HA LYS 859 HA LYS 859 1.092 -1.818 3.678 341 1HB LYS 859 1HB LYS 859 3.024 -2.593 5.041 342 2HB LYS 859 2HB LYS 859 1.485 -3.232 5.620 343 1HG LYS 859 1HG LYS 859 1.899 -5.349 4.446 344 2HG LYS 859 2HG LYS 859 3.416 -4.715 3.810 345 1HD LYS 859 1HD LYS 859 2.974 -4.658 6.772 346 2HD LYS 859 2HD LYS 859 3.394 -6.193 6.010 347 1HE LYS 859 1HE LYS 859 5.259 -4.691 4.824 348 2HE LYS 859 2HE LYS 859 5.039 -3.708 6.285 349 1HZ LYS 859 1HZ LYS 859 5.358 -6.656 6.359 350 2HZ LYS 859 2HZ LYS 859 6.673 -5.589 6.498 351 3HZ LYS 859 3HZ LYS 859 5.435 -5.570 7.661 352 HA TYR 860 HA TYR 860 4.831 -3.139 1.038 353 1HB TYR 860 1HB TYR 860 4.858 -5.524 0.929 354 2HB TYR 860 2HB TYR 860 3.434 -5.571 -0.101 355 HD1 TYR 860 HD1 TYR 860 6.099 -3.029 -0.421 356 HD2 TYR 860 HD2 TYR 860 4.522 -6.695 -2.022 357 HE1 TYR 860 HE1 TYR 860 7.493 -2.733 -2.435 358 HE2 TYR 860 HE2 TYR 860 5.932 -6.389 -4.032 359 HH TYR 860 HH TYR 860 8.401 -4.906 -4.351 360 HA GLU 861 HA GLU 861 2.104 -2.555 -2.996 361 1HB GLU 861 1HB GLU 861 -0.223 -2.982 -1.123 362 2HB GLU 861 2HB GLU 861 -0.451 -2.043 -2.598 363 1HG GLU 861 1HG GLU 861 0.809 -4.142 -3.670 364 2HG GLU 861 2HG GLU 861 -0.937 -4.141 -3.423 365 HA ARG 862 HA ARG 862 1.167 1.440 -0.561 366 1HB ARG 862 1HB ARG 862 0.407 -0.193 1.577 367 2HB ARG 862 2HB ARG 862 1.671 0.840 2.239 368 1HG ARG 862 1HG ARG 862 -0.191 2.320 0.529 369 2HG ARG 862 2HG ARG 862 -0.998 1.561 1.897 370 1HD ARG 862 1HD ARG 862 -0.059 3.930 2.290 371 2HD ARG 862 2HD ARG 862 0.409 2.702 3.474 372 HE ARG 862 HE ARG 862 2.185 3.170 1.133 373 1HH1 ARG 862 1HH1 ARG 862 2.684 1.503 3.721 374 2HH1 ARG 862 2HH1 ARG 862 3.822 2.532 4.522 375 1HH2 ARG 862 1HH2 ARG 862 3.167 5.273 2.507 376 2HH2 ARG 862 2HH2 ARG 862 4.095 4.663 3.836 377 HA ALA 863 HA ALA 863 5.532 1.240 1.395 378 1HB ALA 863 2HB ALA 863 6.440 -1.496 0.733 379 2HB ALA 863 3HB ALA 863 6.695 -0.560 2.203 380 3HB ALA 863 1HB ALA 863 5.171 -1.408 1.952 381 HA ARG 864 HA ARG 864 7.086 0.388 -2.942 382 1HB ARG 864 1HB ARG 864 4.894 -1.412 -3.328 383 2HB ARG 864 2HB ARG 864 4.899 -0.288 -4.690 384 1HG ARG 864 1HG ARG 864 7.579 -1.235 -3.912 385 2HG ARG 864 2HG ARG 864 6.518 -2.505 -4.499 386 1HD ARG 864 1HD ARG 864 6.028 -0.507 -6.327 387 2HD ARG 864 2HD ARG 864 7.219 -1.801 -6.567 388 HE ARG 864 HE ARG 864 8.345 0.327 -4.973 389 1HH1 ARG 864 1HH1 ARG 864 7.003 1.743 -7.318 390 2HH1 ARG 864 2HH1 ARG 864 8.305 1.803 -8.459 391 1HH2 ARG 864 1HH2 ARG 864 10.213 -0.578 -6.812 392 2HH2 ARG 864 2HH2 ARG 864 10.121 0.489 -8.173 393 HA VAL 865 HA VAL 865 3.217 3.357 -4.171 394 HB VAL 865 HB VAL 865 2.502 2.071 -1.612 395 1HG1 VAL 865 1HG1 VAL 865 2.027 4.961 -2.055 396 2HG1 VAL 865 2HG1 VAL 865 0.775 3.993 -1.275 397 3HG1 VAL 865 3HG1 VAL 865 2.384 4.090 -0.564 398 1HG2 VAL 865 1HG2 VAL 865 1.496 1.587 -3.790 399 2HG2 VAL 865 2HG2 VAL 865 0.329 2.043 -2.550 400 3HG2 VAL 865 3HG2 VAL 865 0.804 3.209 -3.784 401 HA LEU 866 HA LEU 866 4.908 5.968 -0.279 402 1HB LEU 866 1HB LEU 866 5.156 4.626 1.586 403 2HB LEU 866 2HB LEU 866 5.658 3.239 0.628 404 HG LEU 866 HG LEU 866 7.629 5.454 0.744 405 1HD1 LEU 866 1HD1 LEU 866 6.415 5.033 3.108 406 2HD1 LEU 866 2HD1 LEU 866 7.575 3.706 3.153 407 3HD1 LEU 866 3HD1 LEU 866 8.141 5.367 2.980 408 1HD2 LEU 866 1HD2 LEU 866 7.666 2.439 1.051 409 2HD2 LEU 866 2HD2 LEU 866 8.245 3.381 -0.322 410 3HD2 LEU 866 3HD2 LEU 866 9.110 3.437 1.212 411 1HA GLY 867 1HA GLY 867 9.076 4.990 -2.400 412 2HA GLY 867 2HA GLY 867 8.584 3.577 -3.341 413 HA THR 868 HA THR 868 6.910 6.152 -6.510 414 HB THR 868 HB THR 868 4.740 5.608 -7.336 415 HG1 THR 868 HG1 THR 868 3.136 5.455 -6.002 416 1HG2 THR 868 1HG2 THR 868 6.600 3.823 -6.734 417 2HG2 THR 868 2HG2 THR 868 5.292 3.198 -5.728 418 3HG2 THR 868 3HG2 THR 868 5.060 3.368 -7.467 419 HA ARG 869 HA ARG 869 4.122 9.079 -4.052 420 1HB ARG 869 1HB ARG 869 4.322 7.127 -1.874 421 2HB ARG 869 2HB ARG 869 4.597 8.764 -1.279 422 1HG ARG 869 1HG ARG 869 2.221 8.332 -1.159 423 2HG ARG 869 2HG ARG 869 2.494 9.469 -2.479 424 1HD ARG 869 1HD ARG 869 2.743 7.003 -3.734 425 2HD ARG 869 2HD ARG 869 1.416 6.747 -2.583 426 HE ARG 869 HE ARG 869 0.465 8.944 -3.528 427 1HH1 ARG 869 1HH1 ARG 869 1.375 6.254 -5.276 428 2HH1 ARG 869 2HH1 ARG 869 1.335 7.018 -6.830 429 1HH2 ARG 869 1HH2 ARG 869 0.923 10.212 -5.545 430 2HH2 ARG 869 2HH2 ARG 869 1.079 9.258 -6.982 431 HA ALA 870 HA ALA 870 8.349 10.033 -1.784 432 1HB ALA 870 3HB ALA 870 9.013 7.973 -0.845 433 2HB ALA 870 2HB ALA 870 10.291 8.315 -2.011 434 3HB ALA 870 1HB ALA 870 9.015 7.168 -2.413 435 HA LEU 871 HA LEU 871 10.309 10.148 -5.954 436 1HB LEU 871 1HB LEU 871 9.295 8.707 -8.148 437 2HB LEU 871 2HB LEU 871 10.812 8.417 -7.316 438 HG LEU 871 HG LEU 871 8.352 7.241 -6.126 439 1HD1 LEU 871 1HD1 LEU 871 9.619 6.396 -8.720 440 2HD1 LEU 871 2HD1 LEU 871 8.784 5.238 -7.684 441 3HD1 LEU 871 3HD1 LEU 871 7.908 6.614 -8.355 442 1HD2 LEU 871 1HD2 LEU 871 11.220 6.336 -6.546 443 2HD2 LEU 871 2HD2 LEU 871 10.536 6.957 -5.044 444 3HD2 LEU 871 3HD2 LEU 871 9.995 5.405 -5.684 445 HA GLN 872 HA GLN 872 6.114 11.190 -8.292 446 1HB GLN 872 1HB GLN 872 5.083 10.186 -5.731 447 2HB GLN 872 2HB GLN 872 4.373 11.727 -6.181 448 1HG GLN 872 1HG GLN 872 3.112 9.691 -7.023 449 2HG GLN 872 2HG GLN 872 3.554 10.848 -8.270 450 2HE2 GLN 872 1HE2 GLN 872 3.588 7.564 -7.557 451 1HE2 GLN 872 2HE2 GLN 872 4.811 7.074 -8.629 452 HA ILE 873 HA ILE 873 6.511 15.024 -5.297 453 HB ILE 873 HB ILE 873 7.931 14.649 -3.054 454 1HG1 ILE 873 1HG1 ILE 873 6.437 12.251 -2.558 455 2HG1 ILE 873 2HG1 ILE 873 7.458 12.003 -3.962 456 1HG2 ILE 873 1HG2 ILE 873 5.034 14.434 -3.670 457 2HG2 ILE 873 2HG2 ILE 873 5.580 14.181 -2.018 458 3HG2 ILE 873 3HG2 ILE 873 5.917 15.703 -2.830 459 1HD1 ILE 873 1HD1 ILE 873 8.816 13.411 -1.795 460 2HD1 ILE 873 2HD1 ILE 873 8.298 11.783 -1.367 461 3HD1 ILE 873 3HD1 ILE 873 9.343 12.042 -2.760 462 HA ALA 874 HA ALA 874 11.262 14.120 -4.842 463 1HB ALA 874 2HB ALA 874 10.935 11.675 -6.585 464 2HB ALA 874 1HB ALA 874 11.128 11.631 -4.833 465 3HB ALA 874 3HB ALA 874 12.434 12.235 -5.847 466 HA MET 875 HA MET 875 10.837 15.410 -9.250 467 1HB MET 875 1HB MET 875 8.837 13.530 -9.607 468 2HB MET 875 2HB MET 875 7.962 15.037 -9.882 469 1HG MET 875 1HG MET 875 10.190 15.550 -11.320 470 2HG MET 875 2HG MET 875 10.141 13.794 -11.476 471 1HE MET 875 1HE MET 875 9.131 12.612 -12.746 472 2HE MET 875 2HE MET 875 7.383 12.587 -12.476 473 3HE MET 875 3HE MET 875 8.027 13.008 -14.061 474 HA CYS 876 HA CYS 876 7.976 18.491 -7.161 475 1HB CYS 876 1HB CYS 876 6.103 17.460 -9.284 476 2HB CYS 876 2HB CYS 876 5.575 18.806 -8.273 477 HG CYS 876 HG CYS 876 6.851 19.862 -10.278 478 HA ALA 877 HA ALA 877 4.833 15.535 -4.985 479 1HB ALA 877 3HB ALA 877 4.933 17.595 -3.950 480 2HB ALA 877 1HB ALA 877 4.037 18.398 -5.239 481 3HB ALA 877 2HB ALA 877 3.190 17.366 -4.088 482 HA PRO 878 HA PRO 878 1.146 14.883 -7.970 483 1HB PRO 878 1HB PRO 878 2.084 12.185 -8.254 484 2HB PRO 878 2HB PRO 878 1.966 13.421 -9.510 485 1HG PRO 878 1HG PRO 878 4.333 12.376 -8.279 486 2HG PRO 878 2HG PRO 878 4.217 13.575 -9.556 487 1HD PRO 878 1HD PRO 878 4.977 13.988 -6.828 488 2HD PRO 878 2HD PRO 878 4.803 15.203 -8.111 489 HA VAL 879 HA VAL 879 1.419 11.552 -4.194 490 HB VAL 879 HB VAL 879 2.644 14.094 -3.082 491 1HG1 VAL 879 1HG1 VAL 879 1.116 12.937 -1.380 492 2HG1 VAL 879 2HG1 VAL 879 2.250 11.591 -1.435 493 3HG1 VAL 879 3HG1 VAL 879 2.785 13.182 -0.898 494 1HG2 VAL 879 1HG2 VAL 879 3.929 12.302 -4.468 495 2HG2 VAL 879 2HG2 VAL 879 4.647 12.902 -2.989 496 3HG2 VAL 879 3HG2 VAL 879 3.846 11.343 -2.995 497 HA MET 880 HA MET 880 -2.452 13.373 -3.069 498 1HB MET 880 1HB MET 880 -1.846 10.940 -1.633 499 2HB MET 880 2HB MET 880 -2.926 11.944 -0.666 500 1HG MET 880 1HG MET 880 -3.602 11.788 -3.544 501 2HG MET 880 2HG MET 880 -3.782 10.279 -2.651 502 1HE MET 880 2HE MET 880 -5.327 12.948 -4.033 503 2HE MET 880 1HE MET 880 -6.615 13.585 -3.012 504 3HE MET 880 3HE MET 880 -4.961 14.148 -2.785 505 HA VAL 881 HA VAL 881 -1.428 16.379 0.036 506 HB VAL 881 HB VAL 881 0.432 16.052 1.747 507 1HG1 VAL 881 1HG1 VAL 881 -1.949 14.830 1.569 508 2HG1 VAL 881 2HG1 VAL 881 -0.921 13.404 1.439 509 3HG1 VAL 881 3HG1 VAL 881 -0.808 14.450 2.854 510 1HG2 VAL 881 1HG2 VAL 881 1.750 14.735 -0.186 511 2HG2 VAL 881 2HG2 VAL 881 2.011 14.391 1.524 512 3HG2 VAL 881 3HG2 VAL 881 0.944 13.360 0.570 513 HA GLU 882 HA GLU 882 1.924 18.664 -1.854 514 1HB GLU 882 1HB GLU 882 -0.489 19.834 -1.450 515 2HB GLU 882 2HB GLU 882 0.558 20.988 -0.623 516 1HG GLU 882 1HG GLU 882 1.872 21.347 -2.593 517 2HG GLU 882 2HG GLU 882 1.126 19.977 -3.418 518 HA LEU 883 HA LEU 883 4.103 19.467 2.236 519 1HB LEU 883 1HB LEU 883 4.931 17.188 1.880 520 2HB LEU 883 2HB LEU 883 5.856 17.717 0.475 521 HG LEU 883 HG LEU 883 7.106 19.297 1.992 522 1HD1 LEU 883 1HD1 LEU 883 5.321 17.927 3.978 523 2HD1 LEU 883 2HD1 LEU 883 6.935 18.428 4.481 524 3HD1 LEU 883 3HD1 LEU 883 5.786 19.626 3.882 525 1HD2 LEU 883 3HD2 LEU 883 7.211 16.345 2.699 526 2HD2 LEU 883 1HD2 LEU 883 8.053 17.111 1.351 527 3HD2 LEU 883 2HD2 LEU 883 8.495 17.514 3.011 528 HA GLU 884 HA GLU 884 6.438 22.259 -0.661 529 1HB GLU 884 1HB GLU 884 8.229 20.796 1.021 530 2HB GLU 884 2HB GLU 884 9.162 21.467 -0.314 531 1HG GLU 884 1HG GLU 884 7.174 23.152 1.209 532 2HG GLU 884 2HG GLU 884 8.835 22.959 1.771 533 1HA GLY 885 1HA GLY 885 6.923 19.281 -4.627 534 2HA GLY 885 2HA GLY 885 8.206 20.480 -4.450 535 HA GLU 886 HA GLU 886 9.780 16.262 -2.052 536 1HB GLU 886 1HB GLU 886 10.476 16.323 -4.331 537 2HB GLU 886 2HB GLU 886 11.317 17.855 -4.115 538 1HG GLU 886 1HG GLU 886 12.993 16.776 -2.709 539 2HG GLU 886 2HG GLU 886 12.112 15.249 -2.788 540 HA THR 887 HA THR 887 13.129 17.882 0.451 541 HB THR 887 HB THR 887 10.447 18.107 1.875 542 HG1 THR 887 HG1 THR 887 10.502 20.170 1.136 543 1HG2 THR 887 1HG2 THR 887 13.205 19.041 2.668 544 2HG2 THR 887 2HG2 THR 887 11.757 19.869 3.242 545 3HG2 THR 887 3HG2 THR 887 12.020 18.171 3.640 546 HA ASP 888 HA ASP 888 12.432 14.528 3.592 547 1HB ASP 888 1HB ASP 888 9.912 15.280 3.769 548 2HB ASP 888 2HB ASP 888 9.635 13.696 3.051 549 HA PRO 889 HA PRO 889 13.296 11.149 0.848 550 1HB PRO 889 1HB PRO 889 13.526 9.276 3.019 551 2HB PRO 889 2HB PRO 889 14.826 10.090 2.144 552 1HG PRO 889 1HG PRO 889 14.022 10.544 4.834 553 2HG PRO 889 2HG PRO 889 15.224 11.449 3.909 554 1HD PRO 889 1HD PRO 889 13.822 13.247 3.951 555 2HD PRO 889 2HD PRO 889 12.530 12.267 4.689 556 HA LEU 890 HA LEU 890 8.960 9.624 1.300 557 1HB LEU 890 1HB LEU 890 10.506 7.892 2.281 558 2HB LEU 890 2HB LEU 890 8.811 7.589 2.619 559 HG LEU 890 HG LEU 890 10.396 7.250 4.576 560 1HD1 LEU 890 1HD1 LEU 890 11.759 9.326 4.040 561 2HD1 LEU 890 2HD1 LEU 890 10.424 10.267 4.704 562 3HD1 LEU 890 3HD1 LEU 890 11.297 9.131 5.731 563 1HD2 LEU 890 1HD2 LEU 890 7.817 8.068 4.532 564 2HD2 LEU 890 2HD2 LEU 890 8.702 7.742 6.022 565 3HD2 LEU 890 3HD2 LEU 890 8.542 9.398 5.438 566 HA LEU 891 HA LEU 891 7.102 11.561 5.529 567 1HB LEU 891 1HB LEU 891 8.153 13.636 5.711 568 2HB LEU 891 2HB LEU 891 8.226 13.831 3.971 569 HG LEU 891 HG LEU 891 6.703 15.444 5.061 570 1HD1 LEU 891 1HD1 LEU 891 6.289 14.177 2.694 571 2HD1 LEU 891 2HD1 LEU 891 4.753 13.878 3.507 572 3HD1 LEU 891 3HD1 LEU 891 5.324 15.528 3.271 573 1HD2 LEU 891 1HD2 LEU 891 5.349 12.914 5.937 574 2HD2 LEU 891 2HD2 LEU 891 5.748 14.342 6.887 575 3HD2 LEU 891 3HD2 LEU 891 4.415 14.396 5.735 576 HA ILE 892 HA ILE 892 4.423 12.814 1.650 577 HB ILE 892 HB ILE 892 6.523 11.331 0.062 578 1HG1 ILE 892 1HG1 ILE 892 7.182 13.535 -0.838 579 2HG1 ILE 892 2HG1 ILE 892 7.469 13.448 0.891 580 1HG2 ILE 892 1HG2 ILE 892 3.963 11.653 -0.548 581 2HG2 ILE 892 2HG2 ILE 892 4.608 13.156 -1.199 582 3HG2 ILE 892 3HG2 ILE 892 5.249 11.605 -1.744 583 1HD1 ILE 892 1HD1 ILE 892 4.811 14.346 0.486 584 2HD1 ILE 892 2HD1 ILE 892 6.171 15.231 1.172 585 3HD1 ILE 892 3HD1 ILE 892 5.870 15.290 -0.562 586 HA ALA 893 HA ALA 893 4.208 8.138 0.790 587 1HB ALA 893 3HB ALA 893 6.249 7.260 0.217 588 2HB ALA 893 1HB ALA 893 7.038 7.902 1.656 589 3HB ALA 893 2HB ALA 893 6.026 6.465 1.772 590 HA MET 894 HA MET 894 4.093 7.515 5.492 591 1HB MET 894 1HB MET 894 6.204 8.481 6.165 592 2HB MET 894 2HB MET 894 5.659 10.104 5.754 593 1HG MET 894 1HG MET 894 3.849 8.920 7.670 594 2HG MET 894 2HG MET 894 5.501 8.834 8.276 595 1HE MET 894 1HE MET 894 7.026 10.649 7.267 596 2HE MET 894 3HE MET 894 6.691 12.378 7.286 597 3HE MET 894 2HE MET 894 7.005 11.519 8.799 598 HA LYS 895 HA LYS 895 1.511 11.594 6.192 599 1HB LYS 895 1HB LYS 895 2.835 13.345 5.298 600 2HB LYS 895 2HB LYS 895 2.875 12.609 3.698 601 1HG LYS 895 1HG LYS 895 0.987 13.658 3.078 602 2HG LYS 895 2HG LYS 895 0.144 13.148 4.540 603 1HD LYS 895 1HD LYS 895 2.159 15.204 5.075 604 2HD LYS 895 2HD LYS 895 0.921 15.751 3.944 605 1HE LYS 895 1HE LYS 895 -0.815 14.854 5.590 606 2HE LYS 895 2HE LYS 895 0.516 14.684 6.752 607 1HZ LYS 895 1HZ LYS 895 0.028 17.188 5.243 608 2HZ LYS 895 2HZ LYS 895 -0.670 16.898 6.764 609 3HZ LYS 895 3HZ LYS 895 1.017 16.964 6.605 610 HA GLU 896 HA GLU 896 -0.805 10.348 2.127 611 1HB GLU 896 1HB GLU 896 -0.016 8.637 0.477 612 2HB GLU 896 2HB GLU 896 1.012 10.057 0.525 613 1HG GLU 896 1HG GLU 896 2.194 8.499 2.400 614 2HG GLU 896 2HG GLU 896 2.675 8.555 0.711 615 HA LEU 897 HA LEU 897 -1.211 6.053 3.851 616 1HB LEU 897 1HB LEU 897 1.072 5.080 3.729 617 2HB LEU 897 2HB LEU 897 1.472 5.870 5.257 618 HG LEU 897 HG LEU 897 0.561 3.335 5.165 619 1HD1 LEU 897 1HD1 LEU 897 0.474 5.521 7.134 620 2HD1 LEU 897 2HD1 LEU 897 -0.642 4.201 7.479 621 3HD1 LEU 897 3HD1 LEU 897 1.082 3.876 7.304 622 1HD2 LEU 897 1HD2 LEU 897 -1.615 4.365 4.099 623 2HD2 LEU 897 2HD2 LEU 897 -1.786 3.147 5.358 624 3HD2 LEU 897 3HD2 LEU 897 -1.987 4.847 5.752 625 HA LYS 898 HA LYS 898 -0.522 7.843 8.431 626 1HB LYS 898 1HB LYS 898 1.438 9.239 7.884 627 2HB LYS 898 2HB LYS 898 0.413 10.269 6.889 628 1HG LYS 898 1HG LYS 898 0.832 11.262 9.135 629 2HG LYS 898 2HG LYS 898 -0.879 10.950 8.843 630 1HD LYS 898 1HD LYS 898 -1.000 9.451 10.529 631 2HD LYS 898 2HD LYS 898 0.490 8.651 10.028 632 1HE LYS 898 1HE LYS 898 0.614 11.349 11.375 633 2HE LYS 898 2HE LYS 898 0.479 9.865 12.341 634 1HZ LYS 898 1HZ LYS 898 2.343 8.951 11.025 635 2HZ LYS 898 2HZ LYS 898 2.534 10.465 10.279 636 3HZ LYS 898 3HZ LYS 898 2.791 10.305 11.948 637 HA ALA 899 HA ALA 899 -3.901 10.573 6.652 638 1HB ALA 899 2HB ALA 899 -4.177 10.960 4.044 639 2HB ALA 899 3HB ALA 899 -2.927 11.844 4.920 640 3HB ALA 899 1HB ALA 899 -2.502 10.412 3.984 641 HA ARG 900 HA ARG 900 -3.958 5.889 4.011 642 1HB ARG 900 1HB ARG 900 -4.861 4.888 5.867 643 2HB ARG 900 2HB ARG 900 -4.488 6.392 6.701 644 1HG ARG 900 1HG ARG 900 -6.814 7.187 5.828 645 2HG ARG 900 2HG ARG 900 -7.122 5.474 5.561 646 1HD ARG 900 1HD ARG 900 -5.950 6.049 8.204 647 2HD ARG 900 2HD ARG 900 -7.554 6.765 7.955 648 HE ARG 900 HE ARG 900 -7.227 3.951 7.103 649 1HH1 ARG 900 1HH1 ARG 900 -9.632 5.858 8.008 650 2HH1 ARG 900 2HH1 ARG 900 -10.165 4.957 9.388 651 1HH2 ARG 900 1HH2 ARG 900 -7.343 2.945 9.497 652 2HH2 ARG 900 2HH2 ARG 900 -8.870 3.307 10.232 653 HA LYS 901 HA LYS 901 -7.438 8.193 2.361 654 1HB LYS 901 1HB LYS 901 -6.680 10.278 3.570 655 2HB LYS 901 2HB LYS 901 -5.713 10.666 2.147 656 1HG LYS 901 1HG LYS 901 -8.342 10.022 1.244 657 2HG LYS 901 2HG LYS 901 -8.502 11.157 2.584 658 1HD LYS 901 1HD LYS 901 -6.461 12.326 1.253 659 2HD LYS 901 2HD LYS 901 -7.291 11.556 -0.100 660 1HE LYS 901 1HE LYS 901 -9.450 12.595 1.049 661 2HE LYS 901 2HE LYS 901 -8.416 13.614 0.028 662 1HZ LYS 901 1HZ LYS 901 -7.172 14.249 2.009 663 2HZ LYS 901 2HZ LYS 901 -8.812 14.638 2.202 664 3HZ LYS 901 3HZ LYS 901 -8.168 13.271 2.978 665 HA ILE 902 HA ILE 902 -4.312 8.936 -1.418 666 HB ILE 902 HB ILE 902 -2.981 6.340 -0.776 667 1HG1 ILE 902 1HG1 ILE 902 -1.189 7.666 0.429 668 2HG1 ILE 902 2HG1 ILE 902 -2.667 7.425 1.342 669 1HG2 ILE 902 1HG2 ILE 902 -2.761 7.978 -2.857 670 2HG2 ILE 902 2HG2 ILE 902 -1.624 8.801 -1.788 671 3HG2 ILE 902 3HG2 ILE 902 -1.361 7.112 -2.225 672 1HD1 ILE 902 3HD1 ILE 902 -3.217 9.775 0.026 673 2HD1 ILE 902 1HD1 ILE 902 -2.574 9.680 1.661 674 3HD1 ILE 902 2HD1 ILE 902 -1.484 9.923 0.300 675 HA PRO 903 HA PRO 903 -7.397 5.870 -2.852 676 1HB PRO 903 1HB PRO 903 -7.886 7.634 -5.072 677 2HB PRO 903 2HB PRO 903 -8.932 7.356 -3.675 678 1HG PRO 903 1HG PRO 903 -7.570 9.747 -4.275 679 2HG PRO 903 2HG PRO 903 -8.354 9.350 -2.741 680 1HD PRO 903 1HD PRO 903 -6.253 9.484 -1.817 681 2HD PRO 903 2HD PRO 903 -5.465 9.382 -3.410 682 HA ILE 904 HA ILE 904 -5.092 4.786 -6.501 683 HB ILE 904 HB ILE 904 -3.404 5.223 -4.214 684 1HG1 ILE 904 1HG1 ILE 904 -2.436 5.388 -7.029 685 2HG1 ILE 904 2HG1 ILE 904 -3.813 6.392 -6.576 686 1HG2 ILE 904 1HG2 ILE 904 -2.435 3.203 -6.251 687 2HG2 ILE 904 2HG2 ILE 904 -1.416 4.008 -5.058 688 3HG2 ILE 904 3HG2 ILE 904 -2.686 2.905 -4.531 689 1HD1 ILE 904 2HD1 ILE 904 -2.229 6.891 -4.460 690 2HD1 ILE 904 3HD1 ILE 904 -0.984 6.537 -5.657 691 3HD1 ILE 904 1HD1 ILE 904 -2.138 7.838 -5.945 692 HA ILE 905 HA ILE 905 -5.206 0.381 -6.561 693 HB ILE 905 HB ILE 905 -6.310 1.265 -8.589 694 1HG1 ILE 905 1HG1 ILE 905 -4.726 -0.752 -9.954 695 2HG1 ILE 905 2HG1 ILE 905 -5.089 -1.246 -8.301 696 1HG2 ILE 905 1HG2 ILE 905 -3.457 1.467 -9.563 697 2HG2 ILE 905 2HG2 ILE 905 -4.817 1.387 -10.683 698 3HG2 ILE 905 3HG2 ILE 905 -4.696 2.721 -9.538 699 1HD1 ILE 905 1HD1 ILE 905 -7.208 -0.140 -10.143 700 2HD1 ILE 905 2HD1 ILE 905 -6.833 -1.860 -10.070 701 3HD1 ILE 905 3HD1 ILE 905 -7.434 -1.026 -8.635 702 HA ILE 906 HA ILE 906 -0.924 -0.666 -7.796 703 HB ILE 906 HB ILE 906 -1.947 -1.410 -5.108 704 1HG1 ILE 906 1HG1 ILE 906 0.346 0.096 -6.316 705 2HG1 ILE 906 2HG1 ILE 906 0.400 -0.358 -4.613 706 1HG2 ILE 906 1HG2 ILE 906 0.367 -2.838 -6.399 707 2HG2 ILE 906 2HG2 ILE 906 0.427 -2.459 -4.680 708 3HG2 ILE 906 3HG2 ILE 906 -0.867 -3.477 -5.311 709 1HD1 ILE 906 1HD1 ILE 906 -2.190 0.696 -5.120 710 2HD1 ILE 906 2HD1 ILE 906 -0.910 1.406 -4.137 711 3HD1 ILE 906 3HD1 ILE 906 -1.026 1.800 -5.852 712 HA ARG 907 HA ARG 907 -1.636 -4.786 -9.313 713 1HB ARG 907 1HB ARG 907 0.862 -3.659 -10.482 714 2HB ARG 907 2HB ARG 907 0.482 -5.350 -10.756 715 1HG ARG 907 1HG ARG 907 -0.384 -3.818 -12.514 716 2HG ARG 907 2HG ARG 907 -1.608 -4.815 -11.732 717 1HD ARG 907 1HD ARG 907 -2.600 -2.999 -10.654 718 2HD ARG 907 2HD ARG 907 -1.079 -2.085 -10.587 719 HE ARG 907 HE ARG 907 -1.323 -1.655 -13.019 720 1HH1 ARG 907 1HH1 ARG 907 -3.071 -3.524 -14.176 721 2HH1 ARG 907 2HH1 ARG 907 -4.646 -2.805 -14.103 722 1HH2 ARG 907 1HH2 ARG 907 -3.763 -0.480 -11.687 723 2HH2 ARG 907 2HH2 ARG 907 -5.036 -1.083 -12.694 724 HA ARG 908 HA ARG 908 1.018 -7.047 -6.595 725 1HB ARG 908 1HB ARG 908 -1.902 -7.827 -6.464 726 2HB ARG 908 2HB ARG 908 -0.717 -8.813 -5.620 727 1HG ARG 908 1HG ARG 908 0.024 -6.716 -4.412 728 2HG ARG 908 2HG ARG 908 -1.346 -5.883 -5.149 729 1HD ARG 908 1HD ARG 908 -2.473 -8.240 -4.081 730 2HD ARG 908 2HD ARG 908 -2.594 -6.629 -3.347 731 HE ARG 908 HE ARG 908 -0.037 -7.672 -2.682 732 1HH1 ARG 908 1HH1 ARG 908 -3.032 -7.205 -1.362 733 2HH1 ARG 908 2HH1 ARG 908 -2.949 -8.495 -0.210 734 1HH2 ARG 908 1HH2 ARG 908 -0.059 -9.862 -1.553 735 2HH2 ARG 908 2HH2 ARG 908 -1.264 -9.998 -0.316 736 HA TYR 909 HA TYR 909 0.886 -10.389 -9.601 737 1HB TYR 909 1HB TYR 909 3.310 -10.105 -10.939 738 2HB TYR 909 2HB TYR 909 1.736 -9.648 -11.536 739 HD1 TYR 909 HD1 TYR 909 1.276 -7.130 -9.741 740 HD2 TYR 909 HD2 TYR 909 4.653 -8.574 -11.969 741 HE1 TYR 909 HE1 TYR 909 2.145 -4.840 -9.964 742 HE2 TYR 909 HE2 TYR 909 5.481 -6.271 -12.207 743 HH TYR 909 HH TYR 909 5.073 -4.016 -10.573 744 HA LEU 910 HA LEU 910 4.108 -12.659 -7.577 745 1HB LEU 910 1HB LEU 910 2.126 -14.454 -8.966 746 2HB LEU 910 2HB LEU 910 3.087 -14.929 -7.563 747 HG LEU 910 HG LEU 910 0.968 -12.771 -7.729 748 1HD1 LEU 910 1HD1 LEU 910 1.180 -15.520 -6.625 749 2HD1 LEU 910 2HD1 LEU 910 0.279 -14.346 -5.669 750 3HD1 LEU 910 3HD1 LEU 910 -0.202 -14.692 -7.328 751 1HD2 LEU 910 1HD2 LEU 910 3.245 -13.054 -5.917 752 2HD2 LEU 910 2HD2 LEU 910 2.115 -11.713 -6.097 753 3HD2 LEU 910 3HD2 LEU 910 1.703 -13.077 -5.062 754 HA PRO 911 HA PRO 911 7.063 -13.758 -10.811 755 1HB PRO 911 1HB PRO 911 8.914 -14.281 -8.668 756 2HB PRO 911 2HB PRO 911 8.905 -12.898 -9.766 757 1HG PRO 911 1HG PRO 911 8.232 -12.932 -6.977 758 2HG PRO 911 2HG PRO 911 8.215 -11.553 -8.080 759 1HD PRO 911 1HD PRO 911 5.933 -11.555 -8.057 760 2HD PRO 911 2HD PRO 911 5.946 -12.951 -6.955 761 HA ASP 912 HA ASP 912 6.925 -17.933 -8.351 762 1HB ASP 912 1HB ASP 912 4.655 -16.607 -6.958 763 2HB ASP 912 2HB ASP 912 4.539 -18.358 -7.128 764 1HA GLY 913 1HA GLY 913 3.650 -17.518 -12.053 765 2HA GLY 913 2HA GLY 913 3.375 -18.978 -11.108 766 HA SER 914 HA SER 914 -0.407 -16.060 -11.315 767 1HB SER 914 1HB SER 914 0.570 -16.235 -8.472 768 2HB SER 914 2HB SER 914 -1.047 -15.637 -8.829 769 HG SER 914 HG SER 914 -0.423 -18.093 -8.553 770 HA TYR 915 HA TYR 915 -0.115 -11.790 -9.289 771 1HB TYR 915 1HB TYR 915 1.002 -11.360 -11.249 772 2HB TYR 915 2HB TYR 915 -0.003 -12.483 -12.148 773 HD1 TYR 915 HD1 TYR 915 0.016 -9.005 -10.745 774 HD2 TYR 915 HD2 TYR 915 -1.662 -11.714 -13.626 775 HE1 TYR 915 HE1 TYR 915 -1.164 -7.118 -11.831 776 HE2 TYR 915 HE2 TYR 915 -2.842 -9.824 -14.711 777 HH TYR 915 HH TYR 915 -2.375 -7.190 -14.828 778 HA GLU 916 HA GLU 916 -4.232 -9.947 -10.425 779 1HB GLU 916 1HB GLU 916 -3.653 -10.921 -7.881 780 2HB GLU 916 2HB GLU 916 -4.299 -9.303 -7.597 781 1HG GLU 916 1HG GLU 916 -5.716 -11.042 -9.568 782 2HG GLU 916 2HG GLU 916 -5.916 -11.404 -7.853 783 HA ASP 917 HA ASP 917 -3.372 -5.570 -9.849 784 1HB ASP 917 1HB ASP 917 -3.770 -6.013 -12.241 785 2HB ASP 917 2HB ASP 917 -4.379 -4.451 -11.756 786 HA TRP 918 HA TRP 918 -6.590 -2.669 -8.412 787 1HB TRP 918 1HB TRP 918 -7.962 -3.930 -6.786 788 2HB TRP 918 2HB TRP 918 -7.935 -4.670 -8.368 789 HD1 TRP 918 HD1 TRP 918 -4.764 -5.826 -7.209 790 HE1 TRP 918 HE1 TRP 918 -4.969 -8.154 -6.109 791 HE3 TRP 918 HE3 TRP 918 -9.676 -5.757 -6.188 792 HZ2 TRP 918 HZ2 TRP 918 -7.032 -9.714 -4.793 793 HZ3 TRP 918 HZ3 TRP 918 -10.768 -7.555 -4.945 794 HH2 TRP 918 HH2 TRP 918 -9.467 -9.576 -4.248 795 1HA GLY 919 1HA GLY 919 -4.804 -2.657 -4.168 796 2HA GLY 919 2HA GLY 919 -4.592 -1.094 -4.941 797 HA VAL 920 HA VAL 920 -7.771 0.003 -2.089 798 HB VAL 920 HB VAL 920 -6.710 2.524 -3.414 799 1HG1 VAL 920 1HG1 VAL 920 -8.269 2.025 -0.880 800 2HG1 VAL 920 2HG1 VAL 920 -7.211 3.428 -1.031 801 3HG1 VAL 920 3HG1 VAL 920 -8.570 3.225 -2.137 802 1HG2 VAL 920 1HG2 VAL 920 -5.721 0.692 -1.243 803 2HG2 VAL 920 2HG2 VAL 920 -4.830 1.416 -2.581 804 3HG2 VAL 920 3HG2 VAL 920 -5.295 2.403 -1.201 805 HA ASP 921 HA ASP 921 -10.675 1.734 -5.300 806 1HB ASP 921 1HB ASP 921 -8.948 1.826 -7.182 807 2HB ASP 921 2HB ASP 921 -9.451 0.188 -7.600 808 HA GLU 922 HA GLU 922 -12.334 -2.499 -5.206 809 1HB GLU 922 1HB GLU 922 -10.563 -2.963 -7.035 810 2HB GLU 922 2HB GLU 922 -9.794 -3.991 -5.827 811 1HG GLU 922 1HG GLU 922 -11.579 -5.505 -5.780 812 2HG GLU 922 2HG GLU 922 -12.736 -4.308 -6.362 813 HA LEU 923 HA LEU 923 -10.579 -3.732 -1.156 814 1HB LEU 923 1HB LEU 923 -8.244 -4.847 -1.007 815 2HB LEU 923 2HB LEU 923 -9.325 -5.371 -2.283 816 HG LEU 923 HG LEU 923 -7.832 -3.096 -3.204 817 1HD1 LEU 923 1HD1 LEU 923 -6.219 -5.415 -2.119 818 2HD1 LEU 923 2HD1 LEU 923 -5.619 -4.281 -3.331 819 3HD1 LEU 923 3HD1 LEU 923 -6.035 -3.712 -1.720 820 1HD2 LEU 923 1HD2 LEU 923 -9.031 -4.987 -4.336 821 2HD2 LEU 923 2HD2 LEU 923 -7.454 -4.537 -4.988 822 3HD2 LEU 923 3HD2 LEU 923 -7.609 -5.964 -3.963 823 HA ILE 924 HA ILE 924 -8.185 -1.339 1.680 824 HB ILE 924 HB ILE 924 -7.006 -4.036 1.842 825 1HG1 ILE 924 1HG1 ILE 924 -7.805 -3.550 4.250 826 2HG1 ILE 924 2HG1 ILE 924 -8.534 -2.114 3.534 827 1HG2 ILE 924 1HG2 ILE 924 -4.961 -2.727 2.200 828 2HG2 ILE 924 2HG2 ILE 924 -5.782 -1.804 3.458 829 3HG2 ILE 924 3HG2 ILE 924 -5.493 -3.528 3.672 830 1HD1 ILE 924 3HD1 ILE 924 -8.941 -4.941 2.545 831 2HD1 ILE 924 1HD1 ILE 924 -10.107 -4.016 3.488 832 3HD1 ILE 924 2HD1 ILE 924 -9.669 -3.490 1.863 833 HA ILE 925 HA ILE 925 -4.380 0.416 0.214 834 HB ILE 925 HB ILE 925 -3.940 2.330 1.760 835 1HG1 ILE 925 1HG1 ILE 925 -6.225 1.667 3.506 836 2HG1 ILE 925 2HG1 ILE 925 -4.836 0.601 3.715 837 1HG2 ILE 925 1HG2 ILE 925 -6.475 1.669 0.500 838 2HG2 ILE 925 2HG2 ILE 925 -6.714 2.738 1.883 839 3HG2 ILE 925 3HG2 ILE 925 -5.636 3.219 0.573 840 1HD1 ILE 925 2HD1 ILE 925 -3.516 2.921 3.665 841 2HD1 ILE 925 3HD1 ILE 925 -5.070 3.534 4.231 842 3HD1 ILE 925 1HD1 ILE 925 -4.221 2.296 5.156 843 HA THR 926 HA THR 926 -0.863 -0.847 2.775 844 HB THR 926 HB THR 926 -1.231 1.666 3.918 845 HG1 THR 926 HG1 THR 926 0.964 1.245 4.688 846 1HG2 THR 926 1HG2 THR 926 -0.834 -0.367 6.131 847 2HG2 THR 926 2HG2 THR 926 -0.607 1.372 6.302 848 3HG2 THR 926 3HG2 THR 926 -2.208 0.726 5.949 849 HA ASP 927 HA ASP 927 -4.007 -3.063 5.514 850 1HB ASP 927 1HB ASP 927 -1.879 -2.626 6.740 851 2HB ASP 927 2HB ASP 927 -2.680 -1.343 7.647 No H/Q in entry = 851 Start of MODEL 4 1 H1 MET 801 H1 MET 801 37.752 25.173 4.325 2 H2 MET 801 H2 MET 801 37.725 26.060 5.770 3 H3 MET 801 H3 MET 801 38.955 26.334 4.629 4 HA MET 801 HA MET 801 39.944 24.222 5.040 5 1HB MET 801 1HB MET 801 39.967 26.322 6.677 6 2HB MET 801 2HB MET 801 39.180 25.187 7.773 7 1HG MET 801 1HG MET 801 41.240 24.413 8.279 8 2HG MET 801 2HG MET 801 41.276 23.709 6.663 9 1HE MET 801 3HE MET 801 42.780 25.626 9.140 10 2HE MET 801 1HE MET 801 43.808 26.876 8.444 11 3HE MET 801 2HE MET 801 42.084 27.174 8.644 12 HA SER 802 HA SER 802 36.407 21.753 6.738 13 1HB SER 802 1HB SER 802 35.653 21.574 3.810 14 2HB SER 802 2HB SER 802 34.651 21.158 5.197 15 HG SER 802 HG SER 802 34.862 23.412 5.810 16 HA ASP 803 HA ASP 803 38.880 18.342 4.999 17 1HB ASP 803 1HB ASP 803 40.666 19.626 7.078 18 2HB ASP 803 2HB ASP 803 41.120 18.161 6.208 19 HA ASN 804 HA ASN 804 37.500 16.101 8.740 20 1HB ASN 804 1HB ASN 804 35.504 16.241 6.899 21 2HB ASN 804 2HB ASN 804 35.850 14.512 6.848 22 2HD2 ASN 804 1HD2 ASN 804 34.236 16.966 8.640 23 1HD2 ASN 804 2HD2 ASN 804 33.860 16.034 10.008 24 HA GLU 805 HA GLU 805 39.582 12.257 7.847 25 1HB GLU 805 1HB GLU 805 38.316 12.151 10.179 26 2HB GLU 805 2HB GLU 805 37.499 10.783 9.423 27 1HG GLU 805 1HG GLU 805 40.466 10.901 9.163 28 2HG GLU 805 2HG GLU 805 39.813 10.494 10.750 29 HA ASP 806 HA ASP 806 37.368 10.118 4.615 30 1HB ASP 806 1HB ASP 806 40.159 10.359 4.282 31 2HB ASP 806 2HB ASP 806 39.796 8.666 3.947 32 HA ASN 807 HA ASN 807 37.072 6.415 7.340 33 1HB ASN 807 1HB ASN 807 34.421 7.417 6.322 34 2HB ASN 807 2HB ASN 807 34.536 5.844 7.111 35 2HD2 ASN 807 1HD2 ASN 807 34.507 5.852 9.375 36 1HD2 ASN 807 2HD2 ASN 807 34.727 7.233 10.335 37 HA PHE 808 HA PHE 808 36.790 3.727 3.715 38 1HB PHE 808 1HB PHE 808 37.332 6.229 2.496 39 2HB PHE 808 2HB PHE 808 38.395 5.062 1.710 40 HD1 PHE 808 HD1 PHE 808 37.116 2.648 1.365 41 HD2 PHE 808 HD2 PHE 808 35.273 6.526 1.462 42 HE1 PHE 808 HE1 PHE 808 35.194 1.767 0.069 43 HE2 PHE 808 HE2 PHE 808 33.351 5.646 0.166 44 HZ PHE 808 HZ PHE 808 33.312 3.266 -0.530 45 HA ASP 809 HA ASP 809 40.755 1.824 4.359 46 1HB ASP 809 1HB ASP 809 42.803 3.229 4.542 47 2HB ASP 809 2HB ASP 809 41.633 3.906 3.410 48 1HA GLY 810 1HA GLY 810 41.319 1.456 8.768 49 2HA GLY 810 2HA GLY 810 39.685 2.013 9.133 50 HA ASP 811 HA ASP 811 38.869 -2.332 9.494 51 1HB ASP 811 1HB ASP 811 37.318 -0.694 10.977 52 2HB ASP 811 2HB ASP 811 36.068 -1.443 9.982 53 HA ASP 812 HA ASP 812 36.344 -2.698 5.671 54 1HB ASP 812 1HB ASP 812 37.569 -0.763 4.759 55 2HB ASP 812 2HB ASP 812 37.469 -2.050 3.558 56 HA PHE 813 HA PHE 813 38.166 -6.716 4.993 57 1HB PHE 813 1HB PHE 813 40.318 -5.380 5.877 58 2HB PHE 813 2HB PHE 813 40.248 -6.615 7.134 59 HD1 PHE 813 HD1 PHE 813 39.807 -6.416 3.405 60 HD2 PHE 813 HD2 PHE 813 41.485 -8.542 6.739 61 HE1 PHE 813 HE1 PHE 813 40.819 -8.061 1.848 62 HE2 PHE 813 HE2 PHE 813 42.495 -10.186 5.183 63 HZ PHE 813 HZ PHE 813 42.163 -9.946 2.737 64 HA ASP 814 HA ASP 814 36.585 -8.895 8.614 65 1HB ASP 814 1HB ASP 814 36.838 -6.451 9.768 66 2HB ASP 814 2HB ASP 814 35.101 -6.695 9.956 67 HA ASP 815 HA ASP 815 32.239 -8.606 7.172 68 1HB ASP 815 1HB ASP 815 33.567 -7.253 4.898 69 2HB ASP 815 2HB ASP 815 32.063 -8.081 4.495 70 HA VAL 816 HA VAL 816 32.953 -12.228 4.327 71 HB VAL 816 HB VAL 816 35.792 -11.483 3.537 72 1HG1 VAL 816 1HG1 VAL 816 33.892 -13.650 2.728 73 2HG1 VAL 816 2HG1 VAL 816 34.917 -12.936 1.483 74 3HG1 VAL 816 3HG1 VAL 816 35.647 -13.703 2.894 75 1HG2 VAL 816 1HG2 VAL 816 33.077 -10.852 2.365 76 2HG2 VAL 816 2HG2 VAL 816 34.377 -9.732 2.770 77 3HG2 VAL 816 3HG2 VAL 816 34.541 -10.810 1.383 78 HA GLU 817 HA GLU 817 35.391 -14.588 7.274 79 1HB GLU 817 1HB GLU 817 35.860 -11.882 8.329 80 2HB GLU 817 2HB GLU 817 35.994 -13.143 9.555 81 1HG GLU 817 1HG GLU 817 37.828 -14.107 8.565 82 2HG GLU 817 2HG GLU 817 37.304 -13.679 6.936 83 HA GLU 818 HA GLU 818 31.687 -15.439 9.708 84 1HB GLU 818 1HB GLU 818 30.918 -13.732 11.388 85 2HB GLU 818 2HB GLU 818 32.668 -13.755 11.172 86 1HG GLU 818 1HG GLU 818 31.193 -11.935 9.358 87 2HG GLU 818 2HG GLU 818 31.168 -11.485 11.062 88 HA ASP 819 HA ASP 819 27.862 -14.060 7.812 89 1HB ASP 819 1HB ASP 819 28.144 -16.973 8.333 90 2HB ASP 819 2HB ASP 819 26.516 -16.413 7.950 91 HA GLU 820 HA GLU 820 24.580 -13.769 10.814 92 1HB GLU 820 1HB GLU 820 26.761 -13.926 12.137 93 2HB GLU 820 2HB GLU 820 26.776 -12.162 12.146 94 1HG GLU 820 1HG GLU 820 24.683 -12.073 13.332 95 2HG GLU 820 2HG GLU 820 24.435 -13.808 13.134 96 1HA GLY 821 1HA GLY 821 22.450 -10.135 9.413 97 2HA GLY 821 2HA GLY 821 24.020 -9.367 9.648 98 HA LEU 822 HA LEU 822 23.137 -9.915 5.021 99 1HB LEU 822 1HB LEU 822 20.712 -10.319 5.303 100 2HB LEU 822 2HB LEU 822 20.463 -8.597 5.592 101 HG LEU 822 HG LEU 822 21.532 -8.186 3.316 102 1HD1 LEU 822 1HD1 LEU 822 21.041 -11.171 3.082 103 2HD1 LEU 822 2HD1 LEU 822 21.516 -10.106 1.759 104 3HD1 LEU 822 3HD1 LEU 822 22.622 -10.388 3.104 105 1HD2 LEU 822 1HD2 LEU 822 18.961 -8.496 3.989 106 2HD2 LEU 822 2HD2 LEU 822 19.449 -8.258 2.312 107 3HD2 LEU 822 3HD2 LEU 822 19.103 -9.881 2.907 108 HA ASP 823 HA ASP 823 23.805 -5.329 5.416 109 1HB ASP 823 1HB ASP 823 22.764 -5.564 3.255 110 2HB ASP 823 2HB ASP 823 21.166 -5.238 3.922 111 HA ASP 824 HA ASP 824 20.953 -3.730 8.786 112 1HB ASP 824 1HB ASP 824 21.034 -2.220 6.673 113 2HB ASP 824 2HB ASP 824 19.281 -2.417 6.641 114 HA LEU 825 HA LEU 825 17.168 -5.967 9.663 115 1HB LEU 825 1HB LEU 825 16.875 -4.957 6.952 116 2HB LEU 825 2HB LEU 825 15.738 -6.272 7.253 117 HG LEU 825 HG LEU 825 16.025 -4.252 9.418 118 1HD1 LEU 825 1HD1 LEU 825 15.927 -3.115 7.030 119 2HD1 LEU 825 2HD1 LEU 825 14.226 -3.574 7.116 120 3HD1 LEU 825 3HD1 LEU 825 14.916 -2.513 8.344 121 1HD2 LEU 825 1HD2 LEU 825 14.469 -6.232 9.454 122 2HD2 LEU 825 2HD2 LEU 825 13.648 -4.684 9.653 123 3HD2 LEU 825 3HD2 LEU 825 13.603 -5.513 8.097 124 HA GLU 826 HA GLU 826 17.993 -9.787 5.905 125 1HB GLU 826 1HB GLU 826 19.732 -9.612 7.724 126 2HB GLU 826 2HB GLU 826 18.507 -10.142 8.874 127 1HG GLU 826 1HG GLU 826 18.626 -12.302 8.181 128 2HG GLU 826 2HG GLU 826 18.698 -11.845 6.479 129 HA ASN 827 HA ASN 827 14.496 -12.131 7.672 130 1HB ASN 827 1HB ASN 827 15.832 -12.355 10.385 131 2HB ASN 827 2HB ASN 827 14.316 -13.164 9.988 132 2HD2 ASN 827 1HD2 ASN 827 15.926 -15.098 10.509 133 1HD2 ASN 827 2HD2 ASN 827 16.747 -15.744 9.171 134 HA ALA 828 HA ALA 828 13.050 -8.154 9.696 135 1HB ALA 828 3HB ALA 828 12.037 -6.754 8.051 136 2HB ALA 828 1HB ALA 828 13.390 -7.516 7.216 137 3HB ALA 828 2HB ALA 828 11.749 -8.113 6.964 138 HA GLU 829 HA GLU 829 8.856 -9.522 10.429 139 1HB GLU 829 1HB GLU 829 6.856 -8.367 9.511 140 2HB GLU 829 2HB GLU 829 8.129 -7.222 9.927 141 1HG GLU 829 1HG GLU 829 8.757 -7.846 7.318 142 2HG GLU 829 2HG GLU 829 6.993 -7.883 7.294 143 HA GLU 830 HA GLU 830 9.501 -13.445 7.946 144 1HB GLU 830 1HB GLU 830 7.096 -12.492 8.866 145 2HB GLU 830 2HB GLU 830 6.802 -12.566 7.128 146 1HG GLU 830 1HG GLU 830 7.427 -14.902 7.056 147 2HG GLU 830 2HG GLU 830 7.949 -14.861 8.741 148 HA GLU 831 HA GLU 831 10.370 -9.735 4.437 149 1HB GLU 831 1HB GLU 831 10.754 -12.712 4.396 150 2HB GLU 831 2HB GLU 831 10.850 -11.820 2.878 151 1HG GLU 831 1HG GLU 831 12.553 -10.322 3.880 152 2HG GLU 831 2HG GLU 831 12.483 -11.262 5.371 153 1HA GLY 832 1HA GLY 832 6.729 -11.342 2.068 154 2HA GLY 832 2HA GLY 832 7.110 -9.754 1.398 155 HA GLN 833 HA GLN 833 7.996 -11.556 -2.491 156 1HB GLN 833 1HB GLN 833 8.202 -13.619 -1.139 157 2HB GLN 833 2HB GLN 833 6.477 -13.926 -1.354 158 1HG GLN 833 1HG GLN 833 6.760 -14.101 -3.763 159 2HG GLN 833 2HG GLN 833 8.462 -13.660 -3.626 160 2HE2 GLN 833 1HE2 GLN 833 6.336 -16.039 -1.916 161 1HE2 GLN 833 2HE2 GLN 833 7.406 -17.344 -2.101 162 HA GLU 834 HA GLU 834 4.425 -11.266 -5.069 163 1HB GLU 834 1HB GLU 834 3.456 -10.697 -2.770 164 2HB GLU 834 2HB GLU 834 3.757 -9.002 -3.158 165 1HG GLU 834 1HG GLU 834 2.033 -8.900 -4.643 166 2HG GLU 834 2HG GLU 834 2.340 -10.524 -5.260 167 HA ASN 835 HA ASN 835 6.476 -7.893 -7.241 168 1HB ASN 835 1HB ASN 835 6.331 -8.201 -9.581 169 2HB ASN 835 2HB ASN 835 4.763 -8.985 -9.481 170 2HD2 ASN 835 1HD2 ASN 835 5.323 -11.020 -10.444 171 1HD2 ASN 835 2HD2 ASN 835 6.499 -12.063 -9.806 172 HA VAL 836 HA VAL 836 2.664 -5.702 -7.546 173 HB VAL 836 HB VAL 836 2.129 -5.213 -5.434 174 1HG1 VAL 836 1HG1 VAL 836 5.070 -5.619 -4.891 175 2HG1 VAL 836 2HG1 VAL 836 3.798 -5.611 -3.672 176 3HG1 VAL 836 3HG1 VAL 836 3.822 -6.863 -4.906 177 1HG2 VAL 836 1HG2 VAL 836 4.368 -3.185 -5.578 178 2HG2 VAL 836 2HG2 VAL 836 2.642 -2.886 -5.742 179 3HG2 VAL 836 3HG2 VAL 836 3.312 -3.360 -4.182 180 HA GLU 837 HA GLU 837 4.316 -2.144 -9.551 181 1HB GLU 837 1HB GLU 837 2.478 -3.756 -11.011 182 2HB GLU 837 2HB GLU 837 1.971 -2.085 -11.227 183 1HG GLU 837 1HG GLU 837 4.808 -3.073 -11.638 184 2HG GLU 837 2HG GLU 837 3.641 -2.840 -12.940 185 HA ILE 838 HA ILE 838 0.947 0.504 -8.183 186 HB ILE 838 HB ILE 838 3.673 1.818 -8.204 187 1HG1 ILE 838 1HG1 ILE 838 2.500 -0.315 -6.717 188 2HG1 ILE 838 2HG1 ILE 838 4.097 0.389 -6.522 189 1HG2 ILE 838 1HG2 ILE 838 1.197 2.703 -6.712 190 2HG2 ILE 838 2HG2 ILE 838 2.825 3.299 -6.399 191 3HG2 ILE 838 3HG2 ILE 838 2.058 3.607 -7.956 192 1HD1 ILE 838 1HD1 ILE 838 1.577 1.490 -5.249 193 2HD1 ILE 838 2HD1 ILE 838 2.744 0.458 -4.424 194 3HD1 ILE 838 3HD1 ILE 838 3.223 2.054 -4.994 195 HA LEU 839 HA LEU 839 0.335 4.215 -10.735 196 1HB LEU 839 1HB LEU 839 -0.685 1.645 -11.527 197 2HB LEU 839 2HB LEU 839 -1.918 2.859 -11.862 198 HG LEU 839 HG LEU 839 0.350 4.137 -12.731 199 1HD1 LEU 839 1HD1 LEU 839 0.853 1.236 -12.712 200 2HD1 LEU 839 2HD1 LEU 839 1.092 1.985 -14.289 201 3HD1 LEU 839 3HD1 LEU 839 1.989 2.573 -12.890 202 1HD2 LEU 839 3HD2 LEU 839 -1.447 2.273 -14.319 203 2HD2 LEU 839 1HD2 LEU 839 -1.808 3.952 -13.920 204 3HD2 LEU 839 2HD2 LEU 839 -0.465 3.570 -14.997 205 HA PRO 840 HA PRO 840 -2.936 6.413 -8.763 206 1HB PRO 840 1HB PRO 840 -3.191 8.163 -10.178 207 2HB PRO 840 2HB PRO 840 -4.289 7.202 -11.173 208 1HG PRO 840 1HG PRO 840 -1.627 8.030 -11.812 209 2HG PRO 840 2HG PRO 840 -2.689 6.998 -12.772 210 1HD PRO 840 1HD PRO 840 -1.307 5.237 -12.328 211 2HD PRO 840 2HD PRO 840 -0.328 6.243 -11.231 212 HA SER 841 HA SER 841 -6.163 3.407 -8.098 213 1HB SER 841 1HB SER 841 -7.979 4.492 -7.213 214 2HB SER 841 2HB SER 841 -6.914 5.890 -7.287 215 HG SER 841 HG SER 841 -8.662 6.552 -8.373 216 1HA GLY 842 1HA GLY 842 -7.411 3.038 -12.305 217 2HA GLY 842 2HA GLY 842 -7.396 1.358 -11.777 218 HA GLU 843 HA GLU 843 -11.819 1.506 -10.477 219 1HB GLU 843 1HB GLU 843 -11.006 1.885 -13.270 220 2HB GLU 843 2HB GLU 843 -12.519 0.990 -13.142 221 1HG GLU 843 1HG GLU 843 -12.154 3.436 -11.450 222 2HG GLU 843 2HG GLU 843 -12.535 3.636 -13.161 223 HA ARG 844 HA ARG 844 -11.669 -2.980 -10.202 224 1HB ARG 844 1HB ARG 844 -12.569 -3.016 -8.130 225 2HB ARG 844 2HB ARG 844 -13.610 -1.646 -8.483 226 1HG ARG 844 1HG ARG 844 -15.163 -3.174 -9.700 227 2HG ARG 844 2HG ARG 844 -14.974 -3.622 -8.007 228 1HD ARG 844 1HD ARG 844 -12.967 -4.916 -9.698 229 2HD ARG 844 2HD ARG 844 -14.624 -5.334 -10.177 230 HE ARG 844 HE ARG 844 -14.093 -5.371 -7.273 231 1HH1 ARG 844 1HH1 ARG 844 -12.792 -7.329 -9.549 232 2HH1 ARG 844 2HH1 ARG 844 -13.659 -8.765 -9.121 233 1HH2 ARG 844 1HH2 ARG 844 -15.864 -7.124 -7.008 234 2HH2 ARG 844 2HH2 ARG 844 -15.399 -8.650 -7.682 235 HA PRO 845 HA PRO 845 -15.808 -3.404 -12.668 236 1HB PRO 845 1HB PRO 845 -16.571 -0.738 -13.443 237 2HB PRO 845 2HB PRO 845 -17.450 -1.859 -12.400 238 1HG PRO 845 1HG PRO 845 -16.115 0.541 -11.624 239 2HG PRO 845 2HG PRO 845 -16.910 -0.634 -10.573 240 1HD PRO 845 1HD PRO 845 -14.857 -1.245 -9.763 241 2HD PRO 845 2HD PRO 845 -14.048 -0.175 -10.928 242 HA GLN 846 HA GLN 846 -13.669 -2.836 -16.500 243 1HB GLN 846 1HB GLN 846 -12.917 -0.754 -15.410 244 2HB GLN 846 2HB GLN 846 -11.521 -1.608 -14.751 245 1HG GLN 846 1HG GLN 846 -10.412 -1.606 -16.745 246 2HG GLN 846 2HG GLN 846 -11.887 -1.856 -17.680 247 2HE2 GLN 846 1HE2 GLN 846 -12.921 -0.004 -18.561 248 1HE2 GLN 846 2HE2 GLN 846 -12.363 1.582 -18.323 249 HA ALA 847 HA ALA 847 -9.868 -5.550 -15.908 250 1HB ALA 847 2HB ALA 847 -9.912 -5.823 -12.902 251 2HB ALA 847 1HB ALA 847 -9.217 -4.399 -13.677 252 3HB ALA 847 3HB ALA 847 -8.538 -5.995 -13.997 253 HA ASN 848 HA ASN 848 -13.435 -8.285 -12.910 254 1HB ASN 848 1HB ASN 848 -13.256 -7.842 -15.826 255 2HB ASN 848 2HB ASN 848 -13.723 -9.478 -15.361 256 2HD2 ASN 848 1HD2 ASN 848 -14.615 -6.036 -14.883 257 1HD2 ASN 848 2HD2 ASN 848 -16.238 -6.349 -14.498 258 HA GLN 849 HA GLN 849 -10.010 -11.292 -13.768 259 1HB GLN 849 1HB GLN 849 -7.588 -10.712 -13.505 260 2HB GLN 849 2HB GLN 849 -8.413 -9.667 -14.660 261 1HG GLN 849 1HG GLN 849 -7.989 -7.835 -13.422 262 2HG GLN 849 2HG GLN 849 -8.615 -8.602 -11.964 263 2HE2 GLN 849 1HE2 GLN 849 -5.719 -7.649 -13.609 264 1HE2 GLN 849 2HE2 GLN 849 -4.623 -8.300 -12.490 265 HA LYS 850 HA LYS 850 -8.181 -11.366 -9.240 266 1HB LYS 850 1HB LYS 850 -9.711 -13.229 -8.530 267 2HB LYS 850 2HB LYS 850 -10.547 -11.995 -9.464 268 1HG LYS 850 1HG LYS 850 -9.841 -13.574 -11.499 269 2HG LYS 850 2HG LYS 850 -11.303 -13.883 -10.563 270 1HD LYS 850 1HD LYS 850 -8.665 -15.308 -10.497 271 2HD LYS 850 2HD LYS 850 -9.635 -15.253 -9.025 272 1HE LYS 850 1HE LYS 850 -10.912 -16.054 -11.639 273 2HE LYS 850 2HE LYS 850 -10.027 -17.245 -10.665 274 1HZ LYS 850 1HZ LYS 850 -12.124 -15.442 -9.583 275 2HZ LYS 850 2HZ LYS 850 -12.415 -17.046 -10.061 276 3HZ LYS 850 3HZ LYS 850 -11.360 -16.720 -8.771 277 HA ARG 851 HA ARG 851 -6.124 -15.471 -9.170 278 1HB ARG 851 1HB ARG 851 -4.841 -13.496 -10.191 279 2HB ARG 851 2HB ARG 851 -4.083 -13.320 -8.608 280 1HG ARG 851 1HG ARG 851 -2.595 -14.870 -9.308 281 2HG ARG 851 2HG ARG 851 -3.891 -16.044 -9.090 282 1HD ARG 851 1HD ARG 851 -2.938 -16.226 -11.369 283 2HD ARG 851 2HD ARG 851 -3.340 -14.522 -11.666 284 HE ARG 851 HE ARG 851 -5.756 -15.254 -11.114 285 1HH1 ARG 851 1HH1 ARG 851 -4.086 -18.056 -10.979 286 2HH1 ARG 851 2HH1 ARG 851 -4.881 -18.852 -12.296 287 1HH2 ARG 851 1HH2 ARG 851 -6.479 -15.984 -13.411 288 2HH2 ARG 851 2HH2 ARG 851 -6.235 -17.678 -13.673 289 HA ILE 852 HA ILE 852 -5.307 -15.168 -4.634 290 HB ILE 852 HB ILE 852 -3.199 -15.980 -4.265 291 1HG1 ILE 852 1HG1 ILE 852 -2.283 -13.766 -3.625 292 2HG1 ILE 852 2HG1 ILE 852 -1.123 -14.705 -4.554 293 1HG2 ILE 852 1HG2 ILE 852 -3.627 -16.477 -6.641 294 2HG2 ILE 852 2HG2 ILE 852 -2.818 -14.979 -7.099 295 3HG2 ILE 852 3HG2 ILE 852 -1.904 -16.275 -6.327 296 1HD1 ILE 852 1HD1 ILE 852 -2.607 -13.283 -6.475 297 2HD1 ILE 852 2HD1 ILE 852 -2.301 -12.128 -5.179 298 3HD1 ILE 852 3HD1 ILE 852 -0.956 -12.947 -5.960 299 HA THR 853 HA THR 853 -3.406 -10.819 -3.275 300 HB THR 853 HB THR 853 -4.425 -8.783 -4.357 301 HG1 THR 853 HG1 THR 853 -5.340 -10.771 -6.163 302 1HG2 THR 853 1HG2 THR 853 -2.208 -9.837 -4.949 303 2HG2 THR 853 2HG2 THR 853 -3.029 -10.635 -6.285 304 3HG2 THR 853 3HG2 THR 853 -2.940 -8.874 -6.232 305 HA THR 854 HA THR 854 -7.020 -11.733 -0.843 306 HB THR 854 HB THR 854 -5.140 -11.894 0.751 307 HG1 THR 854 HG1 THR 854 -6.804 -11.795 2.025 308 1HG2 THR 854 1HG2 THR 854 -4.506 -9.356 -0.131 309 2HG2 THR 854 2HG2 THR 854 -5.152 -9.050 1.482 310 3HG2 THR 854 3HG2 THR 854 -3.790 -10.152 1.271 311 HA PRO 855 HA PRO 855 -9.026 -7.936 -2.139 312 1HB PRO 855 1HB PRO 855 -11.174 -8.703 -2.037 313 2HB PRO 855 2HB PRO 855 -11.168 -8.493 -0.284 314 1HG PRO 855 1HG PRO 855 -11.174 -10.951 -1.724 315 2HG PRO 855 2HG PRO 855 -11.004 -10.742 0.022 316 1HD PRO 855 1HD PRO 855 -8.858 -11.528 -0.181 317 2HD PRO 855 2HD PRO 855 -8.943 -11.453 -1.960 318 HA TYR 856 HA TYR 856 -7.780 -5.152 1.068 319 1HB TYR 856 1HB TYR 856 -8.384 -7.068 2.460 320 2HB TYR 856 2HB TYR 856 -6.829 -7.816 2.152 321 HD1 TYR 856 HD1 TYR 856 -4.714 -6.394 2.888 322 HD2 TYR 856 HD2 TYR 856 -8.699 -5.766 4.357 323 HE1 TYR 856 HE1 TYR 856 -3.799 -5.264 4.881 324 HE2 TYR 856 HE2 TYR 856 -7.784 -4.632 6.352 325 HH TYR 856 HH TYR 856 -5.466 -4.768 7.638 326 HA MET 857 HA MET 857 -3.760 -4.910 -1.037 327 1HB MET 857 1HB MET 857 -4.762 -2.649 -1.283 328 2HB MET 857 2HB MET 857 -4.316 -2.292 0.378 329 1HG MET 857 1HG MET 857 -1.951 -3.210 -0.857 330 2HG MET 857 2HG MET 857 -2.318 -1.563 -0.367 331 1HE MET 857 1HE MET 857 -4.547 -0.596 -1.913 332 2HE MET 857 2HE MET 857 -3.052 0.329 -1.893 333 3HE MET 857 3HE MET 857 -3.893 0.057 -3.418 334 HA THR 858 HA THR 858 -1.494 -5.042 2.843 335 HB THR 858 HB THR 858 0.217 -6.809 2.444 336 HG1 THR 858 HG1 THR 858 0.945 -7.069 0.496 337 1HG2 THR 858 1HG2 THR 858 -2.245 -7.208 2.700 338 2HG2 THR 858 2HG2 THR 858 -2.387 -7.177 0.943 339 3HG2 THR 858 3HG2 THR 858 -1.436 -8.437 1.727 340 HA LYS 859 HA LYS 859 1.221 -1.782 3.687 341 1HB LYS 859 1HB LYS 859 1.533 -3.319 5.580 342 2HB LYS 859 2HB LYS 859 3.071 -2.596 5.107 343 1HG LYS 859 1HG LYS 859 2.301 -5.171 3.804 344 2HG LYS 859 2HG LYS 859 3.897 -4.582 4.270 345 1HD LYS 859 1HD LYS 859 3.556 -5.138 6.554 346 2HD LYS 859 2HD LYS 859 1.818 -5.336 6.327 347 1HE LYS 859 1HE LYS 859 2.040 -7.451 5.429 348 2HE LYS 859 2HE LYS 859 3.611 -7.081 4.688 349 1HZ LYS 859 1HZ LYS 859 3.161 -7.262 7.619 350 2HZ LYS 859 2HZ LYS 859 3.768 -8.540 6.679 351 3HZ LYS 859 3HZ LYS 859 4.651 -7.099 6.818 352 HA TYR 860 HA TYR 860 5.004 -3.130 1.071 353 1HB TYR 860 1HB TYR 860 4.901 -5.534 0.889 354 2HB TYR 860 2HB TYR 860 3.544 -5.453 -0.228 355 HD1 TYR 860 HD1 TYR 860 3.927 -4.004 -2.398 356 HD2 TYR 860 HD2 TYR 860 7.115 -5.570 0.019 357 HE1 TYR 860 HE1 TYR 860 5.509 -3.640 -4.251 358 HE2 TYR 860 HE2 TYR 860 8.688 -5.208 -1.858 359 HH TYR 860 HH TYR 860 8.017 -4.955 -4.808 360 HA GLU 861 HA GLU 861 2.288 -2.330 -2.930 361 1HB GLU 861 1HB GLU 861 -0.156 -2.498 -1.124 362 2HB GLU 861 2HB GLU 861 -0.180 -2.055 -2.833 363 1HG GLU 861 1HG GLU 861 0.888 -4.275 -3.358 364 2HG GLU 861 2HG GLU 861 0.690 -4.716 -1.665 365 HA ARG 862 HA ARG 862 1.296 1.542 -0.159 366 1HB ARG 862 1HB ARG 862 0.347 0.724 1.853 367 2HB ARG 862 2HB ARG 862 1.755 -0.269 2.211 368 1HG ARG 862 1HG ARG 862 2.297 2.634 1.982 369 2HG ARG 862 2HG ARG 862 1.307 2.170 3.359 370 1HD ARG 862 1HD ARG 862 3.048 1.150 4.417 371 2HD ARG 862 2HD ARG 862 3.645 0.419 2.915 372 HE ARG 862 HE ARG 862 4.464 2.788 2.342 373 1HH1 ARG 862 1HH1 ARG 862 3.993 4.674 4.198 374 2HH1 ARG 862 2HH1 ARG 862 5.118 4.456 5.497 375 1HH2 ARG 862 1HH2 ARG 862 5.920 1.202 4.608 376 2HH2 ARG 862 2HH2 ARG 862 6.209 2.490 5.729 377 HA ALA 863 HA ALA 863 5.891 1.281 1.279 378 1HB ALA 863 2HB ALA 863 6.380 -1.580 0.478 379 2HB ALA 863 3HB ALA 863 7.277 -0.594 1.632 380 3HB ALA 863 1HB ALA 863 5.676 -1.205 2.050 381 HA ARG 864 HA ARG 864 6.860 0.528 -3.238 382 1HB ARG 864 1HB ARG 864 4.653 -1.304 -3.326 383 2HB ARG 864 2HB ARG 864 4.497 -0.215 -4.702 384 1HG ARG 864 1HG ARG 864 5.882 -2.152 -5.307 385 2HG ARG 864 2HG ARG 864 6.977 -1.797 -3.974 386 1HD ARG 864 1HD ARG 864 6.583 0.566 -5.629 387 2HD ARG 864 2HD ARG 864 8.093 -0.288 -5.257 388 HE ARG 864 HE ARG 864 6.808 -1.965 -7.055 389 1HH1 ARG 864 1HH1 ARG 864 9.243 0.067 -7.354 390 2HH1 ARG 864 2HH1 ARG 864 8.832 0.742 -8.896 391 1HH2 ARG 864 1HH2 ARG 864 5.613 -0.546 -8.899 392 2HH2 ARG 864 2HH2 ARG 864 6.777 0.395 -9.770 393 HA VAL 865 HA VAL 865 2.902 3.502 -3.990 394 HB VAL 865 HB VAL 865 2.426 2.209 -1.403 395 1HG1 VAL 865 1HG1 VAL 865 1.887 5.109 -1.736 396 2HG1 VAL 865 2HG1 VAL 865 0.769 4.102 -0.814 397 3HG1 VAL 865 3HG1 VAL 865 2.457 4.225 -0.319 398 1HG2 VAL 865 1HG2 VAL 865 0.706 3.317 -3.565 399 2HG2 VAL 865 2HG2 VAL 865 1.148 1.632 -3.289 400 3HG2 VAL 865 3HG2 VAL 865 0.095 2.466 -2.148 401 HA LEU 866 HA LEU 866 4.898 6.260 -0.515 402 1HB LEU 866 1HB LEU 866 5.197 5.165 1.492 403 2HB LEU 866 2HB LEU 866 5.581 3.645 0.694 404 HG LEU 866 HG LEU 866 7.616 5.849 0.611 405 1HD1 LEU 866 1HD1 LEU 866 6.725 4.338 3.027 406 2HD1 LEU 866 2HD1 LEU 866 8.459 4.559 2.796 407 3HD1 LEU 866 3HD1 LEU 866 7.399 5.963 2.904 408 1HD2 LEU 866 1HD2 LEU 866 7.482 3.189 -0.226 409 2HD2 LEU 866 2HD2 LEU 866 8.943 4.165 -0.103 410 3HD2 LEU 866 3HD2 LEU 866 8.460 3.126 1.237 411 1HA GLY 867 1HA GLY 867 9.001 5.060 -2.553 412 2HA GLY 867 2HA GLY 867 8.533 3.542 -3.322 413 HA THR 868 HA THR 868 7.119 5.789 -6.730 414 HB THR 868 HB THR 868 5.307 3.768 -6.518 415 HG1 THR 868 HG1 THR 868 4.963 4.265 -8.734 416 1HG2 THR 868 1HG2 THR 868 3.881 6.420 -6.807 417 2HG2 THR 868 2HG2 THR 868 3.226 4.954 -7.512 418 3HG2 THR 868 3HG2 THR 868 3.450 5.060 -5.769 419 HA ARG 869 HA ARG 869 4.216 8.958 -4.907 420 1HB ARG 869 1HB ARG 869 4.419 7.555 -2.220 421 2HB ARG 869 2HB ARG 869 3.719 9.167 -2.377 422 1HG ARG 869 1HG ARG 869 2.756 6.999 -4.209 423 2HG ARG 869 2HG ARG 869 2.175 7.019 -2.545 424 1HD ARG 869 1HD ARG 869 1.927 9.676 -3.291 425 2HD ARG 869 2HD ARG 869 0.609 8.490 -3.330 426 HE ARG 869 HE ARG 869 2.415 8.574 -5.682 427 1HH1 ARG 869 1HH1 ARG 869 -0.135 10.382 -4.412 428 2HH1 ARG 869 2HH1 ARG 869 -1.151 10.241 -5.807 429 1HH2 ARG 869 1HH2 ARG 869 0.910 7.958 -7.409 430 2HH2 ARG 869 2HH2 ARG 869 -0.561 8.869 -7.502 431 HA ALA 870 HA ALA 870 7.986 10.180 -1.944 432 1HB ALA 870 3HB ALA 870 8.683 8.068 -1.072 433 2HB ALA 870 2HB ALA 870 10.057 8.655 -2.010 434 3HB ALA 870 1HB ALA 870 8.986 7.429 -2.688 435 HA LEU 871 HA LEU 871 10.227 10.505 -5.996 436 1HB LEU 871 1HB LEU 871 9.190 9.139 -8.266 437 2HB LEU 871 2HB LEU 871 10.738 8.882 -7.476 438 HG LEU 871 HG LEU 871 8.341 7.599 -6.252 439 1HD1 LEU 871 1HD1 LEU 871 9.556 6.897 -8.905 440 2HD1 LEU 871 2HD1 LEU 871 8.866 5.644 -7.872 441 3HD1 LEU 871 3HD1 LEU 871 7.853 6.967 -8.450 442 1HD2 LEU 871 1HD2 LEU 871 11.282 7.021 -6.627 443 2HD2 LEU 871 2HD2 LEU 871 10.394 7.225 -5.117 444 3HD2 LEU 871 3HD2 LEU 871 10.168 5.766 -6.083 445 HA GLN 872 HA GLN 872 6.172 11.762 -8.446 446 1HB GLN 872 1HB GLN 872 4.966 10.435 -6.157 447 2HB GLN 872 2HB GLN 872 4.311 12.064 -6.322 448 1HG GLN 872 1HG GLN 872 4.357 11.109 -8.942 449 2HG GLN 872 2HG GLN 872 2.935 11.210 -7.906 450 2HE2 GLN 872 1HE2 GLN 872 4.641 9.055 -9.798 451 1HE2 GLN 872 2HE2 GLN 872 4.197 7.606 -9.032 452 HA ILE 873 HA ILE 873 6.249 15.312 -5.137 453 HB ILE 873 HB ILE 873 7.231 14.833 -2.746 454 1HG1 ILE 873 1HG1 ILE 873 6.062 12.255 -2.552 455 2HG1 ILE 873 2HG1 ILE 873 7.150 12.193 -3.927 456 1HG2 ILE 873 1HG2 ILE 873 4.553 14.279 -3.916 457 2HG2 ILE 873 2HG2 ILE 873 4.812 13.968 -2.202 458 3HG2 ILE 873 3HG2 ILE 873 5.063 15.587 -2.849 459 1HD1 ILE 873 1HD1 ILE 873 8.270 13.594 -1.617 460 2HD1 ILE 873 2HD1 ILE 873 7.921 11.891 -1.327 461 3HD1 ILE 873 3HD1 ILE 873 8.983 12.363 -2.650 462 HA ALA 874 HA ALA 874 10.934 14.501 -4.353 463 1HB ALA 874 1HB ALA 874 10.690 12.002 -6.025 464 2HB ALA 874 3HB ALA 874 11.133 12.100 -4.322 465 3HB ALA 874 2HB ALA 874 12.238 12.695 -5.557 466 HA MET 875 HA MET 875 10.853 15.839 -8.784 467 1HB MET 875 1HB MET 875 8.818 13.989 -9.258 468 2HB MET 875 2HB MET 875 8.052 15.526 -9.665 469 1HG MET 875 1HG MET 875 9.650 16.018 -11.331 470 2HG MET 875 2HG MET 875 10.800 14.839 -10.700 471 1HE MET 875 1HE MET 875 10.155 15.100 -13.676 472 2HE MET 875 2HE MET 875 11.217 13.838 -13.060 473 3HE MET 875 3HE MET 875 9.935 13.424 -14.195 474 HA CYS 876 HA CYS 876 7.897 18.948 -6.930 475 1HB CYS 876 1HB CYS 876 6.073 17.824 -9.042 476 2HB CYS 876 2HB CYS 876 5.497 19.182 -8.076 477 HG CYS 876 HG CYS 876 7.965 20.268 -8.865 478 HA ALA 877 HA ALA 877 4.716 15.952 -4.776 479 1HB ALA 877 3HB ALA 877 4.845 17.909 -3.611 480 2HB ALA 877 1HB ALA 877 4.109 18.850 -4.909 481 3HB ALA 877 2HB ALA 877 3.101 17.845 -3.866 482 HA PRO 878 HA PRO 878 0.975 15.520 -7.681 483 1HB PRO 878 1HB PRO 878 1.844 12.840 -8.231 484 2HB PRO 878 2HB PRO 878 1.732 14.188 -9.367 485 1HG PRO 878 1HG PRO 878 4.096 12.967 -8.385 486 2HG PRO 878 2HG PRO 878 3.981 14.391 -9.406 487 1HD PRO 878 1HD PRO 878 4.780 15.614 -7.683 488 2HD PRO 878 2HD PRO 878 4.678 14.221 -6.588 489 HA VAL 879 HA VAL 879 1.220 11.839 -4.275 490 HB VAL 879 HB VAL 879 2.894 14.057 -3.189 491 1HG1 VAL 879 1HG1 VAL 879 1.222 13.508 -1.353 492 2HG1 VAL 879 2HG1 VAL 879 1.965 11.913 -1.295 493 3HG1 VAL 879 3HG1 VAL 879 2.915 13.349 -0.944 494 1HG2 VAL 879 1HG2 VAL 879 3.437 11.646 -4.347 495 2HG2 VAL 879 2HG2 VAL 879 4.560 12.521 -3.330 496 3HG2 VAL 879 3HG2 VAL 879 3.573 11.246 -2.639 497 HA MET 880 HA MET 880 -2.445 13.692 -2.662 498 1HB MET 880 1HB MET 880 -1.910 11.167 -1.611 499 2HB MET 880 2HB MET 880 -2.459 12.093 -0.214 500 1HG MET 880 1HG MET 880 -4.399 11.102 -1.289 501 2HG MET 880 2HG MET 880 -4.438 12.844 -1.560 502 1HE MET 880 1HE MET 880 -5.407 13.489 -3.182 503 2HE MET 880 2HE MET 880 -4.136 13.910 -4.337 504 3HE MET 880 3HE MET 880 -5.502 12.923 -4.848 505 HA VAL 881 HA VAL 881 -1.112 16.617 0.400 506 HB VAL 881 HB VAL 881 0.793 16.182 2.015 507 1HG1 VAL 881 1HG1 VAL 881 -1.597 15.006 1.953 508 2HG1 VAL 881 2HG1 VAL 881 -0.631 13.565 1.640 509 3HG1 VAL 881 3HG1 VAL 881 -0.376 14.498 3.113 510 1HG2 VAL 881 1HG2 VAL 881 2.028 14.933 -0.007 511 2HG2 VAL 881 2HG2 VAL 881 2.343 14.510 1.677 512 3HG2 VAL 881 3HG2 VAL 881 1.234 13.532 0.715 513 HA GLU 882 HA GLU 882 2.297 18.772 -1.583 514 1HB GLU 882 1HB GLU 882 0.320 20.707 -0.345 515 2HB GLU 882 2HB GLU 882 1.456 21.131 -1.626 516 1HG GLU 882 1HG GLU 882 0.366 18.941 -2.745 517 2HG GLU 882 2HG GLU 882 -0.999 19.452 -1.751 518 HA LEU 883 HA LEU 883 4.465 19.761 2.465 519 1HB LEU 883 1HB LEU 883 5.400 17.519 2.105 520 2HB LEU 883 2HB LEU 883 6.302 18.101 0.706 521 HG LEU 883 HG LEU 883 7.113 19.884 2.605 522 1HD1 LEU 883 1HD1 LEU 883 5.744 18.057 4.124 523 2HD1 LEU 883 2HD1 LEU 883 7.385 17.412 4.192 524 3HD1 LEU 883 3HD1 LEU 883 7.063 19.063 4.724 525 1HD2 LEU 883 1HD2 LEU 883 8.238 17.869 1.062 526 2HD2 LEU 883 2HD2 LEU 883 9.131 18.994 2.086 527 3HD2 LEU 883 3HD2 LEU 883 8.679 17.406 2.706 528 HA GLU 884 HA GLU 884 6.641 22.651 -0.453 529 1HB GLU 884 1HB GLU 884 8.518 21.279 1.203 530 2HB GLU 884 2HB GLU 884 9.405 21.972 -0.154 531 1HG GLU 884 1HG GLU 884 7.428 23.532 1.532 532 2HG GLU 884 2HG GLU 884 9.170 23.531 1.812 533 1HA GLY 885 1HA GLY 885 7.157 19.832 -4.467 534 2HA GLY 885 2HA GLY 885 8.523 20.924 -4.235 535 HA GLU 886 HA GLU 886 9.969 16.597 -2.119 536 1HB GLU 886 1HB GLU 886 10.605 16.711 -4.407 537 2HB GLU 886 2HB GLU 886 11.507 18.205 -4.168 538 1HG GLU 886 1HG GLU 886 13.092 16.887 -2.688 539 2HG GLU 886 2HG GLU 886 12.260 15.427 -3.221 540 HA THR 887 HA THR 887 13.532 17.807 0.334 541 HB THR 887 HB THR 887 10.884 18.131 1.792 542 HG1 THR 887 HG1 THR 887 12.748 19.940 0.653 543 1HG2 THR 887 1HG2 THR 887 13.683 18.834 2.720 544 2HG2 THR 887 2HG2 THR 887 12.223 19.521 3.433 545 3HG2 THR 887 3HG2 THR 887 12.519 17.785 3.529 546 HA ASP 888 HA ASP 888 12.671 14.287 3.272 547 1HB ASP 888 1HB ASP 888 10.256 15.292 3.621 548 2HB ASP 888 2HB ASP 888 9.781 13.788 2.837 549 HA PRO 889 HA PRO 889 12.981 11.024 0.261 550 1HB PRO 889 1HB PRO 889 13.290 9.026 2.304 551 2HB PRO 889 2HB PRO 889 14.554 9.799 1.344 552 1HG PRO 889 1HG PRO 889 14.074 10.146 4.119 553 2HG PRO 889 2HG PRO 889 15.215 11.048 3.116 554 1HD PRO 889 1HD PRO 889 13.928 12.899 3.453 555 2HD PRO 889 2HD PRO 889 12.641 11.930 4.213 556 HA LEU 890 HA LEU 890 8.625 9.724 1.120 557 1HB LEU 890 1HB LEU 890 8.470 7.691 2.449 558 2HB LEU 890 2HB LEU 890 10.126 7.880 1.901 559 HG LEU 890 HG LEU 890 10.222 7.197 4.196 560 1HD1 LEU 890 1HD1 LEU 890 11.704 9.144 3.473 561 2HD1 LEU 890 2HD1 LEU 890 10.588 10.185 4.352 562 3HD1 LEU 890 3HD1 LEU 890 11.482 8.931 5.207 563 1HD2 LEU 890 1HD2 LEU 890 7.767 8.236 4.504 564 2HD2 LEU 890 2HD2 LEU 890 8.823 7.885 5.870 565 3HD2 LEU 890 3HD2 LEU 890 8.707 9.529 5.248 566 HA LEU 891 HA LEU 891 7.376 11.772 5.508 567 1HB LEU 891 1HB LEU 891 8.406 13.827 5.515 568 2HB LEU 891 2HB LEU 891 8.372 13.929 3.767 569 HG LEU 891 HG LEU 891 6.976 15.647 4.969 570 1HD1 LEU 891 1HD1 LEU 891 6.506 14.441 2.565 571 2HD1 LEU 891 2HD1 LEU 891 4.958 14.205 3.379 572 3HD1 LEU 891 3HD1 LEU 891 5.607 15.828 3.172 573 1HD2 LEU 891 1HD2 LEU 891 6.002 13.357 6.305 574 2HD2 LEU 891 2HD2 LEU 891 5.474 15.026 6.515 575 3HD2 LEU 891 3HD2 LEU 891 4.662 13.987 5.347 576 HA ILE 892 HA ILE 892 4.008 12.877 2.235 577 HB ILE 892 HB ILE 892 6.326 12.584 0.442 578 1HG1 ILE 892 1HG1 ILE 892 4.012 14.219 -0.319 579 2HG1 ILE 892 2HG1 ILE 892 4.694 14.599 1.261 580 1HG2 ILE 892 1HG2 ILE 892 3.630 11.541 -0.303 581 2HG2 ILE 892 2HG2 ILE 892 4.571 12.416 -1.496 582 3HG2 ILE 892 3HG2 ILE 892 5.230 10.961 -0.767 583 1HD1 ILE 892 1HD1 ILE 892 6.555 14.112 -0.995 584 2HD1 ILE 892 2HD1 ILE 892 5.699 15.651 -0.951 585 3HD1 ILE 892 3HD1 ILE 892 6.739 15.175 0.393 586 HA ALA 893 HA ALA 893 4.115 8.373 0.690 587 1HB ALA 893 1HB ALA 893 6.997 8.384 1.207 588 2HB ALA 893 3HB ALA 893 6.093 7.537 -0.044 589 3HB ALA 893 2HB ALA 893 6.221 6.849 1.573 590 HA MET 894 HA MET 894 4.271 7.335 5.330 591 1HB MET 894 1HB MET 894 6.431 8.209 5.946 592 2HB MET 894 2HB MET 894 5.900 9.869 5.688 593 1HG MET 894 1HG MET 894 4.394 9.710 7.620 594 2HG MET 894 2HG MET 894 4.862 8.028 7.867 595 1HE MET 894 3HE MET 894 6.155 11.296 6.939 596 2HE MET 894 2HE MET 894 7.016 11.900 8.360 597 3HE MET 894 1HE MET 894 7.886 11.017 7.110 598 HA LYS 895 HA LYS 895 1.765 11.334 6.440 599 1HB LYS 895 1HB LYS 895 3.034 13.163 5.645 600 2HB LYS 895 2HB LYS 895 3.020 12.566 3.988 601 1HG LYS 895 1HG LYS 895 0.517 12.974 3.977 602 2HG LYS 895 2HG LYS 895 1.511 14.425 4.065 603 1HD LYS 895 1HD LYS 895 -0.053 13.082 6.271 604 2HD LYS 895 2HD LYS 895 1.265 14.198 6.631 605 1HE LYS 895 1HE LYS 895 0.100 15.881 5.101 606 2HE LYS 895 2HE LYS 895 -1.299 14.788 5.128 607 1HZ LYS 895 1HZ LYS 895 0.077 15.702 7.590 608 2HZ LYS 895 2HZ LYS 895 -1.260 16.518 6.933 609 3HZ LYS 895 3HZ LYS 895 -1.420 14.914 7.469 610 HA GLU 896 HA GLU 896 -0.783 10.543 2.390 611 1HB GLU 896 1HB GLU 896 -0.149 9.369 0.432 612 2HB GLU 896 2HB GLU 896 1.271 10.313 0.855 613 1HG GLU 896 1HG GLU 896 2.285 8.355 1.897 614 2HG GLU 896 2HG GLU 896 0.852 7.398 1.548 615 HA LEU 897 HA LEU 897 -1.002 6.072 3.787 616 1HB LEU 897 1HB LEU 897 1.316 5.240 3.556 617 2HB LEU 897 2HB LEU 897 1.732 5.988 5.097 618 HG LEU 897 HG LEU 897 0.933 3.388 4.848 619 1HD1 LEU 897 1HD1 LEU 897 0.684 5.377 7.096 620 2HD1 LEU 897 2HD1 LEU 897 0.248 3.685 7.334 621 3HD1 LEU 897 3HD1 LEU 897 1.894 4.114 6.868 622 1HD2 LEU 897 1HD2 LEU 897 -1.403 4.440 4.195 623 2HD2 LEU 897 2HD2 LEU 897 -1.349 3.089 5.319 624 3HD2 LEU 897 3HD2 LEU 897 -1.544 4.721 5.928 625 HA LYS 898 HA LYS 898 -0.408 7.534 8.474 626 1HB LYS 898 1HB LYS 898 1.576 8.943 8.114 627 2HB LYS 898 2HB LYS 898 0.600 10.071 7.176 628 1HG LYS 898 1HG LYS 898 -0.559 10.847 9.049 629 2HG LYS 898 2HG LYS 898 -0.174 9.415 10.004 630 1HD LYS 898 1HD LYS 898 2.331 10.380 9.465 631 2HD LYS 898 2HD LYS 898 1.403 11.875 9.582 632 1HE LYS 898 1HE LYS 898 0.550 10.181 11.722 633 2HE LYS 898 2HE LYS 898 1.469 11.695 11.839 634 1HZ LYS 898 1HZ LYS 898 3.478 10.381 11.267 635 2HZ LYS 898 2HZ LYS 898 2.786 9.917 12.748 636 3HZ LYS 898 3HZ LYS 898 2.550 8.961 11.367 637 HA ALA 899 HA ALA 899 -3.664 10.550 6.870 638 1HB ALA 899 3HB ALA 899 -3.904 11.456 4.586 639 2HB ALA 899 1HB ALA 899 -2.222 11.583 5.098 640 3HB ALA 899 2HB ALA 899 -2.712 10.306 3.987 641 HA ARG 900 HA ARG 900 -4.058 5.816 4.409 642 1HB ARG 900 1HB ARG 900 -5.295 5.117 6.200 643 2HB ARG 900 2HB ARG 900 -4.925 6.671 6.935 644 1HG ARG 900 1HG ARG 900 -6.991 7.550 5.636 645 2HG ARG 900 2HG ARG 900 -7.404 5.849 5.429 646 1HD ARG 900 1HD ARG 900 -6.764 6.037 8.140 647 2HD ARG 900 2HD ARG 900 -8.407 6.016 7.469 648 HE ARG 900 HE ARG 900 -8.102 8.565 7.257 649 1HH1 ARG 900 1HH1 ARG 900 -5.332 7.538 8.690 650 2HH1 ARG 900 2HH1 ARG 900 -5.512 8.431 10.163 651 1HH2 ARG 900 1HH2 ARG 900 -8.795 9.342 9.521 652 2HH2 ARG 900 2HH2 ARG 900 -7.472 9.452 10.633 653 HA LYS 901 HA LYS 901 -6.944 8.413 2.106 654 1HB LYS 901 1HB LYS 901 -6.379 10.530 3.057 655 2HB LYS 901 2HB LYS 901 -4.783 10.507 2.309 656 1HG LYS 901 1HG LYS 901 -6.419 12.042 1.165 657 2HG LYS 901 2HG LYS 901 -5.738 10.809 0.107 658 1HD LYS 901 1HD LYS 901 -7.762 9.898 -0.279 659 2HD LYS 901 2HD LYS 901 -8.135 9.843 1.443 660 1HE LYS 901 1HE LYS 901 -9.408 11.727 1.321 661 2HE LYS 901 2HE LYS 901 -8.187 12.576 0.354 662 1HZ LYS 901 1HZ LYS 901 -9.844 10.382 -0.752 663 2HZ LYS 901 2HZ LYS 901 -10.332 12.008 -0.828 664 3HZ LYS 901 3HZ LYS 901 -8.902 11.511 -1.600 665 HA ILE 902 HA ILE 902 -3.137 8.166 -1.209 666 HB ILE 902 HB ILE 902 -2.048 5.898 -1.188 667 1HG1 ILE 902 1HG1 ILE 902 -4.131 5.321 0.611 668 2HG1 ILE 902 2HG1 ILE 902 -2.784 4.269 0.194 669 1HG2 ILE 902 1HG2 ILE 902 -1.780 7.718 1.213 670 2HG2 ILE 902 2HG2 ILE 902 -0.660 6.399 0.873 671 3HG2 ILE 902 3HG2 ILE 902 -0.824 7.732 -0.268 672 1HD1 ILE 902 1HD1 ILE 902 -2.661 6.346 2.398 673 2HD1 ILE 902 2HD1 ILE 902 -3.082 4.657 2.671 674 3HD1 ILE 902 3HD1 ILE 902 -1.484 5.078 2.059 675 HA PRO 903 HA PRO 903 -6.835 6.060 -2.998 676 1HB PRO 903 1HB PRO 903 -6.821 8.086 -5.041 677 2HB PRO 903 2HB PRO 903 -7.955 7.931 -3.694 678 1HG PRO 903 1HG PRO 903 -6.100 10.005 -4.026 679 2HG PRO 903 2HG PRO 903 -6.947 9.615 -2.524 680 1HD PRO 903 1HD PRO 903 -4.821 9.244 -1.683 681 2HD PRO 903 2HD PRO 903 -4.129 9.009 -3.307 682 HA ILE 904 HA ILE 904 -4.706 4.724 -6.642 683 HB ILE 904 HB ILE 904 -2.777 5.130 -4.531 684 1HG1 ILE 904 1HG1 ILE 904 -1.983 5.343 -7.366 685 2HG1 ILE 904 2HG1 ILE 904 -3.448 6.227 -6.943 686 1HG2 ILE 904 1HG2 ILE 904 -2.110 3.099 -6.677 687 2HG2 ILE 904 2HG2 ILE 904 -0.926 3.881 -5.628 688 3HG2 ILE 904 3HG2 ILE 904 -2.146 2.810 -4.937 689 1HD1 ILE 904 2HD1 ILE 904 -1.915 6.923 -4.843 690 2HD1 ILE 904 3HD1 ILE 904 -0.650 6.671 -6.045 691 3HD1 ILE 904 1HD1 ILE 904 -1.934 7.841 -6.348 692 HA ILE 905 HA ILE 905 -4.902 0.325 -6.560 693 HB ILE 905 HB ILE 905 -6.052 1.162 -8.559 694 1HG1 ILE 905 1HG1 ILE 905 -4.501 -0.881 -9.944 695 2HG1 ILE 905 2HG1 ILE 905 -4.874 -1.354 -8.286 696 1HG2 ILE 905 1HG2 ILE 905 -3.235 1.352 -9.628 697 2HG2 ILE 905 2HG2 ILE 905 -4.623 1.241 -10.710 698 3HG2 ILE 905 3HG2 ILE 905 -4.480 2.597 -9.593 699 1HD1 ILE 905 1HD1 ILE 905 -6.960 -0.233 -10.159 700 2HD1 ILE 905 2HD1 ILE 905 -6.632 -1.960 -10.030 701 3HD1 ILE 905 3HD1 ILE 905 -7.218 -1.063 -8.625 702 HA ILE 906 HA ILE 906 -0.712 -0.944 -7.870 703 HB ILE 906 HB ILE 906 -1.650 -1.621 -5.126 704 1HG1 ILE 906 1HG1 ILE 906 0.687 -0.221 -6.411 705 2HG1 ILE 906 2HG1 ILE 906 0.682 -0.586 -4.687 706 1HG2 ILE 906 1HG2 ILE 906 0.783 -2.941 -6.368 707 2HG2 ILE 906 2HG2 ILE 906 0.484 -2.853 -4.633 708 3HG2 ILE 906 3HG2 ILE 906 -0.616 -3.756 -5.673 709 1HD1 ILE 906 1HD1 ILE 906 -1.848 0.523 -5.233 710 2HD1 ILE 906 2HD1 ILE 906 -0.515 1.294 -4.376 711 3HD1 ILE 906 3HD1 ILE 906 -0.691 1.522 -6.113 712 HA ARG 907 HA ARG 907 -1.710 -5.054 -9.302 713 1HB ARG 907 1HB ARG 907 0.720 -4.000 -10.688 714 2HB ARG 907 2HB ARG 907 0.161 -5.634 -11.016 715 1HG ARG 907 1HG ARG 907 -0.815 -3.999 -12.600 716 2HG ARG 907 2HG ARG 907 -2.043 -4.792 -11.619 717 1HD ARG 907 1HD ARG 907 -2.446 -2.865 -10.325 718 2HD ARG 907 2HD ARG 907 -0.881 -2.143 -10.749 719 HE ARG 907 HE ARG 907 -3.082 -2.514 -12.750 720 1HH1 ARG 907 1HH1 ARG 907 -0.153 -1.770 -13.443 721 2HH1 ARG 907 2HH1 ARG 907 -0.319 -0.063 -13.681 722 1HH2 ARG 907 1HH2 ARG 907 -3.431 0.114 -12.162 723 2HH2 ARG 907 2HH2 ARG 907 -2.176 1.003 -12.956 724 HA ARG 908 HA ARG 908 1.250 -7.211 -6.760 725 1HB ARG 908 1HB ARG 908 -0.979 -8.957 -5.925 726 2HB ARG 908 2HB ARG 908 0.209 -8.137 -4.940 727 1HG ARG 908 1HG ARG 908 -1.110 -5.992 -5.311 728 2HG ARG 908 2HG ARG 908 -2.370 -6.984 -6.045 729 1HD ARG 908 1HD ARG 908 -2.843 -6.601 -3.587 730 2HD ARG 908 2HD ARG 908 -2.538 -8.322 -3.917 731 HE ARG 908 HE ARG 908 -0.123 -6.775 -3.288 732 1HH1 ARG 908 1HH1 ARG 908 -2.852 -7.688 -1.553 733 2HH1 ARG 908 2HH1 ARG 908 -2.003 -8.635 -0.377 734 1HH2 ARG 908 1HH2 ARG 908 1.041 -8.441 -2.026 735 2HH2 ARG 908 2HH2 ARG 908 0.200 -9.059 -0.644 736 HA TYR 909 HA TYR 909 0.871 -10.462 -9.911 737 1HB TYR 909 1HB TYR 909 3.785 -9.834 -10.201 738 2HB TYR 909 2HB TYR 909 2.681 -10.474 -11.398 739 HD1 TYR 909 HD1 TYR 909 1.066 -8.978 -12.535 740 HD2 TYR 909 HD2 TYR 909 4.070 -7.443 -9.899 741 HE1 TYR 909 HE1 TYR 909 0.799 -6.747 -13.516 742 HE2 TYR 909 HE2 TYR 909 3.822 -5.218 -10.878 743 HH TYR 909 HH TYR 909 1.195 -4.419 -12.957 744 HA LEU 910 HA LEU 910 3.667 -12.947 -7.392 745 1HB LEU 910 1HB LEU 910 1.855 -14.680 -9.079 746 2HB LEU 910 2HB LEU 910 2.565 -15.185 -7.544 747 HG LEU 910 HG LEU 910 0.623 -12.902 -8.004 748 1HD1 LEU 910 1HD1 LEU 910 0.264 -15.678 -7.545 749 2HD1 LEU 910 2HD1 LEU 910 -0.164 -14.856 -6.051 750 3HD1 LEU 910 3HD1 LEU 910 -0.969 -14.419 -7.555 751 1HD2 LEU 910 1HD2 LEU 910 2.568 -13.269 -5.931 752 2HD2 LEU 910 2HD2 LEU 910 1.328 -12.021 -6.058 753 3HD2 LEU 910 3HD2 LEU 910 0.968 -13.539 -5.241 754 HA PRO 911 HA PRO 911 7.079 -14.088 -10.105 755 1HB PRO 911 1HB PRO 911 8.486 -14.875 -7.721 756 2HB PRO 911 2HB PRO 911 8.742 -13.422 -8.692 757 1HG PRO 911 1HG PRO 911 7.854 -12.168 -7.029 758 2HG PRO 911 2HG PRO 911 7.552 -13.624 -6.078 759 1HD PRO 911 1HD PRO 911 5.314 -13.397 -6.474 760 2HD PRO 911 2HD PRO 911 5.624 -11.975 -7.494 761 HA ASP 912 HA ASP 912 6.356 -18.417 -8.042 762 1HB ASP 912 1HB ASP 912 3.932 -17.084 -6.946 763 2HB ASP 912 2HB ASP 912 3.768 -18.804 -7.300 764 1HA GLY 913 1HA GLY 913 3.832 -17.383 -12.231 765 2HA GLY 913 2HA GLY 913 3.425 -18.953 -11.544 766 HA SER 914 HA SER 914 -0.300 -15.994 -11.922 767 1HB SER 914 1HB SER 914 -0.847 -15.658 -9.177 768 2HB SER 914 2HB SER 914 -1.202 -17.078 -10.151 769 HG SER 914 HG SER 914 0.096 -17.829 -8.577 770 HA TYR 915 HA TYR 915 -0.126 -11.890 -9.658 771 1HB TYR 915 1HB TYR 915 0.875 -11.158 -11.583 772 2HB TYR 915 2HB TYR 915 0.079 -12.435 -12.490 773 HD1 TYR 915 HD1 TYR 915 -0.619 -9.036 -11.035 774 HD2 TYR 915 HD2 TYR 915 -1.490 -11.889 -14.128 775 HE1 TYR 915 HE1 TYR 915 -2.047 -7.364 -12.178 776 HE2 TYR 915 HE2 TYR 915 -2.917 -10.216 -15.269 777 HH TYR 915 HH TYR 915 -4.130 -8.209 -14.797 778 HA GLU 916 HA GLU 916 -4.310 -10.047 -10.451 779 1HB GLU 916 1HB GLU 916 -3.652 -11.158 -7.990 780 2HB GLU 916 2HB GLU 916 -4.228 -9.540 -7.583 781 1HG GLU 916 1HG GLU 916 -5.800 -11.096 -9.582 782 2HG GLU 916 2HG GLU 916 -5.921 -11.576 -7.889 783 HA ASP 917 HA ASP 917 -3.368 -5.743 -9.610 784 1HB ASP 917 1HB ASP 917 -3.613 -6.131 -12.056 785 2HB ASP 917 2HB ASP 917 -4.014 -4.518 -11.538 786 HA TRP 918 HA TRP 918 -6.483 -2.687 -8.389 787 1HB TRP 918 1HB TRP 918 -7.857 -3.856 -6.655 788 2HB TRP 918 2HB TRP 918 -7.942 -4.559 -8.252 789 HD1 TRP 918 HD1 TRP 918 -4.775 -5.872 -7.139 790 HE1 TRP 918 HE1 TRP 918 -5.091 -8.238 -6.155 791 HE3 TRP 918 HE3 TRP 918 -9.681 -5.641 -6.171 792 HZ2 TRP 918 HZ2 TRP 918 -7.246 -9.778 -4.947 793 HZ3 TRP 918 HZ3 TRP 918 -10.868 -7.429 -5.028 794 HH2 TRP 918 HH2 TRP 918 -9.678 -9.547 -4.414 795 1HA GLY 919 1HA GLY 919 -4.782 -2.598 -4.102 796 2HA GLY 919 2HA GLY 919 -4.502 -1.072 -4.926 797 HA VAL 920 HA VAL 920 -7.664 0.267 -2.189 798 HB VAL 920 HB VAL 920 -6.472 2.663 -3.629 799 1HG1 VAL 920 1HG1 VAL 920 -8.048 2.462 -1.045 800 2HG1 VAL 920 2HG1 VAL 920 -7.109 3.880 -1.512 801 3HG1 VAL 920 3HG1 VAL 920 -8.489 3.376 -2.488 802 1HG2 VAL 920 1HG2 VAL 920 -5.612 0.843 -1.449 803 2HG2 VAL 920 2HG2 VAL 920 -4.640 1.774 -2.590 804 3HG2 VAL 920 3HG2 VAL 920 -5.325 2.560 -1.171 805 HA ASP 921 HA ASP 921 -10.468 1.881 -5.540 806 1HB ASP 921 1HB ASP 921 -8.829 1.967 -7.412 807 2HB ASP 921 2HB ASP 921 -9.073 0.239 -7.675 808 HA GLU 922 HA GLU 922 -12.236 -2.297 -5.287 809 1HB GLU 922 1HB GLU 922 -10.518 -2.861 -7.118 810 2HB GLU 922 2HB GLU 922 -9.724 -3.845 -5.890 811 1HG GLU 922 1HG GLU 922 -11.581 -5.303 -5.681 812 2HG GLU 922 2HG GLU 922 -12.676 -4.153 -6.450 813 HA LEU 923 HA LEU 923 -10.503 -3.517 -1.239 814 1HB LEU 923 1HB LEU 923 -8.193 -4.681 -1.032 815 2HB LEU 923 2HB LEU 923 -9.302 -5.226 -2.270 816 HG LEU 923 HG LEU 923 -7.802 -3.108 -3.414 817 1HD1 LEU 923 1HD1 LEU 923 -6.094 -5.188 -2.030 818 2HD1 LEU 923 2HD1 LEU 923 -5.528 -4.094 -3.289 819 3HD1 LEU 923 3HD1 LEU 923 -6.063 -3.453 -1.739 820 1HD2 LEU 923 1HD2 LEU 923 -8.387 -5.937 -3.728 821 2HD2 LEU 923 2HD2 LEU 923 -8.309 -4.644 -4.928 822 3HD2 LEU 923 3HD2 LEU 923 -6.833 -5.448 -4.406 823 HA ILE 924 HA ILE 924 -8.137 -1.175 1.643 824 HB ILE 924 HB ILE 924 -6.983 -3.868 1.819 825 1HG1 ILE 924 1HG1 ILE 924 -7.668 -3.297 4.255 826 2HG1 ILE 924 2HG1 ILE 924 -8.409 -1.879 3.518 827 1HG2 ILE 924 1HG2 ILE 924 -4.892 -2.566 2.084 828 2HG2 ILE 924 2HG2 ILE 924 -5.652 -1.674 3.401 829 3HG2 ILE 924 3HG2 ILE 924 -5.372 -3.404 3.552 830 1HD1 ILE 924 3HD1 ILE 924 -8.870 -4.714 2.583 831 2HD1 ILE 924 1HD1 ILE 924 -9.973 -3.819 3.627 832 3HD1 ILE 924 2HD1 ILE 924 -9.668 -3.263 1.981 833 HA ILE 925 HA ILE 925 -4.357 0.664 0.221 834 HB ILE 925 HB ILE 925 -3.919 2.534 1.827 835 1HG1 ILE 925 1HG1 ILE 925 -6.211 1.683 3.525 836 2HG1 ILE 925 2HG1 ILE 925 -4.704 0.799 3.758 837 1HG2 ILE 925 1HG2 ILE 925 -6.488 1.869 0.594 838 2HG2 ILE 925 2HG2 ILE 925 -6.661 2.980 1.953 839 3HG2 ILE 925 3HG2 ILE 925 -5.608 3.397 0.601 840 1HD1 ILE 925 2HD1 ILE 925 -3.537 3.043 3.950 841 2HD1 ILE 925 3HD1 ILE 925 -5.137 3.786 3.992 842 3HD1 ILE 925 1HD1 ILE 925 -4.650 2.670 5.267 843 HA THR 926 HA THR 926 -0.762 -0.571 2.713 844 HB THR 926 HB THR 926 -1.507 1.227 5.033 845 HG1 THR 926 HG1 THR 926 -1.391 2.544 3.313 846 1HG2 THR 926 1HG2 THR 926 1.125 0.048 4.113 847 2HG2 THR 926 2HG2 THR 926 0.973 1.271 5.371 848 3HG2 THR 926 3HG2 THR 926 0.263 -0.327 5.601 849 HA ASP 927 HA ASP 927 -3.731 -3.011 5.460 850 1HB ASP 927 1HB ASP 927 -1.594 -2.128 6.681 851 2HB ASP 927 2HB ASP 927 -2.735 -1.371 7.793 No H/Q in entry = 851 Start of MODEL 5 1 HA MET 801 HA MET 801 34.545 -16.924 15.947 2 1HB MET 801 1HB MET 801 37.126 -17.315 15.112 3 2HB MET 801 2HB MET 801 36.223 -17.966 13.743 4 1HG MET 801 1HG MET 801 35.263 -15.926 13.227 5 2HG MET 801 2HG MET 801 35.336 -15.351 14.893 6 1HE MET 801 1HE MET 801 37.278 -14.775 16.132 7 2HE MET 801 2HE MET 801 38.488 -15.972 15.676 8 3HE MET 801 3HE MET 801 38.842 -14.246 15.517 9 HA SER 802 HA SER 802 32.953 -20.273 13.083 10 1HB SER 802 1HB SER 802 35.605 -21.667 13.143 11 2HB SER 802 2HB SER 802 34.218 -22.538 12.496 12 HG SER 802 HG SER 802 33.886 -20.764 11.082 13 HA ASP 803 HA ASP 803 32.175 -23.110 16.619 14 1HB ASP 803 1HB ASP 803 31.612 -22.063 18.797 15 2HB ASP 803 2HB ASP 803 33.131 -21.447 18.151 16 HA ASN 804 HA ASN 804 27.969 -24.185 15.047 17 1HB ASN 804 1HB ASN 804 27.893 -22.506 17.576 18 2HB ASN 804 2HB ASN 804 26.508 -23.369 16.904 19 2HD2 ASN 804 1HD2 ASN 804 27.069 -25.845 16.451 20 1HD2 ASN 804 2HD2 ASN 804 27.932 -26.628 17.685 21 HA GLU 805 HA GLU 805 27.792 -19.980 13.151 22 1HB GLU 805 1HB GLU 805 28.621 -21.879 11.358 23 2HB GLU 805 2HB GLU 805 27.011 -21.508 10.738 24 1HG GLU 805 1HG GLU 805 27.917 -18.998 11.243 25 2HG GLU 805 2HG GLU 805 28.104 -19.801 9.684 26 HA ASP 806 HA ASP 806 23.380 -20.061 13.688 27 1HB ASP 806 1HB ASP 806 24.468 -17.572 13.833 28 2HB ASP 806 2HB ASP 806 23.405 -17.366 12.441 29 HA ASN 807 HA ASN 807 22.669 -20.660 9.220 30 1HB ASN 807 1HB ASN 807 23.697 -22.843 9.803 31 2HB ASN 807 2HB ASN 807 22.263 -23.066 8.803 32 2HD2 ASN 807 1HD2 ASN 807 22.225 -25.304 9.842 33 1HD2 ASN 807 2HD2 ASN 807 21.505 -25.473 11.369 34 HA PHE 808 HA PHE 808 18.192 -20.938 9.966 35 1HB PHE 808 1HB PHE 808 18.910 -21.861 7.275 36 2HB PHE 808 2HB PHE 808 17.230 -22.206 7.684 37 HD1 PHE 808 HD1 PHE 808 19.711 -19.416 8.127 38 HD2 PHE 808 HD2 PHE 808 15.673 -20.551 7.199 39 HE1 PHE 808 HE1 PHE 808 19.127 -17.035 7.752 40 HE2 PHE 808 HE2 PHE 808 15.090 -18.171 6.825 41 HZ PHE 808 HZ PHE 808 16.817 -16.412 7.101 42 HA ASP 809 HA ASP 809 16.820 -24.806 11.660 43 1HB ASP 809 1HB ASP 809 18.717 -25.580 9.664 44 2HB ASP 809 2HB ASP 809 18.800 -26.767 10.966 45 1HA GLY 810 1HA GLY 810 18.567 -25.914 15.533 46 2HA GLY 810 2HA GLY 810 19.759 -24.652 15.218 47 HA ASP 811 HA ASP 811 17.380 -22.246 18.078 48 1HB ASP 811 1HB ASP 811 18.633 -20.157 16.266 49 2HB ASP 811 2HB ASP 811 18.069 -19.850 17.910 50 HA ASP 812 HA ASP 812 13.920 -20.741 15.448 51 1HB ASP 812 1HB ASP 812 12.571 -22.496 14.325 52 2HB ASP 812 2HB ASP 812 14.289 -22.682 13.973 53 HA PHE 813 HA PHE 813 11.280 -21.951 18.979 54 1HB PHE 813 1HB PHE 813 13.458 -23.055 19.938 55 2HB PHE 813 2HB PHE 813 13.520 -21.621 20.964 56 HD1 PHE 813 HD1 PHE 813 11.364 -24.489 19.958 57 HD2 PHE 813 HD2 PHE 813 12.078 -21.382 22.836 58 HE1 PHE 813 HE1 PHE 813 9.654 -25.483 21.454 59 HE2 PHE 813 HE2 PHE 813 10.368 -22.376 24.334 60 HZ PHE 813 HZ PHE 813 9.156 -24.426 23.643 61 HA ASP 814 HA ASP 814 10.813 -17.635 19.981 62 1HB ASP 814 1HB ASP 814 13.022 -17.896 21.044 63 2HB ASP 814 2HB ASP 814 13.812 -17.318 19.577 64 HA ASP 815 HA ASP 815 10.836 -15.267 16.164 65 1HB ASP 815 1HB ASP 815 9.348 -13.679 18.265 66 2HB ASP 815 2HB ASP 815 9.354 -13.202 16.566 67 HA VAL 816 HA VAL 816 14.285 -12.458 17.466 68 HB VAL 816 HB VAL 816 12.387 -10.972 16.955 69 1HG1 VAL 816 1HG1 VAL 816 11.289 -11.590 19.253 70 2HG1 VAL 816 2HG1 VAL 816 12.226 -10.226 19.865 71 3HG1 VAL 816 3HG1 VAL 816 11.036 -9.977 18.587 72 1HG2 VAL 816 1HG2 VAL 816 14.808 -10.144 17.542 73 2HG2 VAL 816 2HG2 VAL 816 13.511 -8.961 17.373 74 3HG2 VAL 816 3HG2 VAL 816 14.033 -9.474 18.978 75 HA GLU 817 HA GLU 817 15.551 -11.956 21.746 76 1HB GLU 817 1HB GLU 817 17.062 -13.894 22.194 77 2HB GLU 817 2HB GLU 817 15.590 -14.377 21.351 78 1HG GLU 817 1HG GLU 817 16.831 -14.267 19.190 79 2HG GLU 817 2HG GLU 817 18.305 -13.896 20.088 80 HA GLU 818 HA GLU 818 19.377 -9.827 20.729 81 1HB GLU 818 1HB GLU 818 18.930 -10.594 17.833 82 2HB GLU 818 2HB GLU 818 20.398 -9.788 18.388 83 1HG GLU 818 1HG GLU 818 20.474 -11.698 20.170 84 2HG GLU 818 2HG GLU 818 19.387 -12.539 19.064 85 HA ASP 819 HA ASP 819 19.978 -5.416 19.408 86 1HB ASP 819 1HB ASP 819 19.234 -6.863 17.245 87 2HB ASP 819 2HB ASP 819 17.711 -6.040 17.585 88 HA GLU 820 HA GLU 820 16.025 -4.421 21.316 89 1HB GLU 820 1HB GLU 820 17.795 -2.125 20.724 90 2HB GLU 820 2HB GLU 820 16.162 -1.685 21.223 91 1HG GLU 820 1HG GLU 820 16.414 -3.211 23.197 92 2HG GLU 820 2HG GLU 820 17.550 -1.863 23.209 93 1HA GLY 821 1HA GLY 821 14.810 -1.774 16.850 94 2HA GLY 821 2HA GLY 821 13.648 -2.778 17.719 95 HA LEU 822 HA LEU 822 12.264 1.364 18.784 96 1HB LEU 822 1HB LEU 822 15.020 2.005 18.270 97 2HB LEU 822 2HB LEU 822 14.031 3.416 17.892 98 HG LEU 822 HG LEU 822 13.612 1.869 20.446 99 1HD1 LEU 822 1HD1 LEU 822 15.648 4.026 19.851 100 2HD1 LEU 822 2HD1 LEU 822 15.066 3.703 21.484 101 3HD1 LEU 822 3HD1 LEU 822 15.923 2.448 20.590 102 1HD2 LEU 822 1HD2 LEU 822 12.081 3.751 19.360 103 2HD2 LEU 822 2HD2 LEU 822 12.368 3.720 21.099 104 3HD2 LEU 822 3HD2 LEU 822 13.284 4.826 20.073 105 HA ASP 823 HA ASP 823 11.138 3.398 14.832 106 1HB ASP 823 1HB ASP 823 13.720 4.989 14.830 107 2HB ASP 823 2HB ASP 823 12.296 5.441 13.891 108 HA ASP 824 HA ASP 824 13.459 1.102 11.615 109 1HB ASP 824 1HB ASP 824 15.374 2.215 10.469 110 2HB ASP 824 2HB ASP 824 14.239 3.384 11.141 111 HA LEU 825 HA LEU 825 16.872 -1.404 13.320 112 1HB LEU 825 1HB LEU 825 15.992 -0.147 15.840 113 2HB LEU 825 2HB LEU 825 16.710 -1.744 16.049 114 HG LEU 825 HG LEU 825 18.377 -0.470 14.192 115 1HD1 LEU 825 1HD1 LEU 825 17.103 1.635 15.003 116 2HD1 LEU 825 2HD1 LEU 825 17.977 1.410 16.518 117 3HD1 LEU 825 3HD1 LEU 825 18.865 1.688 15.019 118 1HD2 LEU 825 1HD2 LEU 825 18.493 -1.188 17.099 119 2HD2 LEU 825 2HD2 LEU 825 19.432 -1.828 15.750 120 3HD2 LEU 825 3HD2 LEU 825 19.814 -0.240 16.416 121 HA GLU 826 HA GLU 826 13.941 -4.759 14.175 122 1HB GLU 826 1HB GLU 826 12.048 -3.447 13.501 123 2HB GLU 826 2HB GLU 826 12.574 -3.441 11.817 124 1HG GLU 826 1HG GLU 826 11.738 -5.521 11.409 125 2HG GLU 826 2HG GLU 826 12.186 -6.123 13.005 126 HA ASN 827 HA ASN 827 16.805 -5.384 9.768 127 1HB ASN 827 1HB ASN 827 16.294 -7.386 11.994 128 2HB ASN 827 2HB ASN 827 17.438 -7.619 10.673 129 2HD2 ASN 827 1HD2 ASN 827 18.192 -7.482 13.498 130 1HD2 ASN 827 2HD2 ASN 827 19.184 -6.118 13.684 131 HA ALA 828 HA ALA 828 12.837 -7.349 8.444 132 1HB ALA 828 3HB ALA 828 11.696 -5.984 6.853 133 2HB ALA 828 2HB ALA 828 13.180 -5.148 6.395 134 3HB ALA 828 1HB ALA 828 12.446 -4.842 7.969 135 HA GLU 829 HA GLU 829 14.919 -9.104 4.857 136 1HB GLU 829 1HB GLU 829 12.107 -9.081 4.440 137 2HB GLU 829 2HB GLU 829 12.854 -8.998 2.845 138 1HG GLU 829 1HG GLU 829 14.423 -10.888 3.940 139 2HG GLU 829 2HG GLU 829 12.914 -11.279 3.116 140 HA GLU 830 HA GLU 830 14.901 -4.262 2.788 141 1HB GLU 830 1HB GLU 830 16.928 -5.830 3.493 142 2HB GLU 830 2HB GLU 830 16.861 -6.304 1.795 143 1HG GLU 830 1HG GLU 830 18.223 -4.485 1.532 144 2HG GLU 830 2HG GLU 830 16.687 -3.617 1.522 145 HA GLU 831 HA GLU 831 12.896 -5.773 -0.944 146 1HB GLU 831 1HB GLU 831 13.347 -8.049 -1.863 147 2HB GLU 831 2HB GLU 831 14.751 -7.377 -1.033 148 1HG GLU 831 1HG GLU 831 14.702 -8.966 0.588 149 2HG GLU 831 2HG GLU 831 12.946 -8.893 0.733 150 1HA GLY 832 1HA GLY 832 9.165 -8.260 -0.057 151 2HA GLY 832 2HA GLY 832 8.769 -7.432 -1.564 152 HA GLN 833 HA GLN 833 8.792 -11.558 -3.196 153 1HB GLN 833 1HB GLN 833 7.731 -13.363 -1.850 154 2HB GLN 833 2HB GLN 833 8.778 -12.352 -0.851 155 1HG GLN 833 1HG GLN 833 6.783 -11.009 -0.188 156 2HG GLN 833 2HG GLN 833 5.766 -12.127 -1.096 157 2HE2 GLN 833 1HE2 GLN 833 6.842 -14.613 -0.442 158 1HE2 GLN 833 2HE2 GLN 833 6.727 -14.879 1.230 159 HA GLU 834 HA GLU 834 4.998 -11.063 -5.405 160 1HB GLU 834 1HB GLU 834 3.975 -10.639 -3.197 161 2HB GLU 834 2HB GLU 834 4.346 -8.923 -3.341 162 1HG GLU 834 1HG GLU 834 2.434 -8.577 -4.471 163 2HG GLU 834 2HG GLU 834 2.923 -9.747 -5.693 164 HA ASN 835 HA ASN 835 6.625 -7.704 -7.962 165 1HB ASN 835 1HB ASN 835 4.509 -8.753 -9.817 166 2HB ASN 835 2HB ASN 835 6.063 -8.048 -10.210 167 2HD2 ASN 835 1HD2 ASN 835 8.022 -9.462 -9.402 168 1HD2 ASN 835 2HD2 ASN 835 7.861 -11.136 -9.629 169 HA VAL 836 HA VAL 836 2.876 -5.429 -7.437 170 HB VAL 836 HB VAL 836 3.953 -5.619 -5.279 171 1HG1 VAL 836 1HG1 VAL 836 5.910 -3.783 -6.582 172 2HG1 VAL 836 2HG1 VAL 836 5.687 -3.657 -4.843 173 3HG1 VAL 836 3HG1 VAL 836 6.195 -5.185 -5.557 174 1HG2 VAL 836 1HG2 VAL 836 3.376 -2.709 -5.908 175 2HG2 VAL 836 2HG2 VAL 836 2.212 -3.902 -5.331 176 3HG2 VAL 836 3HG2 VAL 836 3.530 -3.376 -4.284 177 HA GLU 837 HA GLU 837 3.899 -1.686 -9.691 178 1HB GLU 837 1HB GLU 837 2.450 -3.448 -11.175 179 2HB GLU 837 2HB GLU 837 1.279 -2.148 -11.004 180 1HG GLU 837 1HG GLU 837 3.623 -0.791 -11.574 181 2HG GLU 837 2HG GLU 837 3.759 -2.238 -12.572 182 HA ILE 838 HA ILE 838 0.195 0.483 -8.115 183 HB ILE 838 HB ILE 838 2.768 1.259 -7.690 184 1HG1 ILE 838 1HG1 ILE 838 1.098 3.089 -6.254 185 2HG1 ILE 838 2HG1 ILE 838 0.255 1.550 -6.415 186 1HG2 ILE 838 1HG2 ILE 838 2.278 3.085 -9.493 187 2HG2 ILE 838 2HG2 ILE 838 1.413 3.884 -8.178 188 3HG2 ILE 838 3HG2 ILE 838 3.133 3.531 -8.019 189 1HD1 ILE 838 2HD1 ILE 838 2.483 0.465 -5.696 190 2HD1 ILE 838 3HD1 ILE 838 2.955 2.081 -5.180 191 3HD1 ILE 838 1HD1 ILE 838 1.558 1.295 -4.450 192 HA LEU 839 HA LEU 839 -1.117 4.035 -10.670 193 1HB LEU 839 1HB LEU 839 -2.027 1.345 -11.098 194 2HB LEU 839 2HB LEU 839 -3.411 2.423 -11.270 195 HG LEU 839 HG LEU 839 -1.495 3.813 -12.642 196 1HD1 LEU 839 1HD1 LEU 839 -0.707 0.964 -12.548 197 2HD1 LEU 839 2HD1 LEU 839 -0.767 1.662 -14.167 198 3HD1 LEU 839 3HD1 LEU 839 0.261 2.389 -12.932 199 1HD2 LEU 839 1HD2 LEU 839 -3.807 2.138 -13.247 200 2HD2 LEU 839 2HD2 LEU 839 -3.302 3.652 -13.995 201 3HD2 LEU 839 3HD2 LEU 839 -2.636 2.122 -14.565 202 HA PRO 840 HA PRO 840 -4.251 6.132 -8.354 203 1HB PRO 840 1HB PRO 840 -4.955 7.680 -9.841 204 2HB PRO 840 2HB PRO 840 -6.097 6.515 -10.519 205 1HG PRO 840 1HG PRO 840 -3.694 7.519 -11.718 206 2HG PRO 840 2HG PRO 840 -4.799 6.308 -12.373 207 1HD PRO 840 1HD PRO 840 -3.197 4.717 -12.045 208 2HD PRO 840 2HD PRO 840 -2.132 5.916 -11.270 209 HA SER 841 HA SER 841 -6.906 2.708 -7.334 210 1HB SER 841 1HB SER 841 -8.705 3.624 -5.760 211 2HB SER 841 2HB SER 841 -7.046 3.892 -5.257 212 HG SER 841 HG SER 841 -7.239 5.978 -5.677 213 1HA GLY 842 1HA GLY 842 -11.037 2.838 -9.124 214 2HA GLY 842 2HA GLY 842 -9.970 3.417 -10.398 215 HA GLU 843 HA GLU 843 -8.161 -0.993 -11.550 216 1HB GLU 843 1HB GLU 843 -10.164 -1.128 -9.688 217 2HB GLU 843 2HB GLU 843 -11.056 -1.514 -11.160 218 1HG GLU 843 1HG GLU 843 -8.477 -2.891 -11.028 219 2HG GLU 843 2HG GLU 843 -9.529 -3.301 -9.673 220 HA ARG 844 HA ARG 844 -9.616 1.011 -15.370 221 1HB ARG 844 1HB ARG 844 -7.138 -0.392 -15.459 222 2HB ARG 844 2HB ARG 844 -8.100 -0.929 -16.834 223 1HG ARG 844 1HG ARG 844 -8.579 1.724 -16.974 224 2HG ARG 844 2HG ARG 844 -7.222 0.955 -17.798 225 1HD ARG 844 1HD ARG 844 -7.230 2.649 -15.323 226 2HD ARG 844 2HD ARG 844 -6.016 1.362 -15.453 227 HE ARG 844 HE ARG 844 -5.216 2.393 -17.524 228 1HH1 ARG 844 1HH1 ARG 844 -8.151 3.760 -17.507 229 2HH1 ARG 844 2HH1 ARG 844 -7.642 5.414 -17.551 230 1HH2 ARG 844 1HH2 ARG 844 -4.324 4.688 -16.848 231 2HH2 ARG 844 2HH2 ARG 844 -5.474 5.940 -17.180 232 HA PRO 845 HA PRO 845 -12.901 -1.966 -15.939 233 1HB PRO 845 1HB PRO 845 -13.739 -0.512 -18.277 234 2HB PRO 845 2HB PRO 845 -14.457 -0.481 -16.665 235 1HG PRO 845 1HG PRO 845 -12.947 1.586 -17.951 236 2HG PRO 845 2HG PRO 845 -13.646 1.604 -16.330 237 1HD PRO 845 1HD PRO 845 -11.560 1.441 -15.425 238 2HD PRO 845 2HD PRO 845 -10.855 1.393 -17.060 239 HA GLN 846 HA GLN 846 -11.343 -4.612 -19.110 240 1HB GLN 846 1HB GLN 846 -9.376 -3.767 -20.403 241 2HB GLN 846 2HB GLN 846 -10.567 -2.501 -20.114 242 1HG GLN 846 1HG GLN 846 -9.156 -2.013 -17.968 243 2HG GLN 846 2HG GLN 846 -7.888 -2.904 -18.808 244 2HE2 GLN 846 1HE2 GLN 846 -6.613 -1.662 -20.187 245 1HE2 GLN 846 2HE2 GLN 846 -7.071 -0.168 -20.854 246 HA ALA 847 HA ALA 847 -7.559 -6.181 -16.883 247 1HB ALA 847 1HB ALA 847 -7.081 -3.423 -15.922 248 2HB ALA 847 2HB ALA 847 -6.398 -4.683 -14.894 249 3HB ALA 847 3HB ALA 847 -5.940 -4.588 -16.595 250 HA ASN 848 HA ASN 848 -10.189 -6.141 -12.920 251 1HB ASN 848 1HB ASN 848 -12.076 -5.150 -14.402 252 2HB ASN 848 2HB ASN 848 -12.532 -6.828 -14.696 253 2HD2 ASN 848 1HD2 ASN 848 -12.912 -8.178 -12.639 254 1HD2 ASN 848 2HD2 ASN 848 -13.583 -7.388 -11.294 255 HA GLN 849 HA GLN 849 -10.235 -10.579 -13.430 256 1HB GLN 849 1HB GLN 849 -7.621 -11.329 -13.431 257 2HB GLN 849 2HB GLN 849 -8.459 -10.749 -14.857 258 1HG GLN 849 1HG GLN 849 -7.670 -8.392 -14.084 259 2HG GLN 849 2HG GLN 849 -6.506 -9.469 -14.839 260 2HE2 GLN 849 1HE2 GLN 849 -4.754 -8.339 -13.672 261 1HE2 GLN 849 2HE2 GLN 849 -4.497 -8.621 -12.022 262 HA LYS 850 HA LYS 850 -7.650 -11.322 -9.291 263 1HB LYS 850 1HB LYS 850 -9.383 -12.888 -8.387 264 2HB LYS 850 2HB LYS 850 -10.098 -11.525 -9.241 265 1HG LYS 850 1HG LYS 850 -9.904 -13.199 -11.315 266 2HG LYS 850 2HG LYS 850 -11.286 -13.254 -10.219 267 1HD LYS 850 1HD LYS 850 -8.947 -15.116 -10.433 268 2HD LYS 850 2HD LYS 850 -9.692 -14.884 -8.851 269 1HE LYS 850 1HE LYS 850 -11.855 -15.203 -10.635 270 2HE LYS 850 2HE LYS 850 -11.251 -16.410 -9.482 271 1HZ LYS 850 1HZ LYS 850 -10.063 -15.932 -12.167 272 2HZ LYS 850 2HZ LYS 850 -9.707 -17.203 -11.096 273 3HZ LYS 850 3HZ LYS 850 -11.221 -17.134 -11.866 274 HA ARG 851 HA ARG 851 -6.360 -15.744 -9.375 275 1HB ARG 851 1HB ARG 851 -4.865 -13.599 -10.472 276 2HB ARG 851 2HB ARG 851 -3.720 -14.623 -9.607 277 1HG ARG 851 1HG ARG 851 -5.203 -16.527 -10.839 278 2HG ARG 851 2HG ARG 851 -5.348 -15.221 -12.015 279 1HD ARG 851 1HD ARG 851 -2.604 -15.474 -11.043 280 2HD ARG 851 2HD ARG 851 -3.182 -16.973 -11.798 281 HE ARG 851 HE ARG 851 -3.330 -14.295 -13.134 282 1HH1 ARG 851 1HH1 ARG 851 -5.086 -16.141 -14.480 283 2HH1 ARG 851 2HH1 ARG 851 -4.059 -16.966 -15.604 284 1HH2 ARG 851 1HH2 ARG 851 -1.123 -16.042 -14.007 285 2HH2 ARG 851 2HH2 ARG 851 -1.816 -16.911 -15.337 286 HA ILE 852 HA ILE 852 -4.314 -15.651 -5.308 287 HB ILE 852 HB ILE 852 -1.875 -15.143 -5.177 288 1HG1 ILE 852 1HG1 ILE 852 -2.762 -12.996 -7.000 289 2HG1 ILE 852 2HG1 ILE 852 -1.313 -13.832 -7.533 290 1HG2 ILE 852 1HG2 ILE 852 -2.944 -16.880 -6.746 291 2HG2 ILE 852 2HG2 ILE 852 -2.663 -15.712 -8.037 292 3HG2 ILE 852 3HG2 ILE 852 -1.301 -16.366 -7.127 293 1HD1 ILE 852 1HD1 ILE 852 -0.730 -13.523 -4.905 294 2HD1 ILE 852 2HD1 ILE 852 -0.293 -12.333 -6.129 295 3HD1 ILE 852 3HD1 ILE 852 -1.743 -12.107 -5.154 296 HA THR 853 HA THR 853 -3.182 -11.398 -3.266 297 HB THR 853 HB THR 853 -4.183 -9.235 -4.027 298 HG1 THR 853 HG1 THR 853 -5.520 -10.987 -5.630 299 1HG2 THR 853 1HG2 THR 853 -1.933 -9.962 -4.765 300 2HG2 THR 853 2HG2 THR 853 -2.660 -10.751 -6.157 301 3HG2 THR 853 3HG2 THR 853 -2.749 -9.001 -5.996 302 HA THR 854 HA THR 854 -6.969 -12.336 -1.249 303 HB THR 854 HB THR 854 -5.234 -12.715 0.467 304 HG1 THR 854 HG1 THR 854 -6.490 -12.116 2.244 305 1HG2 THR 854 1HG2 THR 854 -5.270 -9.698 0.624 306 2HG2 THR 854 2HG2 THR 854 -4.659 -10.694 1.943 307 3HG2 THR 854 3HG2 THR 854 -3.889 -10.760 0.359 308 HA PRO 855 HA PRO 855 -9.119 -8.530 -1.926 309 1HB PRO 855 1HB PRO 855 -11.235 -9.327 -1.640 310 2HB PRO 855 2HB PRO 855 -11.064 -9.154 0.109 311 1HG PRO 855 1HG PRO 855 -11.152 -11.581 -1.411 312 2HG PRO 855 2HG PRO 855 -10.909 -11.411 0.329 313 1HD PRO 855 1HD PRO 855 -8.736 -12.090 0.056 314 2HD PRO 855 2HD PRO 855 -8.947 -12.129 -1.712 315 HA TYR 856 HA TYR 856 -7.678 -5.841 1.280 316 1HB TYR 856 1HB TYR 856 -8.120 -7.824 2.644 317 2HB TYR 856 2HB TYR 856 -6.540 -8.473 2.249 318 HD1 TYR 856 HD1 TYR 856 -4.479 -6.964 2.914 319 HD2 TYR 856 HD2 TYR 856 -8.414 -6.540 4.575 320 HE1 TYR 856 HE1 TYR 856 -3.526 -5.795 4.866 321 HE2 TYR 856 HE2 TYR 856 -7.459 -5.383 6.538 322 HH TYR 856 HH TYR 856 -4.421 -5.515 7.454 323 HA MET 857 HA MET 857 -3.757 -5.381 -0.945 324 1HB MET 857 1HB MET 857 -4.847 -3.153 -1.200 325 2HB MET 857 2HB MET 857 -4.400 -2.764 0.456 326 1HG MET 857 1HG MET 857 -1.975 -3.201 -0.237 327 2HG MET 857 2HG MET 857 -2.551 -3.205 -1.901 328 1HE MET 857 1HE MET 857 -3.798 -1.559 -2.957 329 2HE MET 857 2HE MET 857 -4.901 -0.850 -1.786 330 3HE MET 857 3HE MET 857 -3.774 0.181 -2.661 331 HA THR 858 HA THR 858 -1.421 -5.272 2.909 332 HB THR 858 HB THR 858 0.424 -6.894 2.494 333 HG1 THR 858 HG1 THR 858 0.599 -7.600 0.295 334 1HG2 THR 858 1HG2 THR 858 -2.018 -7.483 2.721 335 2HG2 THR 858 2HG2 THR 858 -2.115 -7.499 0.960 336 3HG2 THR 858 3HG2 THR 858 -1.076 -8.655 1.797 337 HA LYS 859 HA LYS 859 1.041 -1.761 3.561 338 1HB LYS 859 1HB LYS 859 2.988 -2.340 5.009 339 2HB LYS 859 2HB LYS 859 1.474 -3.041 5.579 340 1HG LYS 859 1HG LYS 859 3.028 -4.716 3.689 341 2HG LYS 859 2HG LYS 859 3.758 -4.476 5.274 342 1HD LYS 859 1HD LYS 859 1.114 -4.973 5.906 343 2HD LYS 859 2HD LYS 859 1.388 -6.041 4.530 344 1HE LYS 859 1HE LYS 859 3.570 -6.736 5.761 345 2HE LYS 859 2HE LYS 859 2.038 -7.327 6.434 346 1HZ LYS 859 1HZ LYS 859 3.369 -4.787 7.236 347 2HZ LYS 859 2HZ LYS 859 1.999 -5.491 7.956 348 3HZ LYS 859 3HZ LYS 859 3.517 -6.241 8.098 349 HA TYR 860 HA TYR 860 4.877 -2.980 0.986 350 1HB TYR 860 1HB TYR 860 4.870 -5.383 0.814 351 2HB TYR 860 2HB TYR 860 3.511 -5.360 -0.302 352 HD1 TYR 860 HD1 TYR 860 5.965 -2.672 -0.552 353 HD2 TYR 860 HD2 TYR 860 4.966 -6.594 -2.016 354 HE1 TYR 860 HE1 TYR 860 7.508 -2.342 -2.439 355 HE2 TYR 860 HE2 TYR 860 6.518 -6.249 -3.908 356 HH TYR 860 HH TYR 860 8.813 -3.747 -3.995 357 HA GLU 861 HA GLU 861 2.077 -2.266 -2.990 358 1HB GLU 861 1HB GLU 861 -0.362 -2.209 -1.178 359 2HB GLU 861 2HB GLU 861 -0.351 -2.088 -2.934 360 1HG GLU 861 1HG GLU 861 0.128 -4.511 -1.204 361 2HG GLU 861 2HG GLU 861 -0.983 -4.325 -2.556 362 HA ARG 862 HA ARG 862 1.075 1.599 -0.166 363 1HB ARG 862 1HB ARG 862 0.161 0.717 1.832 364 2HB ARG 862 2HB ARG 862 1.586 -0.264 2.150 365 1HG ARG 862 1HG ARG 862 2.109 2.640 1.993 366 2HG ARG 862 2HG ARG 862 1.107 2.154 3.353 367 1HD ARG 862 1HD ARG 862 3.080 0.222 3.385 368 2HD ARG 862 2HD ARG 862 3.970 1.677 2.898 369 HE ARG 862 HE ARG 862 2.312 2.549 4.953 370 1HH1 ARG 862 1HH1 ARG 862 2.748 -0.370 5.833 371 2HH1 ARG 862 2HH1 ARG 862 4.090 -0.180 6.912 372 1HH2 ARG 862 1HH2 ARG 862 4.882 3.003 5.788 373 2HH2 ARG 862 2HH2 ARG 862 5.297 1.731 6.887 374 HA ALA 863 HA ALA 863 5.680 1.460 1.177 375 1HB ALA 863 2HB ALA 863 6.669 -1.202 0.486 376 2HB ALA 863 3HB ALA 863 6.850 -0.304 1.993 377 3HB ALA 863 1HB ALA 863 5.398 -1.263 1.707 378 HA ARG 864 HA ARG 864 6.543 0.531 -3.361 379 1HB ARG 864 1HB ARG 864 4.394 -1.289 -3.266 380 2HB ARG 864 2HB ARG 864 3.941 -0.151 -4.533 381 1HG ARG 864 1HG ARG 864 5.218 -1.963 -5.517 382 2HG ARG 864 2HG ARG 864 6.522 -1.726 -4.354 383 1HD ARG 864 1HD ARG 864 5.997 0.794 -5.634 384 2HD ARG 864 2HD ARG 864 6.183 -0.445 -6.891 385 HE ARG 864 HE ARG 864 8.237 -1.079 -5.233 386 1HH1 ARG 864 1HH1 ARG 864 8.504 1.415 -3.871 387 2HH1 ARG 864 2HH1 ARG 864 9.438 2.407 -4.941 388 1HH2 ARG 864 1HH2 ARG 864 8.841 0.430 -7.725 389 2HH2 ARG 864 2HH2 ARG 864 9.628 1.850 -7.123 390 HA VAL 865 HA VAL 865 2.613 3.563 -4.080 391 HB VAL 865 HB VAL 865 2.162 2.303 -1.464 392 1HG1 VAL 865 1HG1 VAL 865 1.728 5.214 -1.792 393 2HG1 VAL 865 2HG1 VAL 865 0.534 4.266 -0.906 394 3HG1 VAL 865 3HG1 VAL 865 2.211 4.293 -0.366 395 1HG2 VAL 865 1HG2 VAL 865 0.711 2.995 -3.870 396 2HG2 VAL 865 2HG2 VAL 865 0.549 1.609 -2.793 397 3HG2 VAL 865 3HG2 VAL 865 -0.232 3.136 -2.385 398 HA LEU 866 HA LEU 866 4.717 6.266 -0.572 399 1HB LEU 866 1HB LEU 866 4.900 5.055 1.393 400 2HB LEU 866 2HB LEU 866 5.371 3.586 0.548 401 HG LEU 866 HG LEU 866 7.367 5.800 0.551 402 1HD1 LEU 866 1HD1 LEU 866 6.576 4.227 3.013 403 2HD1 LEU 866 2HD1 LEU 866 8.147 5.008 2.836 404 3HD1 LEU 866 3HD1 LEU 866 6.676 5.980 2.842 405 1HD2 LEU 866 1HD2 LEU 866 7.443 3.278 -0.322 406 2HD2 LEU 866 2HD2 LEU 866 8.870 4.050 0.363 407 3HD2 LEU 866 3HD2 LEU 866 7.893 2.966 1.353 408 1HA GLY 867 1HA GLY 867 8.785 4.916 -2.626 409 2HA GLY 867 2HA GLY 867 8.226 3.460 -3.455 410 HA THR 868 HA THR 868 6.905 5.914 -6.756 411 HB THR 868 HB THR 868 5.027 3.991 -6.628 412 HG1 THR 868 HG1 THR 868 4.465 4.800 -8.754 413 1HG2 THR 868 1HG2 THR 868 3.552 5.856 -5.518 414 2HG2 THR 868 2HG2 THR 868 3.423 6.481 -7.160 415 3HG2 THR 868 3HG2 THR 868 2.842 4.861 -6.784 416 HA ARG 869 HA ARG 869 4.231 9.215 -4.735 417 1HB ARG 869 1HB ARG 869 3.810 7.391 -2.582 418 2HB ARG 869 2HB ARG 869 4.497 8.848 -1.864 419 1HG ARG 869 1HG ARG 869 2.731 10.036 -3.467 420 2HG ARG 869 2HG ARG 869 2.265 9.445 -1.872 421 1HD ARG 869 1HD ARG 869 2.099 7.590 -4.242 422 2HD ARG 869 2HD ARG 869 1.131 7.596 -2.755 423 HE ARG 869 HE ARG 869 0.011 9.649 -3.597 424 1HH1 ARG 869 1HH1 ARG 869 0.681 7.169 -5.690 425 2HH1 ARG 869 2HH1 ARG 869 0.508 8.089 -7.148 426 1HH2 ARG 869 1HH2 ARG 869 0.341 11.143 -5.515 427 2HH2 ARG 869 2HH2 ARG 869 0.316 10.338 -7.049 428 HA ALA 870 HA ALA 870 8.189 10.031 -1.894 429 1HB ALA 870 3HB ALA 870 8.692 7.834 -1.094 430 2HB ALA 870 2HB ALA 870 10.113 8.341 -2.008 431 3HB ALA 870 1HB ALA 870 8.949 7.231 -2.732 432 HA LEU 871 HA LEU 871 10.430 10.253 -5.949 433 1HB LEU 871 1HB LEU 871 9.188 9.106 -8.251 434 2HB LEU 871 2HB LEU 871 10.729 8.670 -7.528 435 HG LEU 871 HG LEU 871 8.250 7.576 -6.278 436 1HD1 LEU 871 1HD1 LEU 871 9.322 6.900 -8.990 437 2HD1 LEU 871 2HD1 LEU 871 8.621 5.632 -7.984 438 3HD1 LEU 871 3HD1 LEU 871 7.647 7.027 -8.453 439 1HD2 LEU 871 1HD2 LEU 871 11.111 6.717 -6.748 440 2HD2 LEU 871 2HD2 LEU 871 10.305 7.007 -5.207 441 3HD2 LEU 871 3HD2 LEU 871 9.887 5.588 -6.167 442 HA GLN 872 HA GLN 872 6.505 12.063 -8.284 443 1HB GLN 872 1HB GLN 872 5.216 10.830 -5.985 444 2HB GLN 872 2HB GLN 872 4.751 12.525 -6.107 445 1HG GLN 872 1HG GLN 872 4.599 11.656 -8.736 446 2HG GLN 872 2HG GLN 872 3.230 11.833 -7.640 447 2HE2 GLN 872 1HE2 GLN 872 5.276 9.518 -9.284 448 1HE2 GLN 872 2HE2 GLN 872 4.489 8.124 -8.719 449 HA ILE 873 HA ILE 873 7.075 15.474 -4.887 450 HB ILE 873 HB ILE 873 7.970 14.784 -2.508 451 1HG1 ILE 873 1HG1 ILE 873 6.430 12.398 -2.420 452 2HG1 ILE 873 2HG1 ILE 873 7.521 12.228 -3.785 453 1HG2 ILE 873 1HG2 ILE 873 5.253 14.692 -3.711 454 2HG2 ILE 873 2HG2 ILE 873 5.439 14.262 -2.014 455 3HG2 ILE 873 3HG2 ILE 873 5.942 15.851 -2.575 456 1HD1 ILE 873 1HD1 ILE 873 8.802 13.377 -1.425 457 2HD1 ILE 873 2HD1 ILE 873 8.198 11.739 -1.182 458 3HD1 ILE 873 3HD1 ILE 873 9.334 12.077 -2.482 459 HA ALA 874 HA ALA 874 11.598 14.037 -4.067 460 1HB ALA 874 1HB ALA 874 11.024 11.656 -5.813 461 2HB ALA 874 3HB ALA 874 11.577 11.659 -4.141 462 3HB ALA 874 2HB ALA 874 12.668 12.149 -5.433 463 HA MET 875 HA MET 875 11.785 15.593 -8.430 464 1HB MET 875 1HB MET 875 9.546 14.074 -9.045 465 2HB MET 875 2HB MET 875 8.955 15.716 -9.300 466 1HG MET 875 1HG MET 875 10.205 15.989 -11.166 467 2HG MET 875 2HG MET 875 11.639 15.308 -10.401 468 1HE MET 875 1HE MET 875 8.272 14.832 -11.545 469 2HE MET 875 2HE MET 875 8.573 14.009 -13.073 470 3HE MET 875 3HE MET 875 8.006 13.096 -11.667 471 HA CYS 876 HA CYS 876 9.286 18.972 -6.371 472 1HB CYS 876 1HB CYS 876 7.213 18.313 -8.488 473 2HB CYS 876 2HB CYS 876 7.111 19.792 -7.532 474 HG CYS 876 HG CYS 876 9.078 20.746 -8.748 475 HA ALA 877 HA ALA 877 5.696 16.325 -4.474 476 1HB ALA 877 3HB ALA 877 6.028 18.220 -3.242 477 2HB ALA 877 1HB ALA 877 5.380 19.274 -4.496 478 3HB ALA 877 2HB ALA 877 4.286 18.319 -3.494 479 HA PRO 878 HA PRO 878 2.020 16.474 -7.539 480 1HB PRO 878 1HB PRO 878 2.535 13.696 -8.055 481 2HB PRO 878 2HB PRO 878 2.632 15.040 -9.198 482 1HG PRO 878 1HG PRO 878 4.787 13.535 -8.052 483 2HG PRO 878 2HG PRO 878 4.881 14.843 -9.221 484 1HD PRO 878 1HD PRO 878 5.650 14.904 -6.461 485 2HD PRO 878 2HD PRO 878 5.684 16.237 -7.635 486 HA VAL 879 HA VAL 879 1.581 12.792 -4.162 487 HB VAL 879 HB VAL 879 3.578 14.666 -2.950 488 1HG1 VAL 879 1HG1 VAL 879 1.741 14.145 -1.208 489 2HG1 VAL 879 2HG1 VAL 879 2.411 12.522 -1.220 490 3HG1 VAL 879 3HG1 VAL 879 3.416 13.887 -0.767 491 1HG2 VAL 879 1HG2 VAL 879 3.744 12.237 -4.252 492 2HG2 VAL 879 2HG2 VAL 879 5.007 12.941 -3.266 493 3HG2 VAL 879 3HG2 VAL 879 3.894 11.785 -2.559 494 HA MET 880 HA MET 880 -1.685 15.327 -2.643 495 1HB MET 880 1HB MET 880 -1.674 12.649 -1.547 496 2HB MET 880 2HB MET 880 -2.534 13.748 -0.469 497 1HG MET 880 1HG MET 880 -4.111 12.857 -2.102 498 2HG MET 880 2HG MET 880 -3.851 14.568 -2.435 499 1HE MET 880 1HE MET 880 -4.918 14.255 -4.603 500 2HE MET 880 2HE MET 880 -3.542 15.339 -4.860 501 3HE MET 880 3HE MET 880 -3.915 14.087 -6.042 502 HA VAL 881 HA VAL 881 -0.057 17.386 0.952 503 HB VAL 881 HB VAL 881 1.730 16.512 2.519 504 1HG1 VAL 881 1HG1 VAL 881 -0.816 15.463 1.966 505 2HG1 VAL 881 2HG1 VAL 881 0.222 14.046 2.114 506 3HG1 VAL 881 3HG1 VAL 881 0.125 15.208 3.435 507 1HG2 VAL 881 1HG2 VAL 881 2.796 15.309 0.336 508 2HG2 VAL 881 2HG2 VAL 881 3.105 14.766 1.985 509 3HG2 VAL 881 3HG2 VAL 881 1.880 13.961 1.008 510 HA GLU 882 HA GLU 882 3.564 19.322 -0.822 511 1HB GLU 882 1HB GLU 882 1.531 21.007 0.501 512 2HB GLU 882 2HB GLU 882 3.035 21.837 0.096 513 1HG GLU 882 1HG GLU 882 1.823 20.053 -1.974 514 2HG GLU 882 2HG GLU 882 1.059 21.616 -1.681 515 HA LEU 883 HA LEU 883 5.993 19.404 3.195 516 1HB LEU 883 1HB LEU 883 6.523 17.104 2.508 517 2HB LEU 883 2HB LEU 883 7.468 17.708 1.149 518 HG LEU 883 HG LEU 883 8.705 19.057 3.103 519 1HD1 LEU 883 1HD1 LEU 883 6.953 17.605 4.615 520 2HD1 LEU 883 2HD1 LEU 883 8.356 16.536 4.609 521 3HD1 LEU 883 3HD1 LEU 883 8.510 18.190 5.202 522 1HD2 LEU 883 1HD2 LEU 883 9.080 16.273 2.046 523 2HD2 LEU 883 2HD2 LEU 883 10.058 17.713 1.765 524 3HD2 LEU 883 3HD2 LEU 883 10.165 16.860 3.306 525 HA GLU 884 HA GLU 884 8.507 22.255 0.503 526 1HB GLU 884 1HB GLU 884 10.172 20.451 1.954 527 2HB GLU 884 2HB GLU 884 11.140 21.139 0.653 528 1HG GLU 884 1HG GLU 884 9.421 23.085 2.064 529 2HG GLU 884 2HG GLU 884 10.698 22.378 3.053 530 1HA GLY 885 1HA GLY 885 8.571 19.810 -3.805 531 2HA GLY 885 2HA GLY 885 10.071 20.691 -3.498 532 HA GLU 886 HA GLU 886 10.951 16.086 -1.740 533 1HB GLU 886 1HB GLU 886 11.631 16.305 -4.013 534 2HB GLU 886 2HB GLU 886 12.747 17.616 -3.632 535 1HG GLU 886 1HG GLU 886 14.072 15.958 -2.250 536 2HG GLU 886 2HG GLU 886 13.032 14.689 -2.897 537 HA THR 887 HA THR 887 14.565 16.631 0.863 538 HB THR 887 HB THR 887 11.954 17.347 2.242 539 HG1 THR 887 HG1 THR 887 12.415 19.001 1.013 540 1HG2 THR 887 1HG2 THR 887 14.780 17.523 3.327 541 2HG2 THR 887 2HG2 THR 887 13.408 18.386 4.022 542 3HG2 THR 887 3HG2 THR 887 13.430 16.623 4.017 543 HA ASP 888 HA ASP 888 13.059 13.193 3.626 544 1HB ASP 888 1HB ASP 888 10.793 14.515 3.924 545 2HB ASP 888 2HB ASP 888 10.147 13.125 3.055 546 HA PRO 889 HA PRO 889 13.106 10.096 0.437 547 1HB PRO 889 1HB PRO 889 13.103 7.973 2.375 548 2HB PRO 889 2HB PRO 889 14.480 8.629 1.487 549 1HG PRO 889 1HG PRO 889 13.945 8.903 4.267 550 2HG PRO 889 2HG PRO 889 15.241 9.673 3.346 551 1HD PRO 889 1HD PRO 889 14.219 11.680 3.694 552 2HD PRO 889 2HD PRO 889 12.805 10.878 4.423 553 HA LEU 890 HA LEU 890 8.590 9.341 1.100 554 1HB LEU 890 1HB LEU 890 8.153 7.253 2.258 555 2HB LEU 890 2HB LEU 890 9.838 7.276 1.773 556 HG LEU 890 HG LEU 890 9.786 6.426 4.008 557 1HD1 LEU 890 1HD1 LEU 890 11.496 8.239 3.505 558 2HD1 LEU 890 2HD1 LEU 890 10.448 9.346 4.392 559 3HD1 LEU 890 3HD1 LEU 890 11.156 7.955 5.211 560 1HD2 LEU 890 1HD2 LEU 890 7.438 7.699 4.317 561 2HD2 LEU 890 2HD2 LEU 890 8.392 7.118 5.682 562 3HD2 LEU 890 3HD2 LEU 890 8.480 8.813 5.204 563 HA LEU 891 HA LEU 891 7.423 11.125 5.613 564 1HB LEU 891 1HB LEU 891 8.691 13.034 5.881 565 2HB LEU 891 2HB LEU 891 8.720 13.349 4.158 566 HG LEU 891 HG LEU 891 7.466 15.043 5.557 567 1HD1 LEU 891 1HD1 LEU 891 6.965 14.226 2.999 568 2HD1 LEU 891 2HD1 LEU 891 5.374 14.037 3.738 569 3HD1 LEU 891 3HD1 LEU 891 6.179 15.601 3.773 570 1HD2 LEU 891 1HD2 LEU 891 6.264 12.758 6.618 571 2HD2 LEU 891 2HD2 LEU 891 5.781 14.428 6.914 572 3HD2 LEU 891 3HD2 LEU 891 5.008 13.501 5.630 573 HA ILE 892 HA ILE 892 4.385 13.023 2.370 574 HB ILE 892 HB ILE 892 6.730 12.590 0.634 575 1HG1 ILE 892 1HG1 ILE 892 4.627 14.584 0.051 576 2HG1 ILE 892 2HG1 ILE 892 5.465 14.742 1.594 577 1HG2 ILE 892 1HG2 ILE 892 3.974 11.936 -0.268 578 2HG2 ILE 892 2HG2 ILE 892 4.995 12.870 -1.346 579 3HG2 ILE 892 3HG2 ILE 892 5.524 11.285 -0.802 580 1HD1 ILE 892 1HD1 ILE 892 7.113 14.139 -0.786 581 2HD1 ILE 892 2HD1 ILE 892 6.453 15.766 -0.668 582 3HD1 ILE 892 3HD1 ILE 892 7.488 15.138 0.614 583 HA ALA 893 HA ALA 893 3.991 8.732 0.359 584 1HB ALA 893 3HB ALA 893 5.850 7.738 -0.456 585 2HB ALA 893 1HB ALA 893 6.845 8.364 0.857 586 3HB ALA 893 2HB ALA 893 5.906 6.896 1.087 587 HA MET 894 HA MET 894 3.934 7.063 4.797 588 1HB MET 894 1HB MET 894 6.064 7.581 5.719 589 2HB MET 894 2HB MET 894 5.832 9.312 5.500 590 1HG MET 894 1HG MET 894 4.129 9.311 7.290 591 2HG MET 894 2HG MET 894 4.361 7.577 7.510 592 1HE MET 894 1HE MET 894 6.043 10.716 6.860 593 2HE MET 894 2HE MET 894 6.614 11.199 8.453 594 3HE MET 894 3HE MET 894 7.719 10.415 7.316 595 HA LYS 895 HA LYS 895 1.760 11.102 6.498 596 1HB LYS 895 1HB LYS 895 3.214 12.901 5.987 597 2HB LYS 895 2HB LYS 895 3.224 12.515 4.267 598 1HG LYS 895 1HG LYS 895 1.271 13.619 3.869 599 2HG LYS 895 2HG LYS 895 0.575 13.167 5.423 600 1HD LYS 895 1HD LYS 895 2.903 15.003 5.543 601 2HD LYS 895 2HD LYS 895 1.426 15.681 4.855 602 1HE LYS 895 1HE LYS 895 0.449 14.335 7.055 603 2HE LYS 895 2HE LYS 895 2.008 14.943 7.645 604 1HZ LYS 895 1HZ LYS 895 0.037 16.583 6.143 605 2HZ LYS 895 2HZ LYS 895 0.181 16.588 7.836 606 3HZ LYS 895 3HZ LYS 895 1.470 17.127 6.875 607 HA GLU 896 HA GLU 896 -0.542 11.027 2.202 608 1HB GLU 896 1HB GLU 896 1.773 9.393 1.249 609 2HB GLU 896 2HB GLU 896 0.222 9.139 0.478 610 1HG GLU 896 1HG GLU 896 1.946 11.603 0.491 611 2HG GLU 896 2HG GLU 896 1.183 10.797 -0.870 612 HA LEU 897 HA LEU 897 -1.676 6.518 3.169 613 1HB LEU 897 1HB LEU 897 -0.311 4.701 3.345 614 2HB LEU 897 2HB LEU 897 0.363 5.302 4.865 615 HG LEU 897 HG LEU 897 1.824 6.799 3.617 616 1HD1 LEU 897 1HD1 LEU 897 1.954 3.988 3.722 617 2HD1 LEU 897 3HD1 LEU 897 3.278 5.150 3.685 618 3HD1 LEU 897 2HD1 LEU 897 2.633 4.500 2.176 619 1HD2 LEU 897 1HD2 LEU 897 -0.052 6.241 1.552 620 2HD2 LEU 897 2HD2 LEU 897 1.316 7.348 1.489 621 3HD2 LEU 897 3HD2 LEU 897 1.517 5.670 0.988 622 HA LYS 898 HA LYS 898 -0.694 7.166 7.971 623 1HB LYS 898 1HB LYS 898 1.551 8.174 7.573 624 2HB LYS 898 2HB LYS 898 0.749 9.613 6.946 625 1HG LYS 898 1HG LYS 898 -0.031 10.269 9.029 626 2HG LYS 898 2HG LYS 898 0.015 8.630 9.679 627 1HD LYS 898 1HD LYS 898 2.653 9.018 9.127 628 2HD LYS 898 2HD LYS 898 2.161 10.664 9.530 629 1HE LYS 898 1HE LYS 898 1.079 8.635 11.378 630 2HE LYS 898 2HE LYS 898 2.849 8.757 11.396 631 1HZ LYS 898 1HZ LYS 898 1.011 11.088 11.509 632 2HZ LYS 898 2HZ LYS 898 1.749 10.396 12.870 633 3HZ LYS 898 3HZ LYS 898 2.703 11.117 11.663 634 HA ALA 899 HA ALA 899 -3.433 10.780 6.868 635 1HB ALA 899 3HB ALA 899 -1.816 12.099 5.569 636 2HB ALA 899 2HB ALA 899 -3.407 12.237 4.822 637 3HB ALA 899 1HB ALA 899 -2.193 11.169 4.118 638 HA ARG 900 HA ARG 900 -4.512 6.860 3.457 639 1HB ARG 900 1HB ARG 900 -5.693 6.442 5.461 640 2HB ARG 900 2HB ARG 900 -6.135 8.139 5.664 641 1HG ARG 900 1HG ARG 900 -7.826 8.034 4.105 642 2HG ARG 900 2HG ARG 900 -7.094 6.674 3.252 643 1HD ARG 900 1HD ARG 900 -7.976 5.098 4.726 644 2HD ARG 900 2HD ARG 900 -8.005 6.238 6.085 645 HE ARG 900 HE ARG 900 -9.771 7.067 3.929 646 1HH1 ARG 900 1HH1 ARG 900 -10.049 4.118 5.226 647 2HH1 ARG 900 2HH1 ARG 900 -11.454 4.416 6.194 648 1HH2 ARG 900 1HH2 ARG 900 -11.317 7.860 5.804 649 2HH2 ARG 900 2HH2 ARG 900 -12.172 6.535 6.522 650 HA LYS 901 HA LYS 901 -6.053 10.706 1.522 651 1HB LYS 901 1HB LYS 901 -4.413 12.064 2.722 652 2HB LYS 901 2HB LYS 901 -3.133 11.483 1.658 653 1HG LYS 901 1HG LYS 901 -4.087 13.778 1.080 654 2HG LYS 901 2HG LYS 901 -4.070 12.603 -0.233 655 1HD LYS 901 1HD LYS 901 -6.345 12.405 -0.280 656 2HD LYS 901 2HD LYS 901 -6.503 12.622 1.463 657 1HE LYS 901 1HE LYS 901 -5.602 15.097 0.757 658 2HE LYS 901 2HE LYS 901 -6.534 14.662 -0.689 659 1HZ LYS 901 1HZ LYS 901 -8.335 13.926 0.829 660 2HZ LYS 901 2HZ LYS 901 -7.466 14.581 2.130 661 3HZ LYS 901 3HZ LYS 901 -8.038 15.597 0.894 662 HA ILE 902 HA ILE 902 -3.969 9.181 -2.236 663 HB ILE 902 HB ILE 902 -1.821 8.339 -2.676 664 1HG1 ILE 902 1HG1 ILE 902 -1.619 6.257 -1.579 665 2HG1 ILE 902 2HG1 ILE 902 -0.441 7.270 -0.763 666 1HG2 ILE 902 1HG2 ILE 902 -1.970 10.489 -1.394 667 2HG2 ILE 902 2HG2 ILE 902 -1.572 9.574 0.059 668 3HG2 ILE 902 3HG2 ILE 902 -0.417 9.660 -1.272 669 1HD1 ILE 902 1HD1 ILE 902 -3.246 6.767 0.269 670 2HD1 ILE 902 2HD1 ILE 902 -1.815 5.895 0.806 671 3HD1 ILE 902 3HD1 ILE 902 -1.951 7.626 1.102 672 HA PRO 903 HA PRO 903 -6.190 5.086 -1.691 673 1HB PRO 903 1HB PRO 903 -8.363 5.757 -1.917 674 2HB PRO 903 2HB PRO 903 -8.059 6.130 -3.616 675 1HG PRO 903 1HG PRO 903 -8.504 7.973 -1.461 676 2HG PRO 903 2HG PRO 903 -8.167 8.347 -3.154 677 1HD PRO 903 1HD PRO 903 -6.097 9.102 -2.553 678 2HD PRO 903 2HD PRO 903 -6.416 8.643 -0.863 679 HA ILE 904 HA ILE 904 -5.270 4.275 -5.986 680 HB ILE 904 HB ILE 904 -3.036 4.851 -4.272 681 1HG1 ILE 904 1HG1 ILE 904 -2.860 5.295 -7.185 682 2HG1 ILE 904 2HG1 ILE 904 -4.311 5.936 -6.421 683 1HG2 ILE 904 1HG2 ILE 904 -2.636 2.762 -6.379 684 2HG2 ILE 904 2HG2 ILE 904 -1.400 3.995 -6.157 685 3HG2 ILE 904 3HG2 ILE 904 -1.847 2.946 -4.815 686 1HD1 ILE 904 1HD1 ILE 904 -1.758 6.435 -4.988 687 2HD1 ILE 904 2HD1 ILE 904 -1.982 7.305 -6.506 688 3HD1 ILE 904 3HD1 ILE 904 -3.153 7.491 -5.201 689 HA ILE 905 HA ILE 905 -5.355 -0.059 -6.359 690 HB ILE 905 HB ILE 905 -6.488 0.891 -8.345 691 1HG1 ILE 905 1HG1 ILE 905 -4.993 -1.063 -9.838 692 2HG1 ILE 905 2HG1 ILE 905 -5.158 -1.617 -8.172 693 1HG2 ILE 905 1HG2 ILE 905 -3.671 0.990 -9.468 694 2HG2 ILE 905 2HG2 ILE 905 -5.131 1.190 -10.435 695 3HG2 ILE 905 3HG2 ILE 905 -4.740 2.357 -9.178 696 1HD1 ILE 905 1HD1 ILE 905 -7.503 -0.511 -9.697 697 2HD1 ILE 905 2HD1 ILE 905 -7.058 -2.213 -9.803 698 3HD1 ILE 905 3HD1 ILE 905 -7.516 -1.513 -8.248 699 HA ILE 906 HA ILE 906 -1.081 -1.029 -7.559 700 HB ILE 906 HB ILE 906 -2.019 -1.950 -4.868 701 1HG1 ILE 906 1HG1 ILE 906 0.219 -0.232 -5.951 702 2HG1 ILE 906 2HG1 ILE 906 0.086 -0.651 -4.243 703 1HG2 ILE 906 1HG2 ILE 906 0.351 -3.079 -6.316 704 2HG2 ILE 906 2HG2 ILE 906 0.485 -2.756 -4.589 705 3HG2 ILE 906 3HG2 ILE 906 -0.747 -3.867 -5.184 706 1HD1 ILE 906 1HD1 ILE 906 -2.470 0.183 -4.833 707 2HD1 ILE 906 2HD1 ILE 906 -1.227 1.194 -4.097 708 3HD1 ILE 906 3HD1 ILE 906 -1.491 1.246 -5.837 709 HA ARG 907 HA ARG 907 -1.824 -5.162 -9.072 710 1HB ARG 907 1HB ARG 907 0.515 -3.929 -10.502 711 2HB ARG 907 2HB ARG 907 -0.090 -5.527 -10.917 712 1HG ARG 907 1HG ARG 907 -1.172 -3.913 -12.358 713 2HG ARG 907 2HG ARG 907 -2.356 -4.548 -11.221 714 1HD ARG 907 1HD ARG 907 -2.677 -2.512 -10.237 715 2HD ARG 907 2HD ARG 907 -0.943 -2.129 -10.267 716 HE ARG 907 HE ARG 907 -1.188 -1.294 -12.506 717 1HH1 ARG 907 1HH1 ARG 907 -3.488 -3.564 -12.708 718 2HH1 ARG 907 2HH1 ARG 907 -4.767 -2.552 -13.289 719 1HH2 ARG 907 1HH2 ARG 907 -3.087 0.406 -12.624 720 2HH2 ARG 907 2HH2 ARG 907 -4.540 -0.305 -13.241 721 HA ARG 908 HA ARG 908 1.394 -7.153 -6.723 722 1HB ARG 908 1HB ARG 908 -0.642 -9.018 -5.715 723 2HB ARG 908 2HB ARG 908 0.482 -8.021 -4.817 724 1HG ARG 908 1HG ARG 908 -1.056 -6.060 -5.171 725 2HG ARG 908 2HG ARG 908 -2.212 -7.155 -5.924 726 1HD ARG 908 1HD ARG 908 -2.235 -8.520 -3.778 727 2HD ARG 908 2HD ARG 908 -2.808 -6.859 -3.517 728 HE ARG 908 HE ARG 908 -0.610 -6.340 -2.570 729 1HH1 ARG 908 1HH1 ARG 908 1.644 -7.415 -2.901 730 2HH1 ARG 908 2HH1 ARG 908 1.733 -8.988 -2.182 731 1HH2 ARG 908 1HH2 ARG 908 -1.704 -9.328 -1.869 732 2HH2 ARG 908 2HH2 ARG 908 -0.164 -10.071 -1.598 733 HA TYR 909 HA TYR 909 0.933 -10.472 -9.755 734 1HB TYR 909 1HB TYR 909 3.705 -9.716 -10.553 735 2HB TYR 909 2HB TYR 909 2.402 -10.311 -11.542 736 HD1 TYR 909 HD1 TYR 909 3.574 -7.220 -9.738 737 HD2 TYR 909 HD2 TYR 909 1.076 -8.872 -12.797 738 HE1 TYR 909 HE1 TYR 909 3.156 -4.966 -10.605 739 HE2 TYR 909 HE2 TYR 909 0.638 -6.614 -13.665 740 HH TYR 909 HH TYR 909 2.379 -4.110 -13.217 741 HA LEU 910 HA LEU 910 4.183 -12.747 -7.626 742 1HB LEU 910 1HB LEU 910 2.298 -14.585 -9.095 743 2HB LEU 910 2HB LEU 910 3.262 -15.076 -7.701 744 HG LEU 910 HG LEU 910 1.080 -12.977 -7.803 745 1HD1 LEU 910 1HD1 LEU 910 1.356 -15.770 -6.840 746 2HD1 LEU 910 2HD1 LEU 910 0.438 -14.673 -5.815 747 3HD1 LEU 910 3HD1 LEU 910 -0.051 -14.934 -7.485 748 1HD2 LEU 910 1HD2 LEU 910 3.354 -13.245 -6.002 749 2HD2 LEU 910 2HD2 LEU 910 2.145 -11.967 -6.092 750 3HD2 LEU 910 3HD2 LEU 910 1.826 -13.413 -5.141 751 HA PRO 911 HA PRO 911 7.330 -13.711 -10.684 752 1HB PRO 911 1HB PRO 911 9.060 -14.307 -8.462 753 2HB PRO 911 2HB PRO 911 9.081 -12.866 -9.482 754 1HG PRO 911 1HG PRO 911 8.256 -13.060 -6.746 755 2HG PRO 911 2HG PRO 911 8.242 -11.629 -7.780 756 1HD PRO 911 1HD PRO 911 5.963 -11.713 -7.850 757 2HD PRO 911 2HD PRO 911 5.976 -13.188 -6.862 758 HA ASP 912 HA ASP 912 7.159 -18.011 -8.488 759 1HB ASP 912 1HB ASP 912 4.821 -16.814 -7.089 760 2HB ASP 912 2HB ASP 912 4.751 -18.556 -7.356 761 1HA GLY 913 1HA GLY 913 3.979 -17.436 -12.269 762 2HA GLY 913 2HA GLY 913 3.745 -18.966 -11.427 763 HA SER 914 HA SER 914 -0.143 -16.203 -11.493 764 1HB SER 914 1HB SER 914 0.837 -16.431 -8.653 765 2HB SER 914 2HB SER 914 -0.807 -15.901 -8.996 766 HG SER 914 HG SER 914 -0.526 -18.214 -8.705 767 HA TYR 915 HA TYR 915 0.058 -11.973 -9.368 768 1HB TYR 915 1HB TYR 915 1.025 -11.445 -11.370 769 2HB TYR 915 2HB TYR 915 0.052 -12.624 -12.230 770 HD1 TYR 915 HD1 TYR 915 -0.313 -9.240 -10.617 771 HD2 TYR 915 HD2 TYR 915 -1.467 -11.863 -13.816 772 HE1 TYR 915 HE1 TYR 915 -1.636 -7.413 -11.638 773 HE2 TYR 915 HE2 TYR 915 -2.788 -10.033 -14.839 774 HH TYR 915 HH TYR 915 -2.577 -7.304 -14.675 775 HA GLU 916 HA GLU 916 -4.219 -10.314 -10.169 776 1HB GLU 916 1HB GLU 916 -3.454 -11.321 -7.705 777 2HB GLU 916 2HB GLU 916 -4.045 -9.706 -7.320 778 1HG GLU 916 1HG GLU 916 -5.650 -11.419 -9.174 779 2HG GLU 916 2HG GLU 916 -5.723 -11.736 -7.442 780 HA ASP 917 HA ASP 917 -3.485 -5.939 -9.406 781 1HB ASP 917 1HB ASP 917 -4.400 -4.762 -11.365 782 2HB ASP 917 2HB ASP 917 -3.532 -6.213 -11.809 783 HA TRP 918 HA TRP 918 -6.841 -3.092 -8.272 784 1HB TRP 918 1HB TRP 918 -8.107 -4.341 -6.503 785 2HB TRP 918 2HB TRP 918 -8.140 -5.077 -8.087 786 HD1 TRP 918 HD1 TRP 918 -4.859 -6.098 -6.969 787 HE1 TRP 918 HE1 TRP 918 -4.975 -8.451 -5.916 788 HE3 TRP 918 HE3 TRP 918 -9.786 -6.284 -5.997 789 HZ2 TRP 918 HZ2 TRP 918 -6.963 -10.136 -4.662 790 HZ3 TRP 918 HZ3 TRP 918 -10.794 -8.152 -4.796 791 HH2 TRP 918 HH2 TRP 918 -9.407 -10.126 -4.131 792 1HA GLY 919 1HA GLY 919 -5.036 -2.817 -4.031 793 2HA GLY 919 2HA GLY 919 -5.003 -1.247 -4.817 794 HA VAL 920 HA VAL 920 -8.093 -0.387 -1.816 795 HB VAL 920 HB VAL 920 -7.271 2.207 -3.164 796 1HG1 VAL 920 1HG1 VAL 920 -8.646 1.565 -0.553 797 2HG1 VAL 920 2HG1 VAL 920 -7.695 3.039 -0.737 798 3HG1 VAL 920 3HG1 VAL 920 -9.099 2.761 -1.767 799 1HG2 VAL 920 1HG2 VAL 920 -6.056 0.431 -1.056 800 2HG2 VAL 920 2HG2 VAL 920 -5.289 1.160 -2.465 801 3HG2 VAL 920 3HG2 VAL 920 -5.700 2.158 -1.075 802 HA ASP 921 HA ASP 921 -11.228 1.122 -4.923 803 1HB ASP 921 1HB ASP 921 -9.714 1.451 -6.857 804 2HB ASP 921 2HB ASP 921 -9.786 -0.279 -7.194 805 HA GLU 922 HA GLU 922 -12.597 -3.211 -4.826 806 1HB GLU 922 1HB GLU 922 -10.835 -3.510 -6.720 807 2HB GLU 922 2HB GLU 922 -10.015 -4.558 -5.565 808 1HG GLU 922 1HG GLU 922 -12.153 -5.859 -5.311 809 2HG GLU 922 2HG GLU 922 -11.486 -5.933 -6.943 810 HA LEU 923 HA LEU 923 -10.614 -4.388 -0.880 811 1HB LEU 923 1HB LEU 923 -8.244 -5.407 -0.819 812 2HB LEU 923 2HB LEU 923 -9.341 -5.958 -2.068 813 HG LEU 923 HG LEU 923 -8.039 -3.683 -3.129 814 1HD1 LEU 923 1HD1 LEU 923 -6.113 -5.671 -1.898 815 2HD1 LEU 923 2HD1 LEU 923 -5.684 -4.426 -3.073 816 3HD1 LEU 923 3HD1 LEU 923 -6.255 -3.969 -1.470 817 1HD2 LEU 923 1HD2 LEU 923 -8.389 -6.527 -3.570 818 2HD2 LEU 923 2HD2 LEU 923 -8.412 -5.179 -4.713 819 3HD2 LEU 923 3HD2 LEU 923 -6.877 -5.895 -4.223 820 HA ILE 924 HA ILE 924 -8.281 -1.922 1.914 821 HB ILE 924 HB ILE 924 -6.901 -4.517 1.992 822 1HG1 ILE 924 1HG1 ILE 924 -7.563 -4.064 4.451 823 2HG1 ILE 924 2HG1 ILE 924 -8.436 -2.691 3.777 824 1HG2 ILE 924 1HG2 ILE 924 -4.924 -3.064 2.219 825 2HG2 ILE 924 2HG2 ILE 924 -5.719 -2.218 3.545 826 3HG2 ILE 924 3HG2 ILE 924 -5.298 -3.919 3.709 827 1HD1 ILE 924 3HD1 ILE 924 -8.704 -5.544 2.821 828 2HD1 ILE 924 1HD1 ILE 924 -9.865 -4.708 3.849 829 3HD1 ILE 924 2HD1 ILE 924 -9.585 -4.151 2.198 830 HA ILE 925 HA ILE 925 -4.718 0.172 0.315 831 HB ILE 925 HB ILE 925 -4.446 2.160 1.802 832 1HG1 ILE 925 1HG1 ILE 925 -6.448 0.766 3.608 833 2HG1 ILE 925 2HG1 ILE 925 -4.723 0.853 3.954 834 1HG2 ILE 925 1HG2 ILE 925 -6.916 1.207 0.617 835 2HG2 ILE 925 2HG2 ILE 925 -7.249 2.263 1.988 836 3HG2 ILE 925 3HG2 ILE 925 -6.255 2.841 0.652 837 1HD1 ILE 925 1HD1 ILE 925 -6.161 3.392 3.304 838 2HD1 ILE 925 2HD1 ILE 925 -6.394 2.687 4.904 839 3HD1 ILE 925 3HD1 ILE 925 -4.775 3.131 4.364 840 HA THR 926 HA THR 926 -0.970 -0.621 2.714 841 HB THR 926 HB THR 926 -1.809 1.300 4.907 842 HG1 THR 926 HG1 THR 926 -1.504 2.715 3.412 843 1HG2 THR 926 1HG2 THR 926 0.860 0.095 4.148 844 2HG2 THR 926 2HG2 THR 926 0.686 1.468 5.240 845 3HG2 THR 926 3HG2 THR 926 -0.006 -0.096 5.671 846 HA ASP 927 HA ASP 927 -3.648 -3.416 5.401 847 1HB ASP 927 1HB ASP 927 -2.254 -1.366 6.934 848 2HB ASP 927 2HB ASP 927 -3.447 -2.194 7.935 No H/Q in entry = 848 Start of MODEL 6 1 H1 MET 801 H1 MET 801 59.799 -20.529 14.316 2 H2 MET 801 H2 MET 801 59.005 -21.832 15.065 3 H3 MET 801 H3 MET 801 59.730 -22.036 13.542 4 HA MET 801 HA MET 801 58.124 -20.628 12.491 5 1HB MET 801 1HB MET 801 57.209 -22.786 14.390 6 2HB MET 801 2HB MET 801 56.061 -22.002 13.304 7 1HG MET 801 1HG MET 801 58.644 -23.031 12.180 8 2HG MET 801 2HG MET 801 57.348 -24.176 12.528 9 1HE MET 801 1HE MET 801 55.770 -24.778 11.335 10 2HE MET 801 2HE MET 801 55.056 -24.106 9.871 11 3HE MET 801 3HE MET 801 56.660 -24.852 9.817 12 HA SER 802 HA SER 802 56.765 -18.164 16.293 13 1HB SER 802 1HB SER 802 58.097 -15.951 16.306 14 2HB SER 802 2HB SER 802 58.974 -17.412 16.750 15 HG SER 802 HG SER 802 60.176 -17.152 15.051 16 HA ASP 803 HA ASP 803 55.238 -14.725 13.486 17 1HB ASP 803 1HB ASP 803 57.779 -14.604 11.835 18 2HB ASP 803 2HB ASP 803 56.408 -13.513 11.631 19 HA ASN 804 HA ASN 804 53.906 -16.907 9.789 20 1HB ASN 804 1HB ASN 804 55.163 -18.603 11.400 21 2HB ASN 804 2HB ASN 804 53.533 -19.228 11.653 22 2HD2 ASN 804 1HD2 ASN 804 53.344 -21.050 10.330 23 1HD2 ASN 804 2HD2 ASN 804 53.797 -21.110 8.696 24 HA GLU 805 HA GLU 805 49.542 -17.222 10.749 25 1HB GLU 805 1HB GLU 805 49.894 -15.808 8.724 26 2HB GLU 805 2HB GLU 805 49.780 -17.256 7.723 27 1HG GLU 805 1HG GLU 805 47.496 -17.665 8.688 28 2HG GLU 805 2HG GLU 805 47.608 -16.180 7.741 29 HA ASP 806 HA ASP 806 48.566 -21.476 9.710 30 1HB ASP 806 1HB ASP 806 48.989 -20.991 12.326 31 2HB ASP 806 2HB ASP 806 47.268 -21.370 12.392 32 HA ASN 807 HA ASN 807 44.203 -20.164 9.007 33 1HB ASN 807 1HB ASN 807 45.266 -19.120 7.021 34 2HB ASN 807 2HB ASN 807 43.817 -20.013 6.566 35 2HD2 ASN 807 1HD2 ASN 807 44.300 -20.904 4.534 36 1HD2 ASN 807 2HD2 ASN 807 45.708 -21.782 4.178 37 HA PHE 808 HA PHE 808 43.624 -24.588 7.300 38 1HB PHE 808 1HB PHE 808 42.434 -23.915 9.328 39 2HB PHE 808 2HB PHE 808 41.129 -23.222 8.366 40 HD1 PHE 808 HD1 PHE 808 43.036 -26.463 8.408 41 HD2 PHE 808 HD2 PHE 808 39.204 -24.525 8.307 42 HE1 PHE 808 HE1 PHE 808 41.919 -28.677 8.334 43 HE2 PHE 808 HE2 PHE 808 38.087 -26.737 8.232 44 HZ PHE 808 HZ PHE 808 39.444 -28.813 8.246 45 HA ASP 809 HA ASP 809 40.622 -23.330 3.723 46 1HB ASP 809 1HB ASP 809 40.474 -25.805 5.101 47 2HB ASP 809 2HB ASP 809 38.894 -25.554 4.360 48 1HA GLY 810 1HA GLY 810 36.831 -21.830 6.745 49 2HA GLY 810 2HA GLY 810 36.381 -22.249 5.092 50 HA ASP 811 HA ASP 811 33.751 -24.946 7.590 51 1HB ASP 811 1HB ASP 811 36.256 -25.669 8.345 52 2HB ASP 811 2HB ASP 811 35.484 -25.557 9.927 53 HA ASP 812 HA ASP 812 31.989 -23.219 11.335 54 1HB ASP 812 1HB ASP 812 30.672 -24.859 12.652 55 2HB ASP 812 2HB ASP 812 30.694 -25.277 10.939 56 HA PHE 813 HA PHE 813 34.987 -23.972 14.743 57 1HB PHE 813 1HB PHE 813 36.521 -25.198 13.242 58 2HB PHE 813 2HB PHE 813 37.140 -23.668 12.623 59 HD1 PHE 813 HD1 PHE 813 36.503 -25.309 15.945 60 HD2 PHE 813 HD2 PHE 813 39.117 -22.878 13.555 61 HE1 PHE 813 HE1 PHE 813 38.119 -25.202 17.822 62 HE2 PHE 813 HE2 PHE 813 40.734 -22.771 15.433 63 HZ PHE 813 HZ PHE 813 40.235 -23.932 17.566 64 HA ASP 814 HA ASP 814 35.150 -19.393 14.586 65 1HB ASP 814 1HB ASP 814 37.480 -20.369 13.577 66 2HB ASP 814 2HB ASP 814 37.171 -19.060 12.437 67 HA ASP 815 HA ASP 815 33.263 -17.931 10.604 68 1HB ASP 815 1HB ASP 815 32.243 -20.156 10.270 69 2HB ASP 815 2HB ASP 815 31.053 -18.882 10.001 70 HA VAL 816 HA VAL 816 31.381 -14.893 13.300 71 HB VAL 816 HB VAL 816 29.677 -16.644 13.534 72 1HG1 VAL 816 1HG1 VAL 816 31.222 -18.232 14.763 73 2HG1 VAL 816 2HG1 VAL 816 30.935 -17.275 16.216 74 3HG1 VAL 816 3HG1 VAL 816 29.596 -18.118 15.438 75 1HG2 VAL 816 1HG2 VAL 816 29.598 -14.343 14.801 76 2HG2 VAL 816 2HG2 VAL 816 28.398 -15.579 15.178 77 3HG2 VAL 816 3HG2 VAL 816 29.784 -15.343 16.243 78 HA GLU 817 HA GLU 817 33.322 -14.141 17.287 79 1HB GLU 817 1HB GLU 817 35.537 -13.126 16.727 80 2HB GLU 817 2HB GLU 817 35.185 -14.549 15.749 81 1HG GLU 817 1HG GLU 817 34.251 -11.969 14.627 82 2HG GLU 817 2HG GLU 817 36.000 -12.179 14.698 83 HA GLU 818 HA GLU 818 32.047 -9.812 17.414 84 1HB GLU 818 1HB GLU 818 32.064 -10.044 14.721 85 2HB GLU 818 2HB GLU 818 30.374 -9.599 14.961 86 1HG GLU 818 1HG GLU 818 31.311 -7.728 16.500 87 2HG GLU 818 2HG GLU 818 32.849 -8.045 15.696 88 HA ASP 819 HA ASP 819 27.491 -9.699 17.973 89 1HB ASP 819 1HB ASP 819 27.360 -10.185 20.411 90 2HB ASP 819 2HB ASP 819 28.584 -11.173 19.614 91 HA GLU 820 HA GLU 820 25.385 -6.361 20.702 92 1HB GLU 820 1HB GLU 820 28.323 -6.398 20.986 93 2HB GLU 820 2HB GLU 820 27.625 -4.778 20.940 94 1HG GLU 820 1HG GLU 820 26.650 -5.014 22.973 95 2HG GLU 820 2HG GLU 820 26.113 -6.657 22.622 96 1HA GLY 821 1HA GLY 821 25.234 -3.635 17.257 97 2HA GLY 821 2HA GLY 821 25.670 -4.997 16.224 98 HA LEU 822 HA LEU 822 20.979 -5.360 16.405 99 1HB LEU 822 1HB LEU 822 21.042 -4.100 19.013 100 2HB LEU 822 2HB LEU 822 19.650 -3.523 18.099 101 HG LEU 822 HG LEU 822 19.076 -5.551 19.374 102 1HD1 LEU 822 1HD1 LEU 822 18.306 -5.032 16.897 103 2HD1 LEU 822 2HD1 LEU 822 19.243 -6.479 16.527 104 3HD1 LEU 822 3HD1 LEU 822 17.889 -6.570 17.654 105 1HD2 LEU 822 1HD2 LEU 822 21.576 -6.380 19.047 106 2HD2 LEU 822 2HD2 LEU 822 20.265 -7.544 19.237 107 3HD2 LEU 822 3HD2 LEU 822 20.893 -7.179 17.631 108 HA ASP 823 HA ASP 823 20.276 -0.790 15.138 109 1HB ASP 823 1HB ASP 823 22.935 -0.218 16.363 110 2HB ASP 823 2HB ASP 823 22.417 0.844 15.052 111 HA ASP 824 HA ASP 824 22.871 -1.865 11.516 112 1HB ASP 824 1HB ASP 824 25.148 -2.964 13.196 113 2HB ASP 824 2HB ASP 824 25.264 -2.645 11.465 114 HA LEU 825 HA LEU 825 22.198 -6.348 11.306 115 1HB LEU 825 1HB LEU 825 21.662 -5.961 14.076 116 2HB LEU 825 2HB LEU 825 20.386 -7.003 13.450 117 HG LEU 825 HG LEU 825 22.287 -8.356 14.211 118 1HD1 LEU 825 1HD1 LEU 825 20.923 -8.859 12.052 119 2HD1 LEU 825 2HD1 LEU 825 22.399 -8.399 11.201 120 3HD1 LEU 825 3HD1 LEU 825 22.417 -9.756 12.327 121 1HD2 LEU 825 1HD2 LEU 825 23.772 -6.325 12.662 122 2HD2 LEU 825 2HD2 LEU 825 24.296 -7.296 14.036 123 3HD2 LEU 825 3HD2 LEU 825 24.324 -7.981 12.411 124 HA GLU 826 HA GLU 826 18.087 -5.938 9.625 125 1HB GLU 826 1HB GLU 826 16.627 -3.974 10.105 126 2HB GLU 826 2HB GLU 826 17.490 -4.520 11.543 127 1HG GLU 826 1HG GLU 826 19.236 -2.776 11.086 128 2HG GLU 826 2HG GLU 826 18.231 -2.176 9.767 129 HA ASN 827 HA ASN 827 19.352 -3.247 6.096 130 1HB ASN 827 1HB ASN 827 21.916 -4.853 6.336 131 2HB ASN 827 2HB ASN 827 21.637 -3.613 5.114 132 2HD2 ASN 827 1HD2 ASN 827 20.445 -1.552 6.475 133 1HD2 ASN 827 2HD2 ASN 827 21.428 -1.012 7.751 134 HA ALA 828 HA ALA 828 18.587 -7.358 3.962 135 1HB ALA 828 3HB ALA 828 16.760 -8.615 4.680 136 2HB ALA 828 1HB ALA 828 17.088 -7.683 6.139 137 3HB ALA 828 2HB ALA 828 15.795 -7.187 5.049 138 HA GLU 829 HA GLU 829 15.856 -5.054 1.175 139 1HB GLU 829 1HB GLU 829 16.074 -7.724 0.552 140 2HB GLU 829 2HB GLU 829 14.353 -7.439 0.291 141 1HG GLU 829 1HG GLU 829 15.375 -5.232 -0.906 142 2HG GLU 829 2HG GLU 829 15.067 -6.740 -1.767 143 HA GLU 830 HA GLU 830 12.338 -4.580 4.648 144 1HB GLU 830 1HB GLU 830 12.746 -3.056 2.556 145 2HB GLU 830 2HB GLU 830 11.498 -4.051 1.804 146 1HG GLU 830 1HG GLU 830 10.203 -3.557 4.063 147 2HG GLU 830 2HG GLU 830 11.274 -2.155 4.110 148 HA GLU 831 HA GLU 831 11.535 -9.316 2.809 149 1HB GLU 831 1HB GLU 831 10.785 -8.222 5.116 150 2HB GLU 831 2HB GLU 831 9.275 -7.963 4.242 151 1HG GLU 831 1HG GLU 831 9.130 -10.349 3.722 152 2HG GLU 831 2HG GLU 831 10.683 -10.636 4.510 153 1HA GLY 832 1HA GLY 832 7.397 -8.654 0.617 154 2HA GLY 832 2HA GLY 832 8.750 -8.255 -0.443 155 HA GLN 833 HA GLN 833 7.587 -12.241 -2.092 156 1HB GLN 833 1HB GLN 833 6.162 -13.912 -0.917 157 2HB GLN 833 2HB GLN 833 7.194 -13.038 0.219 158 1HG GLN 833 1HG GLN 833 5.292 -11.451 0.627 159 2HG GLN 833 2HG GLN 833 4.274 -12.488 -0.373 160 2HE2 GLN 833 1HE2 GLN 833 3.269 -12.356 2.091 161 1HE2 GLN 833 2HE2 GLN 833 3.676 -13.695 3.050 162 HA GLU 834 HA GLU 834 4.217 -11.261 -4.771 163 1HB GLU 834 1HB GLU 834 2.947 -10.850 -2.691 164 2HB GLU 834 2HB GLU 834 3.475 -9.168 -2.690 165 1HG GLU 834 1HG GLU 834 1.880 -8.570 -4.170 166 2HG GLU 834 2HG GLU 834 2.270 -9.916 -5.239 167 HA ASN 835 HA ASN 835 6.375 -7.863 -6.797 168 1HB ASN 835 1HB ASN 835 4.745 -8.859 -9.128 169 2HB ASN 835 2HB ASN 835 6.347 -8.144 -9.130 170 2HD2 ASN 835 1HD2 ASN 835 8.008 -9.602 -7.746 171 1HD2 ASN 835 2HD2 ASN 835 7.946 -11.257 -8.112 172 HA VAL 836 HA VAL 836 2.661 -5.555 -7.354 173 HB VAL 836 HB VAL 836 2.145 -4.908 -5.272 174 1HG1 VAL 836 1HG1 VAL 836 5.022 -5.648 -4.806 175 2HG1 VAL 836 2HG1 VAL 836 3.918 -5.233 -3.501 176 3HG1 VAL 836 3HG1 VAL 836 3.583 -6.627 -4.524 177 1HG2 VAL 836 1HG2 VAL 836 4.551 -3.086 -5.435 178 2HG2 VAL 836 2HG2 VAL 836 2.872 -2.641 -5.714 179 3HG2 VAL 836 3HG2 VAL 836 3.411 -3.088 -4.096 180 HA GLU 837 HA GLU 837 4.381 -2.044 -9.405 181 1HB GLU 837 1HB GLU 837 2.595 -3.667 -10.898 182 2HB GLU 837 2HB GLU 837 2.061 -2.007 -11.128 183 1HG GLU 837 1HG GLU 837 4.486 -1.423 -11.627 184 2HG GLU 837 2HG GLU 837 3.689 -2.430 -12.836 185 HA ILE 838 HA ILE 838 0.945 0.628 -8.213 186 HB ILE 838 HB ILE 838 3.492 2.225 -8.674 187 1HG1 ILE 838 1HG1 ILE 838 3.351 0.001 -7.188 188 2HG1 ILE 838 2HG1 ILE 838 4.333 1.373 -6.706 189 1HG2 ILE 838 1HG2 ILE 838 0.977 2.855 -7.196 190 2HG2 ILE 838 2HG2 ILE 838 2.511 3.426 -6.544 191 3HG2 ILE 838 3HG2 ILE 838 2.008 3.906 -8.164 192 1HD1 ILE 838 1HD1 ILE 838 1.497 1.439 -5.822 193 2HD1 ILE 838 2HD1 ILE 838 2.517 0.216 -5.067 194 3HD1 ILE 838 3HD1 ILE 838 2.957 1.915 -4.970 195 HA LEU 839 HA LEU 839 -0.068 3.824 -11.285 196 1HB LEU 839 1HB LEU 839 -1.159 1.154 -11.488 197 2HB LEU 839 2HB LEU 839 -2.387 2.327 -11.964 198 HG LEU 839 HG LEU 839 -0.207 3.359 -13.227 199 1HD1 LEU 839 1HD1 LEU 839 0.632 0.800 -12.398 200 2HD1 LEU 839 2HD1 LEU 839 0.265 0.638 -14.114 201 3HD1 LEU 839 3HD1 LEU 839 1.428 1.847 -13.572 202 1HD2 LEU 839 1HD2 LEU 839 -2.615 2.450 -13.975 203 2HD2 LEU 839 2HD2 LEU 839 -1.351 2.800 -15.154 204 3HD2 LEU 839 3HD2 LEU 839 -1.634 1.139 -14.630 205 HA PRO 840 HA PRO 840 -3.179 6.325 -9.433 206 1HB PRO 840 1HB PRO 840 -3.641 7.768 -11.106 207 2HB PRO 840 2HB PRO 840 -4.822 6.634 -11.766 208 1HG PRO 840 1HG PRO 840 -2.262 7.331 -12.853 209 2HG PRO 840 2HG PRO 840 -3.414 6.151 -13.484 210 1HD PRO 840 1HD PRO 840 -1.983 4.476 -12.882 211 2HD PRO 840 2HD PRO 840 -0.878 5.660 -12.141 212 HA SER 841 HA SER 841 -6.139 3.249 -8.192 213 1HB SER 841 1HB SER 841 -7.945 4.403 -6.918 214 2HB SER 841 2HB SER 841 -6.343 4.934 -6.428 215 HG SER 841 HG SER 841 -6.607 6.753 -7.751 216 1HA GLY 842 1HA GLY 842 -9.810 2.161 -10.492 217 2HA GLY 842 2HA GLY 842 -9.553 3.824 -11.015 218 HA GLU 843 HA GLU 843 -7.628 1.220 -14.228 219 1HB GLU 843 1HB GLU 843 -5.916 0.377 -11.984 220 2HB GLU 843 2HB GLU 843 -5.693 -0.597 -13.439 221 1HG GLU 843 1HG GLU 843 -5.754 2.415 -13.586 222 2HG GLU 843 2HG GLU 843 -4.265 1.555 -13.194 223 HA ARG 844 HA ARG 844 -9.699 -2.864 -13.774 224 1HB ARG 844 1HB ARG 844 -11.703 -0.884 -13.280 225 2HB ARG 844 2HB ARG 844 -12.325 -2.084 -14.414 226 1HG ARG 844 1HG ARG 844 -11.913 -3.878 -12.899 227 2HG ARG 844 2HG ARG 844 -10.909 -2.866 -11.860 228 1HD ARG 844 1HD ARG 844 -13.253 -1.448 -11.845 229 2HD ARG 844 2HD ARG 844 -12.849 -2.681 -10.635 230 HE ARG 844 HE ARG 844 -14.042 -3.735 -13.108 231 1HH1 ARG 844 1HH1 ARG 844 -15.513 -1.660 -11.075 232 2HH1 ARG 844 2HH1 ARG 844 -16.620 -2.786 -10.364 233 1HH2 ARG 844 1HH2 ARG 844 -15.051 -5.576 -11.699 234 2HH2 ARG 844 2HH2 ARG 844 -16.358 -5.004 -10.716 235 HA PRO 845 HA PRO 845 -11.449 -2.294 -18.240 236 1HB PRO 845 1HB PRO 845 -10.877 0.415 -19.032 237 2HB PRO 845 2HB PRO 845 -12.457 -0.348 -18.826 238 1HG PRO 845 1HG PRO 845 -11.276 1.651 -17.172 239 2HG PRO 845 2HG PRO 845 -12.804 0.804 -16.908 240 1HD PRO 845 1HD PRO 845 -11.855 -0.264 -15.116 241 2HD PRO 845 2HD PRO 845 -10.271 0.452 -15.491 242 HA GLN 846 HA GLN 846 -7.409 -2.663 -19.994 243 1HB GLN 846 1HB GLN 846 -6.940 -0.716 -18.532 244 2HB GLN 846 2HB GLN 846 -6.450 -1.817 -17.245 245 1HG GLN 846 1HG GLN 846 -4.443 -2.289 -18.227 246 2HG GLN 846 2HG GLN 846 -5.114 -2.235 -19.857 247 2HE2 GLN 846 1HE2 GLN 846 -3.333 -0.820 -20.569 248 1HE2 GLN 846 2HE2 GLN 846 -3.297 0.817 -20.123 249 HA ALA 847 HA ALA 847 -6.493 -6.600 -17.785 250 1HB ALA 847 1HB ALA 847 -5.162 -4.742 -15.817 251 2HB ALA 847 3HB ALA 847 -4.447 -5.589 -17.190 252 3HB ALA 847 2HB ALA 847 -4.876 -6.480 -15.730 253 HA ASN 848 HA ASN 848 -9.531 -6.211 -13.973 254 1HB ASN 848 1HB ASN 848 -11.850 -6.716 -14.781 255 2HB ASN 848 2HB ASN 848 -11.187 -5.244 -15.489 256 2HD2 ASN 848 1HD2 ASN 848 -12.682 -8.198 -16.267 257 1HD2 ASN 848 2HD2 ASN 848 -12.300 -8.235 -17.921 258 HA GLN 849 HA GLN 849 -9.435 -10.675 -14.205 259 1HB GLN 849 1HB GLN 849 -7.138 -9.872 -15.038 260 2HB GLN 849 2HB GLN 849 -7.196 -11.484 -14.332 261 1HG GLN 849 1HG GLN 849 -6.729 -9.495 -12.270 262 2HG GLN 849 2HG GLN 849 -5.748 -10.892 -12.707 263 2HE2 GLN 849 1HE2 GLN 849 -4.225 -8.808 -12.020 264 1HE2 GLN 849 2HE2 GLN 849 -3.610 -7.962 -13.347 265 HA LYS 850 HA LYS 850 -7.971 -11.217 -9.611 266 1HB LYS 850 1HB LYS 850 -9.703 -12.934 -9.079 267 2HB LYS 850 2HB LYS 850 -10.313 -11.712 -10.193 268 1HG LYS 850 1HG LYS 850 -9.420 -13.430 -12.021 269 2HG LYS 850 2HG LYS 850 -11.011 -13.632 -11.289 270 1HD LYS 850 1HD LYS 850 -8.508 -15.199 -10.866 271 2HD LYS 850 2HD LYS 850 -9.553 -14.959 -9.465 272 1HE LYS 850 1HE LYS 850 -10.925 -15.757 -11.986 273 2HE LYS 850 2HE LYS 850 -9.930 -16.998 -11.198 274 1HZ LYS 850 1HZ LYS 850 -11.941 -15.307 -9.809 275 2HZ LYS 850 2HZ LYS 850 -12.205 -16.914 -10.296 276 3HZ LYS 850 3HZ LYS 850 -11.032 -16.561 -9.119 277 HA ARG 851 HA ARG 851 -6.116 -15.400 -9.251 278 1HB ARG 851 1HB ARG 851 -4.687 -13.578 -10.282 279 2HB ARG 851 2HB ARG 851 -4.080 -13.242 -8.662 280 1HG ARG 851 1HG ARG 851 -2.538 -14.840 -9.074 281 2HG ARG 851 2HG ARG 851 -3.847 -15.995 -8.845 282 1HD ARG 851 1HD ARG 851 -3.883 -14.864 -11.542 283 2HD ARG 851 2HD ARG 851 -2.354 -15.689 -11.184 284 HE ARG 851 HE ARG 851 -5.052 -16.945 -11.043 285 1HH1 ARG 851 1HH1 ARG 851 -3.959 -18.519 -9.110 286 2HH1 ARG 851 2HH1 ARG 851 -2.865 -19.617 -9.884 287 1HH2 ARG 851 1HH2 ARG 851 -2.627 -17.745 -12.794 288 2HH2 ARG 851 2HH2 ARG 851 -2.111 -19.179 -11.971 289 HA ILE 852 HA ILE 852 -5.556 -15.003 -4.691 290 HB ILE 852 HB ILE 852 -3.495 -15.857 -4.188 291 1HG1 ILE 852 1HG1 ILE 852 -2.573 -13.664 -3.501 292 2HG1 ILE 852 2HG1 ILE 852 -1.375 -14.626 -4.356 293 1HG2 ILE 852 1HG2 ILE 852 -3.774 -16.367 -6.584 294 2HG2 ILE 852 2HG2 ILE 852 -2.903 -14.890 -6.998 295 3HG2 ILE 852 3HG2 ILE 852 -2.071 -16.197 -6.156 296 1HD1 ILE 852 1HD1 ILE 852 -2.676 -13.204 -6.384 297 2HD1 ILE 852 2HD1 ILE 852 -2.504 -12.038 -5.072 298 3HD1 ILE 852 3HD1 ILE 852 -1.083 -12.846 -5.717 299 HA THR 853 HA THR 853 -3.705 -10.660 -3.311 300 HB THR 853 HB THR 853 -4.632 -8.634 -4.502 301 HG1 THR 853 HG1 THR 853 -5.974 -10.619 -5.780 302 1HG2 THR 853 1HG2 THR 853 -2.383 -9.695 -4.897 303 2HG2 THR 853 2HG2 THR 853 -3.098 -10.546 -6.259 304 3HG2 THR 853 3HG2 THR 853 -3.015 -8.786 -6.269 305 HA THR 854 HA THR 854 -7.495 -11.441 -1.120 306 HB THR 854 HB THR 854 -5.352 -10.077 0.520 307 HG1 THR 854 HG1 THR 854 -5.121 -12.028 1.307 308 1HG2 THR 854 1HG2 THR 854 -7.573 -9.156 1.201 309 2HG2 THR 854 2HG2 THR 854 -8.129 -10.801 1.497 310 3HG2 THR 854 3HG2 THR 854 -6.819 -10.124 2.464 311 HA PRO 855 HA PRO 855 -9.431 -7.617 -2.347 312 1HB PRO 855 1HB PRO 855 -11.595 -8.329 -2.163 313 2HB PRO 855 2HB PRO 855 -11.539 -8.033 -0.423 314 1HG PRO 855 1HG PRO 855 -11.609 -10.562 -1.773 315 2HG PRO 855 2HG PRO 855 -11.493 -10.272 -0.035 316 1HD PRO 855 1HD PRO 855 -9.330 -11.032 -0.083 317 2HD PRO 855 2HD PRO 855 -9.413 -11.214 -1.854 318 HA TYR 856 HA TYR 856 -8.018 -4.868 0.839 319 1HB TYR 856 1HB TYR 856 -8.693 -6.742 2.262 320 2HB TYR 856 2HB TYR 856 -7.141 -7.517 2.007 321 HD1 TYR 856 HD1 TYR 856 -5.024 -6.103 2.733 322 HD2 TYR 856 HD2 TYR 856 -9.019 -5.376 4.123 323 HE1 TYR 856 HE1 TYR 856 -4.119 -4.923 4.702 324 HE2 TYR 856 HE2 TYR 856 -8.114 -4.192 6.096 325 HH TYR 856 HH TYR 856 -4.779 -4.307 6.939 326 HA MET 857 HA MET 857 -3.952 -4.833 -1.183 327 1HB MET 857 1HB MET 857 -4.900 -2.539 -1.566 328 2HB MET 857 2HB MET 857 -4.403 -2.104 0.065 329 1HG MET 857 1HG MET 857 -2.037 -2.854 -0.659 330 2HG MET 857 2HG MET 857 -2.657 -2.773 -2.305 331 1HE MET 857 1HE MET 857 -3.524 -0.974 -3.431 332 2HE MET 857 2HE MET 857 -4.664 -0.265 -2.295 333 3HE MET 857 3HE MET 857 -3.430 0.746 -3.038 334 HA THR 858 HA THR 858 -1.793 -4.757 2.766 335 HB THR 858 HB THR 858 -0.019 -6.506 2.473 336 HG1 THR 858 HG1 THR 858 0.768 -6.152 0.475 337 1HG2 THR 858 1HG2 THR 858 -2.747 -6.802 1.203 338 2HG2 THR 858 2HG2 THR 858 -1.698 -8.174 1.562 339 3HG2 THR 858 3HG2 THR 858 -2.297 -7.153 2.870 340 HA LYS 859 HA LYS 859 0.908 -1.459 3.481 341 1HB LYS 859 1HB LYS 859 2.722 -2.158 5.039 342 2HB LYS 859 2HB LYS 859 1.137 -2.753 5.531 343 1HG LYS 859 1HG LYS 859 1.621 -4.955 4.902 344 2HG LYS 859 2HG LYS 859 2.901 -4.460 3.794 345 1HD LYS 859 1HD LYS 859 4.041 -3.543 5.984 346 2HD LYS 859 2HD LYS 859 2.978 -4.700 6.783 347 1HE LYS 859 1HE LYS 859 4.756 -5.483 4.457 348 2HE LYS 859 2HE LYS 859 5.274 -5.617 6.149 349 1HZ LYS 859 1HZ LYS 859 3.144 -6.827 6.562 350 2HZ LYS 859 2HZ LYS 859 2.910 -6.886 4.880 351 3HZ LYS 859 3HZ LYS 859 4.245 -7.666 5.582 352 HA TYR 860 HA TYR 860 4.763 -2.946 1.128 353 1HB TYR 860 1HB TYR 860 4.696 -5.356 1.023 354 2HB TYR 860 2HB TYR 860 3.390 -5.328 -0.156 355 HD1 TYR 860 HD1 TYR 860 5.876 -2.688 -0.414 356 HD2 TYR 860 HD2 TYR 860 4.946 -6.682 -1.710 357 HE1 TYR 860 HE1 TYR 860 7.493 -2.446 -2.256 358 HE2 TYR 860 HE2 TYR 860 6.578 -6.429 -3.559 359 HH TYR 860 HH TYR 860 7.586 -3.961 -4.821 360 HA GLU 861 HA GLU 861 2.082 -2.248 -2.961 361 1HB GLU 861 1HB GLU 861 -0.350 -1.966 -1.166 362 2HB GLU 861 2HB GLU 861 -0.329 -1.942 -2.925 363 1HG GLU 861 1HG GLU 861 0.060 -4.305 -1.077 364 2HG GLU 861 2HG GLU 861 -1.139 -4.103 -2.348 365 HA ARG 862 HA ARG 862 1.277 1.724 -0.213 366 1HB ARG 862 1HB ARG 862 0.310 0.939 1.782 367 2HB ARG 862 2HB ARG 862 1.651 -0.137 2.123 368 1HG ARG 862 1HG ARG 862 2.556 2.624 1.984 369 2HG ARG 862 2HG ARG 862 1.279 2.445 3.173 370 1HD ARG 862 1HD ARG 862 2.927 0.203 3.575 371 2HD ARG 862 2HD ARG 862 2.860 1.653 4.593 372 HE ARG 862 HE ARG 862 4.459 2.294 2.348 373 1HH1 ARG 862 1HH1 ARG 862 4.757 -0.684 3.734 374 2HH1 ARG 862 2HH1 ARG 862 6.338 -0.443 4.399 375 1HH2 ARG 862 1HH2 ARG 862 6.374 2.964 3.760 376 2HH2 ARG 862 2HH2 ARG 862 7.254 1.623 4.413 377 HA ALA 863 HA ALA 863 5.849 1.439 1.217 378 1HB ALA 863 2HB ALA 863 6.750 -1.257 0.515 379 2HB ALA 863 3HB ALA 863 6.978 -0.361 2.017 380 3HB ALA 863 1HB ALA 863 5.488 -1.264 1.747 381 HA ARG 864 HA ARG 864 6.830 0.508 -3.270 382 1HB ARG 864 1HB ARG 864 4.619 -1.314 -3.291 383 2HB ARG 864 2HB ARG 864 4.441 -0.256 -4.693 384 1HG ARG 864 1HG ARG 864 7.018 -1.675 -3.970 385 2HG ARG 864 2HG ARG 864 5.856 -2.295 -5.136 386 1HD ARG 864 1HD ARG 864 6.265 0.375 -5.911 387 2HD ARG 864 2HD ARG 864 6.949 -1.060 -6.700 388 HE ARG 864 HE ARG 864 8.507 -0.454 -4.377 389 1HH1 ARG 864 1HH1 ARG 864 9.009 -0.664 -7.539 390 2HH1 ARG 864 2HH1 ARG 864 9.959 0.771 -7.737 391 1HH2 ARG 864 1HH2 ARG 864 9.187 2.032 -4.600 392 2HH2 ARG 864 2HH2 ARG 864 10.058 2.299 -6.073 393 HA VAL 865 HA VAL 865 2.883 3.467 -4.102 394 HB VAL 865 HB VAL 865 2.415 2.302 -1.453 395 1HG1 VAL 865 1HG1 VAL 865 1.916 5.174 -1.965 396 2HG1 VAL 865 2HG1 VAL 865 0.732 4.249 -1.041 397 3HG1 VAL 865 3HG1 VAL 865 2.399 4.358 -0.477 398 1HG2 VAL 865 1HG2 VAL 865 1.227 1.762 -3.545 399 2HG2 VAL 865 2HG2 VAL 865 0.184 2.202 -2.193 400 3HG2 VAL 865 3HG2 VAL 865 0.508 3.372 -3.476 401 HA LEU 866 HA LEU 866 4.915 6.275 -0.620 402 1HB LEU 866 1HB LEU 866 5.288 5.155 1.353 403 2HB LEU 866 2HB LEU 866 5.583 3.636 0.521 404 HG LEU 866 HG LEU 866 7.735 5.675 0.264 405 1HD1 LEU 866 1HD1 LEU 866 6.757 5.634 2.721 406 2HD1 LEU 866 2HD1 LEU 866 7.640 4.111 2.817 407 3HD1 LEU 866 3HD1 LEU 866 8.500 5.607 2.454 408 1HD2 LEU 866 1HD2 LEU 866 7.467 2.698 0.657 409 2HD2 LEU 866 2HD2 LEU 866 8.232 3.566 -0.673 410 3HD2 LEU 866 3HD2 LEU 866 9.020 3.495 0.901 411 1HA GLY 867 1HA GLY 867 8.933 5.077 -2.846 412 2HA GLY 867 2HA GLY 867 8.402 3.596 -3.646 413 HA THR 868 HA THR 868 6.864 6.012 -6.886 414 HB THR 868 HB THR 868 5.093 3.983 -6.752 415 HG1 THR 868 HG1 THR 868 4.721 4.505 -8.865 416 1HG2 THR 868 1HG2 THR 868 3.596 6.588 -6.558 417 2HG2 THR 868 2HG2 THR 868 2.932 5.281 -7.521 418 3HG2 THR 868 3HG2 THR 868 3.221 5.044 -5.800 419 HA ARG 869 HA ARG 869 4.034 9.101 -4.752 420 1HB ARG 869 1HB ARG 869 3.956 7.245 -2.537 421 2HB ARG 869 2HB ARG 869 4.383 8.839 -1.915 422 1HG ARG 869 1HG ARG 869 2.403 9.585 -3.551 423 2HG ARG 869 2HG ARG 869 2.088 9.053 -1.899 424 1HD ARG 869 1HD ARG 869 2.199 6.681 -3.424 425 2HD ARG 869 2HD ARG 869 0.731 7.462 -2.801 426 HE ARG 869 HE ARG 869 1.698 7.606 -5.556 427 1HH1 ARG 869 1HH1 ARG 869 1.407 10.059 -6.142 428 2HH1 ARG 869 2HH1 ARG 869 -0.211 10.603 -5.854 429 1HH2 ARG 869 1HH2 ARG 869 -1.044 7.906 -3.840 430 2HH2 ARG 869 2HH2 ARG 869 -1.599 9.385 -4.551 431 HA ALA 870 HA ALA 870 8.020 10.223 -2.059 432 1HB ALA 870 3HB ALA 870 8.710 8.044 -1.309 433 2HB ALA 870 2HB ALA 870 10.062 8.704 -2.230 434 3HB ALA 870 1HB ALA 870 8.997 7.507 -2.964 435 HA LEU 871 HA LEU 871 10.032 10.648 -6.219 436 1HB LEU 871 1HB LEU 871 8.836 9.362 -8.461 437 2HB LEU 871 2HB LEU 871 10.429 9.070 -7.781 438 HG LEU 871 HG LEU 871 8.098 7.768 -6.447 439 1HD1 LEU 871 1HD1 LEU 871 9.124 7.168 -9.196 440 2HD1 LEU 871 2HD1 LEU 871 8.559 5.855 -8.162 441 3HD1 LEU 871 3HD1 LEU 871 7.464 7.166 -8.603 442 1HD2 LEU 871 1HD2 LEU 871 11.005 7.167 -7.020 443 2HD2 LEU 871 2HD2 LEU 871 10.223 7.365 -5.451 444 3HD2 LEU 871 3HD2 LEU 871 9.908 5.924 -6.417 445 HA GLN 872 HA GLN 872 5.841 12.018 -8.377 446 1HB GLN 872 1HB GLN 872 4.784 10.651 -6.032 447 2HB GLN 872 2HB GLN 872 4.120 12.279 -6.144 448 1HG GLN 872 1HG GLN 872 2.686 11.531 -7.716 449 2HG GLN 872 2HG GLN 872 4.063 11.237 -8.776 450 2HE2 GLN 872 1HE2 GLN 872 4.315 9.091 -9.407 451 1HE2 GLN 872 2HE2 GLN 872 3.693 7.750 -8.574 452 HA ILE 873 HA ILE 873 6.139 15.478 -4.990 453 HB ILE 873 HB ILE 873 7.205 14.914 -2.656 454 1HG1 ILE 873 1HG1 ILE 873 6.010 12.337 -2.520 455 2HG1 ILE 873 2HG1 ILE 873 7.063 12.321 -3.921 456 1HG2 ILE 873 1HG2 ILE 873 4.479 14.447 -3.746 457 2HG2 ILE 873 2HG2 ILE 873 4.793 14.049 -2.059 458 3HG2 ILE 873 3HG2 ILE 873 5.049 15.692 -2.635 459 1HD1 ILE 873 1HD1 ILE 873 8.270 13.631 -1.613 460 2HD1 ILE 873 2HD1 ILE 873 7.885 11.935 -1.337 461 3HD1 ILE 873 3HD1 ILE 873 8.922 12.398 -2.683 462 HA ALA 874 HA ALA 874 10.831 14.561 -4.352 463 1HB ALA 874 1HB ALA 874 10.410 12.118 -6.038 464 2HB ALA 874 3HB ALA 874 11.138 12.225 -4.438 465 3HB ALA 874 2HB ALA 874 12.018 12.808 -5.849 466 HA MET 875 HA MET 875 10.675 16.145 -8.700 467 1HB MET 875 1HB MET 875 9.093 14.350 -9.613 468 2HB MET 875 2HB MET 875 7.759 15.427 -9.199 469 1HG MET 875 1HG MET 875 9.991 16.595 -10.789 470 2HG MET 875 2HG MET 875 8.924 15.464 -11.620 471 1HE MET 875 2HE MET 875 6.993 15.532 -12.169 472 2HE MET 875 1HE MET 875 5.645 16.499 -11.576 473 3HE MET 875 3HE MET 875 6.561 17.044 -12.979 474 HA CYS 876 HA CYS 876 7.809 19.192 -6.620 475 1HB CYS 876 1HB CYS 876 6.892 19.356 -8.902 476 2HB CYS 876 2HB CYS 876 5.596 18.239 -8.488 477 HG CYS 876 HG CYS 876 4.358 20.078 -7.347 478 HA ALA 877 HA ALA 877 4.680 16.142 -4.499 479 1HB ALA 877 3HB ALA 877 4.840 18.069 -3.292 480 2HB ALA 877 1HB ALA 877 4.036 19.034 -4.531 481 3HB ALA 877 2HB ALA 877 3.089 17.984 -3.476 482 HA PRO 878 HA PRO 878 0.837 15.836 -7.346 483 1HB PRO 878 1HB PRO 878 1.650 13.150 -7.939 484 2HB PRO 878 2HB PRO 878 1.515 14.505 -9.062 485 1HG PRO 878 1HG PRO 878 3.903 13.261 -8.079 486 2HG PRO 878 2HG PRO 878 3.765 14.589 -9.222 487 1HD PRO 878 1HD PRO 878 4.681 14.695 -6.505 488 2HD PRO 878 2HD PRO 878 4.504 16.036 -7.655 489 HA VAL 879 HA VAL 879 1.071 12.089 -4.015 490 HB VAL 879 HB VAL 879 2.867 14.203 -2.889 491 1HG1 VAL 879 1HG1 VAL 879 1.247 13.515 -1.040 492 2HG1 VAL 879 2HG1 VAL 879 2.004 11.930 -1.128 493 3HG1 VAL 879 3HG1 VAL 879 2.955 13.344 -0.708 494 1HG2 VAL 879 1HG2 VAL 879 3.276 11.816 -4.213 495 2HG2 VAL 879 2HG2 VAL 879 4.489 12.678 -3.292 496 3HG2 VAL 879 3HG2 VAL 879 3.573 11.387 -2.533 497 HA MET 880 HA MET 880 -2.415 14.132 -2.239 498 1HB MET 880 1HB MET 880 -1.849 11.605 -0.770 499 2HB MET 880 2HB MET 880 -3.140 12.625 -0.129 500 1HG MET 880 1HG MET 880 -2.957 11.821 -3.043 501 2HG MET 880 2HG MET 880 -3.894 10.924 -1.851 502 1HE MET 880 1HE MET 880 -3.428 13.548 -4.159 503 2HE MET 880 2HE MET 880 -4.973 12.890 -4.693 504 3HE MET 880 3HE MET 880 -4.871 14.570 -4.170 505 HA VAL 881 HA VAL 881 -0.802 16.553 1.137 506 HB VAL 881 HB VAL 881 1.214 15.948 2.565 507 1HG1 VAL 881 1HG1 VAL 881 -1.233 14.527 2.202 508 2HG1 VAL 881 2HG1 VAL 881 0.021 13.327 2.499 509 3HG1 VAL 881 3HG1 VAL 881 -0.253 14.626 3.659 510 1HG2 VAL 881 1HG2 VAL 881 2.249 14.812 0.375 511 2HG2 VAL 881 2HG2 VAL 881 2.667 14.253 1.995 512 3HG2 VAL 881 3HG2 VAL 881 1.455 13.388 1.050 513 HA GLU 882 HA GLU 882 2.544 18.746 -0.928 514 1HB GLU 882 1HB GLU 882 0.235 20.216 0.165 515 2HB GLU 882 2HB GLU 882 1.592 21.238 -0.308 516 1HG GLU 882 1HG GLU 882 1.441 20.650 -2.538 517 2HG GLU 882 2HG GLU 882 0.761 19.061 -2.181 518 HA LEU 883 HA LEU 883 4.917 19.724 2.996 519 1HB LEU 883 1HB LEU 883 5.897 17.522 2.536 520 2HB LEU 883 2HB LEU 883 6.682 18.149 1.087 521 HG LEU 883 HG LEU 883 7.901 19.797 2.551 522 1HD1 LEU 883 1HD1 LEU 883 6.358 18.267 4.622 523 2HD1 LEU 883 2HD1 LEU 883 7.953 18.899 5.030 524 3HD1 LEU 883 3HD1 LEU 883 6.673 19.999 4.520 525 1HD2 LEU 883 1HD2 LEU 883 8.934 17.661 1.814 526 2HD2 LEU 883 2HD2 LEU 883 9.502 18.141 3.412 527 3HD2 LEU 883 3HD2 LEU 883 8.292 16.869 3.252 528 HA GLU 884 HA GLU 884 6.811 22.732 -0.015 529 1HB GLU 884 1HB GLU 884 8.826 21.403 1.502 530 2HB GLU 884 2HB GLU 884 9.610 22.118 0.096 531 1HG GLU 884 1HG GLU 884 7.932 24.145 0.850 532 2HG GLU 884 2HG GLU 884 9.619 24.019 1.348 533 1HA GLY 885 1HA GLY 885 7.138 20.019 -4.105 534 2HA GLY 885 2HA GLY 885 8.552 21.061 -3.919 535 HA GLU 886 HA GLU 886 9.904 16.670 -1.885 536 1HB GLU 886 1HB GLU 886 10.495 16.773 -4.192 537 2HB GLU 886 2HB GLU 886 11.482 18.214 -3.954 538 1HG GLU 886 1HG GLU 886 12.407 16.041 -2.260 539 2HG GLU 886 2HG GLU 886 12.369 15.542 -3.948 540 HA THR 887 HA THR 887 13.589 17.741 0.463 541 HB THR 887 HB THR 887 10.973 18.077 1.971 542 HG1 THR 887 HG1 THR 887 11.256 20.164 1.480 543 1HG2 THR 887 1HG2 THR 887 13.794 18.319 2.948 544 2HG2 THR 887 2HG2 THR 887 12.614 19.505 3.508 545 3HG2 THR 887 3HG2 THR 887 12.351 17.787 3.811 546 HA ASP 888 HA ASP 888 12.746 14.134 3.305 547 1HB ASP 888 1HB ASP 888 10.334 15.122 3.712 548 2HB ASP 888 2HB ASP 888 9.847 13.652 2.872 549 HA PRO 889 HA PRO 889 13.060 11.013 0.155 550 1HB PRO 889 1HB PRO 889 13.406 8.933 2.109 551 2HB PRO 889 2HB PRO 889 14.653 9.752 1.164 552 1HG PRO 889 1HG PRO 889 14.196 9.986 3.959 553 2HG PRO 889 2HG PRO 889 15.334 10.920 2.982 554 1HD PRO 889 1HD PRO 889 14.056 12.766 3.379 555 2HD PRO 889 2HD PRO 889 12.786 11.778 4.143 556 HA LEU 890 HA LEU 890 8.708 9.679 0.991 557 1HB LEU 890 1HB LEU 890 8.585 7.574 2.201 558 2HB LEU 890 2HB LEU 890 10.231 7.804 1.640 559 HG LEU 890 HG LEU 890 10.381 6.996 3.887 560 1HD1 LEU 890 1HD1 LEU 890 11.830 8.994 3.281 561 2HD1 LEU 890 2HD1 LEU 890 10.695 9.981 4.199 562 3HD1 LEU 890 3HD1 LEU 890 11.604 8.704 5.003 563 1HD2 LEU 890 1HD2 LEU 890 7.911 7.973 4.286 564 2HD2 LEU 890 2HD2 LEU 890 8.990 7.550 5.614 565 3HD2 LEU 890 3HD2 LEU 890 8.842 9.230 5.102 566 HA LEU 891 HA LEU 891 7.462 11.385 5.511 567 1HB LEU 891 1HB LEU 891 8.458 13.436 5.746 568 2HB LEU 891 2HB LEU 891 8.490 13.697 4.016 569 HG LEU 891 HG LEU 891 7.061 15.317 5.293 570 1HD1 LEU 891 1HD1 LEU 891 6.623 14.293 2.802 571 2HD1 LEU 891 2HD1 LEU 891 5.060 14.012 3.575 572 3HD1 LEU 891 3HD1 LEU 891 5.726 15.639 3.496 573 1HD2 LEU 891 1HD2 LEU 891 5.867 12.821 6.216 574 2HD2 LEU 891 2HD2 LEU 891 5.754 14.437 6.903 575 3HD2 LEU 891 3HD2 LEU 891 4.667 13.955 5.602 576 HA ILE 892 HA ILE 892 4.108 12.803 2.343 577 HB ILE 892 HB ILE 892 6.424 12.613 0.536 578 1HG1 ILE 892 1HG1 ILE 892 4.066 14.267 -0.089 579 2HG1 ILE 892 2HG1 ILE 892 4.848 14.591 1.459 580 1HG2 ILE 892 1HG2 ILE 892 3.757 11.555 -0.261 581 2HG2 ILE 892 2HG2 ILE 892 4.633 12.556 -1.403 582 3HG2 ILE 892 3HG2 ILE 892 5.369 11.080 -0.798 583 1HD1 ILE 892 1HD1 ILE 892 6.563 14.176 -0.922 584 2HD1 ILE 892 2HD1 ILE 892 5.715 15.713 -0.779 585 3HD1 ILE 892 3HD1 ILE 892 6.831 15.198 0.485 586 HA ALA 893 HA ALA 893 4.165 8.405 0.523 587 1HB ALA 893 3HB ALA 893 6.107 7.640 -0.353 588 2HB ALA 893 1HB ALA 893 7.064 8.423 0.900 589 3HB ALA 893 2HB ALA 893 6.332 6.857 1.205 590 HA MET 894 HA MET 894 4.540 6.960 5.044 591 1HB MET 894 1HB MET 894 6.647 7.849 5.762 592 2HB MET 894 2HB MET 894 6.096 9.510 5.572 593 1HG MET 894 1HG MET 894 4.443 8.038 7.473 594 2HG MET 894 2HG MET 894 6.140 8.036 7.950 595 1HE MET 894 2HE MET 894 7.410 10.131 6.911 596 2HE MET 894 3HE MET 894 6.979 11.797 7.319 597 3HE MET 894 1HE MET 894 7.506 10.685 8.578 598 HA LYS 895 HA LYS 895 1.916 10.816 6.587 599 1HB LYS 895 1HB LYS 895 3.117 12.721 5.808 600 2HB LYS 895 2HB LYS 895 3.044 12.178 4.134 601 1HG LYS 895 1HG LYS 895 0.540 12.490 4.232 602 2HG LYS 895 2HG LYS 895 1.472 13.979 4.367 603 1HD LYS 895 1HD LYS 895 1.126 12.855 6.994 604 2HD LYS 895 2HD LYS 895 -0.447 12.950 6.202 605 1HE LYS 895 1HE LYS 895 0.566 15.379 5.517 606 2HE LYS 895 2HE LYS 895 -0.349 15.117 7.015 607 1HZ LYS 895 1HZ LYS 895 2.592 14.780 6.752 608 2HZ LYS 895 2HZ LYS 895 1.842 16.152 7.411 609 3HZ LYS 895 3HZ LYS 895 1.682 14.645 8.179 610 HA GLU 896 HA GLU 896 -0.543 10.066 2.401 611 1HB GLU 896 1HB GLU 896 1.958 8.669 1.518 612 2HB GLU 896 2HB GLU 896 0.423 8.192 0.802 613 1HG GLU 896 1HG GLU 896 0.692 11.091 0.928 614 2HG GLU 896 2HG GLU 896 2.002 10.349 0.009 615 HA LEU 897 HA LEU 897 -0.965 5.535 3.827 616 1HB LEU 897 1HB LEU 897 0.651 3.963 4.152 617 2HB LEU 897 2HB LEU 897 1.285 4.834 5.552 618 HG LEU 897 HG LEU 897 2.465 6.360 4.063 619 1HD1 LEU 897 1HD1 LEU 897 2.995 3.605 4.450 620 2HD1 LEU 897 2HD1 LEU 897 3.567 4.066 2.846 621 3HD1 LEU 897 3HD1 LEU 897 4.134 4.939 4.268 622 1HD2 LEU 897 1HD2 LEU 897 0.616 5.256 2.187 623 2HD2 LEU 897 2HD2 LEU 897 1.752 6.579 1.936 624 3HD2 LEU 897 3HD2 LEU 897 2.243 4.921 1.597 625 HA LYS 898 HA LYS 898 0.011 6.762 8.508 626 1HB LYS 898 1HB LYS 898 2.078 8.045 7.941 627 2HB LYS 898 2HB LYS 898 1.055 9.299 7.241 628 1HG LYS 898 1HG LYS 898 0.268 10.017 9.293 629 2HG LYS 898 2HG LYS 898 0.515 8.446 10.057 630 1HD LYS 898 1HD LYS 898 3.079 9.306 9.251 631 2HD LYS 898 2HD LYS 898 2.303 10.723 9.959 632 1HE LYS 898 1HE LYS 898 1.576 8.911 11.812 633 2HE LYS 898 2HE LYS 898 3.082 8.152 11.259 634 1HZ LYS 898 1HZ LYS 898 4.122 10.399 11.434 635 2HZ LYS 898 2HZ LYS 898 2.715 10.938 12.220 636 3HZ LYS 898 3HZ LYS 898 3.668 9.724 12.926 637 HA ALA 899 HA ALA 899 -3.246 9.839 7.165 638 1HB ALA 899 2HB ALA 899 -3.423 11.116 5.019 639 2HB ALA 899 3HB ALA 899 -1.813 11.232 5.727 640 3HB ALA 899 1HB ALA 899 -2.101 10.151 4.364 641 HA ARG 900 HA ARG 900 -3.824 5.478 4.175 642 1HB ARG 900 1HB ARG 900 -5.643 4.875 5.494 643 2HB ARG 900 2HB ARG 900 -6.264 6.527 5.551 644 1HG ARG 900 1HG ARG 900 -3.688 5.887 6.931 645 2HG ARG 900 2HG ARG 900 -4.886 7.122 7.316 646 1HD ARG 900 1HD ARG 900 -6.255 5.630 8.471 647 2HD ARG 900 2HD ARG 900 -5.694 4.233 7.530 648 HE ARG 900 HE ARG 900 -3.534 4.391 8.771 649 1HH1 ARG 900 1HH1 ARG 900 -2.851 6.442 10.231 650 2HH1 ARG 900 2HH1 ARG 900 -3.746 6.446 11.714 651 1HH2 ARG 900 1HH2 ARG 900 -6.176 4.258 10.563 652 2HH2 ARG 900 2HH2 ARG 900 -5.628 5.210 11.902 653 HA LYS 901 HA LYS 901 -5.924 8.777 1.883 654 1HB LYS 901 1HB LYS 901 -4.626 10.531 2.997 655 2HB LYS 901 2HB LYS 901 -3.230 10.145 1.992 656 1HG LYS 901 1HG LYS 901 -4.630 12.150 1.242 657 2HG LYS 901 2HG LYS 901 -4.311 10.927 0.017 658 1HD LYS 901 1HD LYS 901 -6.493 10.252 -0.078 659 2HD LYS 901 2HD LYS 901 -6.754 10.515 1.646 660 1HE LYS 901 1HE LYS 901 -6.582 13.047 1.085 661 2HE LYS 901 2HE LYS 901 -6.855 12.538 -0.594 662 1HZ LYS 901 1HZ LYS 901 -8.549 11.747 1.717 663 2HZ LYS 901 2HZ LYS 901 -8.949 12.962 0.598 664 3HZ LYS 901 3HZ LYS 901 -8.817 11.345 0.092 665 HA ILE 902 HA ILE 902 -2.278 7.617 -1.411 666 HB ILE 902 HB ILE 902 -1.706 5.158 -1.404 667 1HG1 ILE 902 1HG1 ILE 902 -3.793 5.075 0.491 668 2HG1 ILE 902 2HG1 ILE 902 -2.740 3.746 0.018 669 1HG2 ILE 902 1HG2 ILE 902 -0.182 6.858 -0.508 670 2HG2 ILE 902 2HG2 ILE 902 -0.977 6.759 1.062 671 3HG2 ILE 902 3HG2 ILE 902 -0.084 5.373 0.436 672 1HD1 ILE 902 1HD1 ILE 902 -2.166 5.728 2.243 673 2HD1 ILE 902 2HD1 ILE 902 -2.732 4.073 2.469 674 3HD1 ILE 902 3HD1 ILE 902 -1.137 4.374 1.780 675 HA PRO 903 HA PRO 903 -6.316 6.257 -3.183 676 1HB PRO 903 1HB PRO 903 -6.043 8.381 -5.102 677 2HB PRO 903 2HB PRO 903 -7.138 8.329 -3.716 678 1HG PRO 903 1HG PRO 903 -5.000 10.107 -4.008 679 2HG PRO 903 2HG PRO 903 -5.812 9.731 -2.481 680 1HD PRO 903 1HD PRO 903 -3.694 9.007 -1.836 681 2HD PRO 903 2HD PRO 903 -3.188 8.715 -3.522 682 HA ILE 904 HA ILE 904 -4.478 4.790 -6.915 683 HB ILE 904 HB ILE 904 -2.329 5.342 -5.095 684 1HG1 ILE 904 1HG1 ILE 904 -1.848 5.419 -8.000 685 2HG1 ILE 904 2HG1 ILE 904 -3.312 6.253 -7.487 686 1HG2 ILE 904 1HG2 ILE 904 -1.939 3.070 -7.039 687 2HG2 ILE 904 2HG2 ILE 904 -0.603 4.108 -6.548 688 3HG2 ILE 904 3HG2 ILE 904 -1.470 3.159 -5.342 689 1HD1 ILE 904 1HD1 ILE 904 -0.800 6.713 -5.926 690 2HD1 ILE 904 2HD1 ILE 904 -0.975 7.510 -7.489 691 3HD1 ILE 904 3HD1 ILE 904 -2.156 7.805 -6.212 692 HA ILE 905 HA ILE 905 -4.891 0.444 -6.862 693 HB ILE 905 HB ILE 905 -5.846 1.327 -8.984 694 1HG1 ILE 905 1HG1 ILE 905 -4.472 -0.892 -10.211 695 2HG1 ILE 905 2HG1 ILE 905 -4.812 -1.270 -8.524 696 1HG2 ILE 905 1HG2 ILE 905 -2.975 1.092 -9.929 697 2HG2 ILE 905 2HG2 ILE 905 -4.349 1.264 -11.019 698 3HG2 ILE 905 3HG2 ILE 905 -3.965 2.546 -9.877 699 1HD1 ILE 905 1HD1 ILE 905 -6.927 -0.047 -10.272 700 2HD1 ILE 905 2HD1 ILE 905 -6.646 -1.786 -10.287 701 3HD1 ILE 905 3HD1 ILE 905 -7.128 -0.979 -8.791 702 HA ILE 906 HA ILE 906 -0.655 -0.937 -7.808 703 HB ILE 906 HB ILE 906 -1.836 -1.542 -5.154 704 1HG1 ILE 906 1HG1 ILE 906 0.708 -0.331 -6.233 705 2HG1 ILE 906 2HG1 ILE 906 0.459 -0.596 -4.508 706 1HG2 ILE 906 1HG2 ILE 906 0.428 -3.159 -6.306 707 2HG2 ILE 906 2HG2 ILE 906 0.408 -2.764 -4.589 708 3HG2 ILE 906 3HG2 ILE 906 -0.913 -3.694 -5.293 709 1HD1 ILE 906 1HD1 ILE 906 -1.904 0.624 -5.369 710 2HD1 ILE 906 2HD1 ILE 906 -0.596 1.397 -4.475 711 3HD1 ILE 906 3HD1 ILE 906 -0.627 1.478 -6.235 712 HA ARG 907 HA ARG 907 -1.622 -5.015 -9.336 713 1HB ARG 907 1HB ARG 907 0.884 -3.969 -10.594 714 2HB ARG 907 2HB ARG 907 0.285 -5.572 -10.997 715 1HG ARG 907 1HG ARG 907 -0.616 -3.958 -12.589 716 2HG ARG 907 2HG ARG 907 -1.913 -4.575 -11.569 717 1HD ARG 907 1HD ARG 907 -2.271 -2.539 -10.561 718 2HD ARG 907 2HD ARG 907 -0.548 -2.113 -10.587 719 HE ARG 907 HE ARG 907 -0.904 -1.107 -12.690 720 1HH1 ARG 907 1HH1 ARG 907 -3.878 -2.133 -11.635 721 2HH1 ARG 907 2HH1 ARG 907 -4.570 -2.370 -13.205 722 1HH2 ARG 907 1HH2 ARG 907 -1.564 -1.970 -14.884 723 2HH2 ARG 907 2HH2 ARG 907 -3.261 -2.278 -15.043 724 HA ARG 908 HA ARG 908 1.214 -7.148 -6.625 725 1HB ARG 908 1HB ARG 908 -1.058 -8.882 -5.891 726 2HB ARG 908 2HB ARG 908 0.073 -8.045 -4.852 727 1HG ARG 908 1HG ARG 908 -1.234 -5.907 -5.346 728 2HG ARG 908 2HG ARG 908 -2.454 -6.928 -6.104 729 1HD ARG 908 1HD ARG 908 -3.012 -6.457 -3.674 730 2HD ARG 908 2HD ARG 908 -2.739 -8.188 -3.957 731 HE ARG 908 HE ARG 908 -0.303 -6.716 -3.272 732 1HH1 ARG 908 1HH1 ARG 908 -3.085 -7.270 -1.529 733 2HH1 ARG 908 2HH1 ARG 908 -2.356 -8.275 -0.321 734 1HH2 ARG 908 1HH2 ARG 908 0.675 -8.531 -1.985 735 2HH2 ARG 908 2HH2 ARG 908 -0.225 -8.984 -0.577 736 HA TYR 909 HA TYR 909 0.966 -10.412 -9.777 737 1HB TYR 909 1HB TYR 909 3.892 -9.815 -9.954 738 2HB TYR 909 2HB TYR 909 2.825 -10.443 -11.188 739 HD1 TYR 909 HD1 TYR 909 3.887 -7.343 -9.421 740 HD2 TYR 909 HD2 TYR 909 1.588 -8.994 -12.635 741 HE1 TYR 909 HE1 TYR 909 3.713 -5.118 -10.422 742 HE2 TYR 909 HE2 TYR 909 1.418 -6.768 -13.652 743 HH TYR 909 HH TYR 909 3.010 -4.532 -13.470 744 HA LEU 910 HA LEU 910 3.585 -12.889 -7.087 745 1HB LEU 910 1HB LEU 910 1.812 -14.610 -8.826 746 2HB LEU 910 2HB LEU 910 2.456 -15.119 -7.263 747 HG LEU 910 HG LEU 910 0.579 -12.800 -7.807 748 1HD1 LEU 910 1HD1 LEU 910 0.166 -15.574 -7.291 749 2HD1 LEU 910 2HD1 LEU 910 -0.343 -14.684 -5.862 750 3HD1 LEU 910 3HD1 LEU 910 -1.045 -14.303 -7.432 751 1HD2 LEU 910 1HD2 LEU 910 2.436 -13.219 -5.648 752 2HD2 LEU 910 2HD2 LEU 910 1.276 -11.909 -5.862 753 3HD2 LEU 910 3HD2 LEU 910 0.793 -13.386 -5.033 754 HA PRO 911 HA PRO 911 7.114 -14.128 -9.587 755 1HB PRO 911 1HB PRO 911 8.373 -14.903 -7.117 756 2HB PRO 911 2HB PRO 911 8.703 -13.466 -8.089 757 1HG PRO 911 1HG PRO 911 7.734 -12.176 -6.498 758 2HG PRO 911 2HG PRO 911 7.367 -13.615 -5.545 759 1HD PRO 911 1HD PRO 911 5.157 -13.384 -6.068 760 2HD PRO 911 2HD PRO 911 5.534 -11.973 -7.079 761 HA ASP 912 HA ASP 912 6.215 -18.424 -7.543 762 1HB ASP 912 1HB ASP 912 3.763 -17.052 -6.566 763 2HB ASP 912 2HB ASP 912 3.589 -18.769 -6.921 764 1HA GLY 913 1HA GLY 913 3.906 -17.370 -11.855 765 2HA GLY 913 2HA GLY 913 3.450 -18.934 -11.181 766 HA SER 914 HA SER 914 -0.225 -15.944 -11.710 767 1HB SER 914 1HB SER 914 -0.839 -15.540 -8.987 768 2HB SER 914 2HB SER 914 -1.196 -16.970 -9.943 769 HG SER 914 HG SER 914 0.057 -17.444 -8.080 770 HA TYR 915 HA TYR 915 -0.097 -11.790 -9.494 771 1HB TYR 915 1HB TYR 915 1.136 -11.456 -11.414 772 2HB TYR 915 2HB TYR 915 -0.024 -12.302 -12.425 773 HD1 TYR 915 HD1 TYR 915 -0.215 -9.191 -10.280 774 HD2 TYR 915 HD2 TYR 915 -0.778 -10.961 -14.153 775 HE1 TYR 915 HE1 TYR 915 -1.019 -7.024 -11.153 776 HE2 TYR 915 HE2 TYR 915 -1.577 -8.786 -15.026 777 HH TYR 915 HH TYR 915 -2.424 -6.724 -14.334 778 HA GLU 916 HA GLU 916 -4.229 -9.991 -10.478 779 1HB GLU 916 1HB GLU 916 -3.687 -11.031 -7.957 780 2HB GLU 916 2HB GLU 916 -4.281 -9.403 -7.628 781 1HG GLU 916 1HG GLU 916 -5.759 -11.032 -9.643 782 2HG GLU 916 2HG GLU 916 -5.958 -11.448 -7.941 783 HA ASP 917 HA ASP 917 -3.310 -5.668 -9.718 784 1HB ASP 917 1HB ASP 917 -4.184 -4.476 -11.729 785 2HB ASP 917 2HB ASP 917 -3.268 -5.923 -12.091 786 HA TRP 918 HA TRP 918 -6.497 -2.606 -8.731 787 1HB TRP 918 1HB TRP 918 -7.912 -3.718 -6.975 788 2HB TRP 918 2HB TRP 918 -7.965 -4.452 -8.558 789 HD1 TRP 918 HD1 TRP 918 -4.831 -5.762 -7.321 790 HE1 TRP 918 HE1 TRP 918 -5.204 -8.104 -6.291 791 HE3 TRP 918 HE3 TRP 918 -9.771 -5.468 -6.551 792 HZ2 TRP 918 HZ2 TRP 918 -7.418 -9.593 -5.131 793 HZ3 TRP 918 HZ3 TRP 918 -11.015 -7.224 -5.410 794 HH2 TRP 918 HH2 TRP 918 -9.866 -9.335 -4.702 795 1HA GLY 919 1HA GLY 919 -4.862 -2.303 -4.438 796 2HA GLY 919 2HA GLY 919 -4.668 -0.771 -5.275 797 HA VAL 920 HA VAL 920 -7.801 0.441 -2.458 798 HB VAL 920 HB VAL 920 -6.752 2.935 -3.838 799 1HG1 VAL 920 1HG1 VAL 920 -8.206 2.445 -1.233 800 2HG1 VAL 920 2HG1 VAL 920 -7.199 3.873 -1.472 801 3HG1 VAL 920 3HG1 VAL 920 -8.603 3.602 -2.504 802 1HG2 VAL 920 1HG2 VAL 920 -5.712 1.135 -1.659 803 2HG2 VAL 920 2HG2 VAL 920 -4.862 1.779 -3.063 804 3HG2 VAL 920 3HG2 VAL 920 -5.244 2.835 -1.708 805 HA ASP 921 HA ASP 921 -10.666 2.073 -5.750 806 1HB ASP 921 1HB ASP 921 -8.976 2.195 -7.613 807 2HB ASP 921 2HB ASP 921 -9.331 0.503 -7.971 808 HA GLU 922 HA GLU 922 -12.348 -2.148 -5.652 809 1HB GLU 922 1HB GLU 922 -10.479 -2.628 -7.410 810 2HB GLU 922 2HB GLU 922 -9.835 -3.705 -6.173 811 1HG GLU 922 1HG GLU 922 -11.679 -5.138 -6.263 812 2HG GLU 922 2HG GLU 922 -12.751 -3.877 -6.874 813 HA LEU 923 HA LEU 923 -10.673 -3.326 -1.562 814 1HB LEU 923 1HB LEU 923 -8.376 -4.506 -1.322 815 2HB LEU 923 2HB LEU 923 -9.472 -5.055 -2.572 816 HG LEU 923 HG LEU 923 -7.965 -2.968 -3.734 817 1HD1 LEU 923 1HD1 LEU 923 -6.222 -5.006 -2.329 818 2HD1 LEU 923 2HD1 LEU 923 -5.678 -3.830 -3.525 819 3HD1 LEU 923 3HD1 LEU 923 -6.278 -3.284 -1.962 820 1HD2 LEU 923 1HD2 LEU 923 -8.545 -5.789 -4.003 821 2HD2 LEU 923 2HD2 LEU 923 -8.373 -4.534 -5.232 822 3HD2 LEU 923 3HD2 LEU 923 -6.945 -5.356 -4.609 823 HA ILE 924 HA ILE 924 -8.308 -0.908 1.249 824 HB ILE 924 HB ILE 924 -7.167 -3.597 1.543 825 1HG1 ILE 924 1HG1 ILE 924 -7.907 -2.964 3.931 826 2HG1 ILE 924 2HG1 ILE 924 -8.597 -1.539 3.159 827 1HG2 ILE 924 1HG2 ILE 924 -5.079 -2.304 1.795 828 2HG2 ILE 924 2HG2 ILE 924 -5.857 -1.334 3.044 829 3HG2 ILE 924 3HG2 ILE 924 -5.594 -3.054 3.299 830 1HD1 ILE 924 3HD1 ILE 924 -9.123 -4.392 2.312 831 2HD1 ILE 924 1HD1 ILE 924 -10.237 -3.385 3.234 832 3HD1 ILE 924 2HD1 ILE 924 -9.814 -2.948 1.579 833 HA ILE 925 HA ILE 925 -4.495 0.823 -0.205 834 HB ILE 925 HB ILE 925 -4.140 2.826 1.253 835 1HG1 ILE 925 1HG1 ILE 925 -6.449 1.870 2.933 836 2HG1 ILE 925 2HG1 ILE 925 -4.807 1.393 3.350 837 1HG2 ILE 925 1HG2 ILE 925 -6.614 2.044 -0.056 838 2HG2 ILE 925 2HG2 ILE 925 -6.923 3.179 1.257 839 3HG2 ILE 925 3HG2 ILE 925 -5.809 3.613 -0.038 840 1HD1 ILE 925 1HD1 ILE 925 -4.692 4.162 2.799 841 2HD1 ILE 925 2HD1 ILE 925 -6.121 3.920 3.804 842 3HD1 ILE 925 3HD1 ILE 925 -4.542 3.379 4.372 843 HA THR 926 HA THR 926 -0.973 -0.173 2.461 844 HB THR 926 HB THR 926 -1.818 1.908 4.505 845 HG1 THR 926 HG1 THR 926 -1.240 2.438 2.169 846 1HG2 THR 926 1HG2 THR 926 0.759 0.380 4.105 847 2HG2 THR 926 2HG2 THR 926 0.661 1.859 5.060 848 3HG2 THR 926 3HG2 THR 926 -0.254 0.432 5.548 849 HA ASP 927 HA ASP 927 -4.010 -2.622 5.102 850 1HB ASP 927 1HB ASP 927 -2.438 -0.715 6.620 851 2HB ASP 927 2HB ASP 927 -3.766 -1.319 7.611 No H/Q in entry = 851 Start of MODEL 7 1 H1 MET 801 H1 MET 801 31.991 -0.764 36.114 2 H2 MET 801 H2 MET 801 30.390 -0.342 36.482 3 H3 MET 801 H3 MET 801 31.015 -1.835 37.001 4 HA MET 801 HA MET 801 31.061 -2.709 34.820 5 1HB MET 801 1HB MET 801 28.646 -1.151 35.705 6 2HB MET 801 2HB MET 801 28.588 -2.050 34.188 7 1HG MET 801 1HG MET 801 29.595 -3.995 35.671 8 2HG MET 801 2HG MET 801 28.867 -3.078 36.989 9 1HE MET 801 1HE MET 801 28.561 -5.868 35.981 10 2HE MET 801 2HE MET 801 27.187 -5.745 37.089 11 3HE MET 801 3HE MET 801 26.947 -6.334 35.446 12 HA SER 802 HA SER 802 30.710 2.440 33.227 13 1HB SER 802 1HB SER 802 32.322 0.401 31.706 14 2HB SER 802 2HB SER 802 32.636 2.120 31.916 15 HG SER 802 HG SER 802 33.033 1.664 34.139 16 HA ASP 803 HA ASP 803 28.806 0.677 29.367 17 1HB ASP 803 1HB ASP 803 30.342 -1.917 29.576 18 2HB ASP 803 2HB ASP 803 29.197 -1.618 28.268 19 HA ASN 804 HA ASN 804 25.537 -2.029 30.907 20 1HB ASN 804 1HB ASN 804 26.354 -0.800 32.977 21 2HB ASN 804 2HB ASN 804 25.125 0.422 32.643 22 2HD2 ASN 804 1HD2 ASN 804 25.248 -1.473 34.966 23 1HD2 ASN 804 2HD2 ASN 804 23.801 -2.357 34.910 24 HA GLU 805 HA GLU 805 22.649 0.156 28.153 25 1HB GLU 805 1HB GLU 805 23.042 -2.250 27.277 26 2HB GLU 805 2HB GLU 805 21.622 -2.685 28.229 27 1HG GLU 805 1HG GLU 805 21.305 -0.280 26.533 28 2HG GLU 805 2HG GLU 805 21.500 -1.797 25.654 29 HA ASP 806 HA ASP 806 18.988 0.120 30.733 30 1HB ASP 806 1HB ASP 806 20.901 0.203 32.334 31 2HB ASP 806 2HB ASP 806 20.973 1.953 32.118 32 HA ASN 807 HA ASN 807 17.793 4.015 28.626 33 1HB ASN 807 1HB ASN 807 15.496 2.044 28.795 34 2HB ASN 807 2HB ASN 807 15.316 3.657 28.103 35 2HD2 ASN 807 1HD2 ASN 807 15.480 3.571 25.864 36 1HD2 ASN 807 2HD2 ASN 807 16.530 2.557 24.998 37 HA PHE 808 HA PHE 808 15.532 5.105 32.497 38 1HB PHE 808 1HB PHE 808 14.435 6.259 30.260 39 2HB PHE 808 2HB PHE 808 12.992 5.899 31.208 40 HD1 PHE 808 HD1 PHE 808 12.694 6.863 33.466 41 HD2 PHE 808 HD2 PHE 808 16.063 7.886 31.007 42 HE1 PHE 808 HE1 PHE 808 13.169 8.809 34.927 43 HE2 PHE 808 HE2 PHE 808 16.538 9.833 32.468 44 HZ PHE 808 HZ PHE 808 15.090 10.295 34.428 45 HA ASP 809 HA ASP 809 12.199 1.832 33.108 46 1HB ASP 809 1HB ASP 809 11.182 4.507 33.130 47 2HB ASP 809 2HB ASP 809 9.816 3.416 32.895 48 1HA GLY 810 1HA GLY 810 9.879 -0.698 30.358 49 2HA GLY 810 2HA GLY 810 10.164 0.610 29.210 50 HA ASP 811 HA ASP 811 13.410 -1.741 27.325 51 1HB ASP 811 1HB ASP 811 11.396 -3.353 28.193 52 2HB ASP 811 2HB ASP 811 11.297 -3.636 26.455 53 HA ASP 812 HA ASP 812 12.446 -1.031 23.017 54 1HB ASP 812 1HB ASP 812 14.805 -1.847 23.188 55 2HB ASP 812 2HB ASP 812 14.246 -3.457 22.732 56 HA PHE 813 HA PHE 813 9.811 -4.545 21.706 57 1HB PHE 813 1HB PHE 813 9.552 -4.766 24.604 58 2HB PHE 813 2HB PHE 813 8.030 -5.135 23.792 59 HD1 PHE 813 HD1 PHE 813 8.122 -6.770 21.785 60 HD2 PHE 813 HD2 PHE 813 11.275 -6.365 24.674 61 HE1 PHE 813 HE1 PHE 813 9.008 -8.993 21.131 62 HE2 PHE 813 HE2 PHE 813 12.161 -8.587 24.020 63 HZ PHE 813 HZ PHE 813 11.027 -9.901 22.249 64 HA ASP 814 HA ASP 814 6.653 -1.429 20.960 65 1HB ASP 814 1HB ASP 814 6.262 -2.147 23.449 66 2HB ASP 814 2HB ASP 814 6.568 -0.446 23.807 67 HA ASP 815 HA ASP 815 8.362 2.630 20.439 68 1HB ASP 815 1HB ASP 815 9.474 1.808 22.771 69 2HB ASP 815 2HB ASP 815 10.935 2.211 21.869 70 HA VAL 816 HA VAL 816 11.662 1.876 17.441 71 HB VAL 816 HB VAL 816 9.861 -0.396 16.529 72 1HG1 VAL 816 1HG1 VAL 816 12.228 0.805 15.373 73 2HG1 VAL 816 2HG1 VAL 816 12.561 -0.861 15.846 74 3HG1 VAL 816 3HG1 VAL 816 11.231 -0.506 14.744 75 1HG2 VAL 816 1HG2 VAL 816 11.114 -0.289 18.907 76 2HG2 VAL 816 2HG2 VAL 816 10.983 -1.786 17.985 77 3HG2 VAL 816 3HG2 VAL 816 12.466 -0.834 17.915 78 HA GLU 817 HA GLU 817 8.795 3.663 14.321 79 1HB GLU 817 1HB GLU 817 7.553 4.581 16.839 80 2HB GLU 817 2HB GLU 817 7.347 5.684 15.479 81 1HG GLU 817 1HG GLU 817 6.771 3.410 14.202 82 2HG GLU 817 2HG GLU 817 5.540 4.297 15.103 83 HA GLU 818 HA GLU 818 11.190 7.641 15.051 84 1HB GLU 818 1HB GLU 818 12.483 6.187 17.316 85 2HB GLU 818 2HB GLU 818 13.377 7.533 16.607 86 1HG GLU 818 1HG GLU 818 10.488 7.985 17.176 87 2HG GLU 818 2HG GLU 818 11.572 7.894 18.564 88 HA ASP 819 HA ASP 819 14.093 6.240 12.003 89 1HB ASP 819 1HB ASP 819 13.233 8.654 11.463 90 2HB ASP 819 2HB ASP 819 14.828 9.162 12.018 91 HA GLU 820 HA GLU 820 17.914 6.655 14.341 92 1HB GLU 820 1HB GLU 820 16.387 5.316 15.876 93 2HB GLU 820 2HB GLU 820 16.994 3.863 15.079 94 1HG GLU 820 1HG GLU 820 19.349 4.996 15.636 95 2HG GLU 820 2HG GLU 820 18.401 5.740 16.925 96 1HA GLY 821 1HA GLY 821 21.261 5.261 11.767 97 2HA GLY 821 2HA GLY 821 20.159 3.889 11.635 98 HA LEU 822 HA LEU 822 19.711 5.992 7.638 99 1HB LEU 822 1HB LEU 822 20.847 8.526 8.827 100 2HB LEU 822 2HB LEU 822 20.261 8.479 7.164 101 HG LEU 822 HG LEU 822 18.410 7.252 9.093 102 1HD1 LEU 822 1HD1 LEU 822 19.487 9.984 9.528 103 2HD1 LEU 822 2HD1 LEU 822 17.731 9.831 9.582 104 3HD1 LEU 822 3HD1 LEU 822 18.733 8.876 10.673 105 1HD2 LEU 822 1HD2 LEU 822 18.237 9.351 6.911 106 2HD2 LEU 822 2HD2 LEU 822 17.731 7.665 6.814 107 3HD2 LEU 822 3HD2 LEU 822 16.840 8.795 7.834 108 HA ASP 823 HA ASP 823 24.379 6.377 6.529 109 1HB ASP 823 1HB ASP 823 24.911 5.457 8.916 110 2HB ASP 823 2HB ASP 823 24.908 3.877 8.130 111 HA ASP 824 HA ASP 824 22.664 2.982 3.951 112 1HB ASP 824 1HB ASP 824 23.369 0.652 4.505 113 2HB ASP 824 2HB ASP 824 24.526 1.850 5.081 114 HA LEU 825 HA LEU 825 18.645 1.400 5.301 115 1HB LEU 825 1HB LEU 825 18.969 3.419 7.496 116 2HB LEU 825 2HB LEU 825 17.383 2.693 7.243 117 HG LEU 825 HG LEU 825 19.359 0.615 7.127 118 1HD1 LEU 825 1HD1 LEU 825 20.650 2.354 8.496 119 2HD1 LEU 825 2HD1 LEU 825 19.420 2.136 9.741 120 3HD1 LEU 825 3HD1 LEU 825 20.431 0.775 9.250 121 1HD2 LEU 825 1HD2 LEU 825 16.885 0.563 7.784 122 2HD2 LEU 825 2HD2 LEU 825 17.972 -0.377 8.807 123 3HD2 LEU 825 3HD2 LEU 825 17.389 1.195 9.352 124 HA GLU 826 HA GLU 826 16.863 5.035 3.059 125 1HB GLU 826 1HB GLU 826 18.613 4.717 1.410 126 2HB GLU 826 2HB GLU 826 17.937 3.160 0.933 127 1HG GLU 826 1HG GLU 826 16.343 4.113 -0.379 128 2HG GLU 826 2HG GLU 826 16.034 5.409 0.775 129 HA ASN 827 HA ASN 827 14.354 0.347 2.796 130 1HB ASN 827 1HB ASN 827 13.810 1.932 4.659 131 2HB ASN 827 2HB ASN 827 13.111 3.033 3.472 132 2HD2 ASN 827 1HD2 ASN 827 10.959 2.753 4.476 133 1HD2 ASN 827 2HD2 ASN 827 10.070 1.328 4.224 134 HA ALA 828 HA ALA 828 13.322 2.393 -1.279 135 1HB ALA 828 1HB ALA 828 15.626 0.509 -1.761 136 2HB ALA 828 3HB ALA 828 15.539 2.242 -2.073 137 3HB ALA 828 2HB ALA 828 14.667 1.115 -3.111 138 HA GLU 829 HA GLU 829 11.311 -1.529 -2.607 139 1HB GLU 829 1HB GLU 829 14.001 -2.593 -3.283 140 2HB GLU 829 2HB GLU 829 12.694 -3.778 -3.248 141 1HG GLU 829 1HG GLU 829 11.579 -2.810 -5.020 142 2HG GLU 829 2HG GLU 829 12.178 -1.192 -4.649 143 HA GLU 830 HA GLU 830 13.717 -3.790 1.650 144 1HB GLU 830 1HB GLU 830 11.474 -2.195 1.448 145 2HB GLU 830 2HB GLU 830 10.769 -3.794 1.686 146 1HG GLU 830 1HG GLU 830 12.688 -3.931 3.551 147 2HG GLU 830 2HG GLU 830 12.472 -2.180 3.527 148 HA GLU 831 HA GLU 831 12.529 -7.142 -2.084 149 1HB GLU 831 1HB GLU 831 14.046 -7.296 0.306 150 2HB GLU 831 2HB GLU 831 12.830 -8.569 0.414 151 1HG GLU 831 1HG GLU 831 13.511 -9.119 -2.035 152 2HG GLU 831 2HG GLU 831 14.595 -9.617 -0.734 153 1HA GLY 832 1HA GLY 832 9.136 -9.219 0.716 154 2HA GLY 832 2HA GLY 832 8.516 -8.334 -0.680 155 HA GLN 833 HA GLN 833 8.085 -12.344 -2.507 156 1HB GLN 833 1HB GLN 833 7.852 -13.094 -0.158 157 2HB GLN 833 2HB GLN 833 6.694 -13.935 -1.193 158 1HG GLN 833 1HG GLN 833 6.109 -11.476 0.488 159 2HG GLN 833 2HG GLN 833 4.949 -12.308 -0.549 160 2HE2 GLN 833 1HE2 GLN 833 4.615 -12.039 2.331 161 1HE2 GLN 833 2HE2 GLN 833 4.673 -13.600 2.998 162 HA GLU 834 HA GLU 834 4.601 -11.195 -4.960 163 1HB GLU 834 1HB GLU 834 3.558 -10.888 -2.681 164 2HB GLU 834 2HB GLU 834 3.888 -9.161 -2.816 165 1HG GLU 834 1HG GLU 834 2.619 -9.865 -5.229 166 2HG GLU 834 2HG GLU 834 1.713 -10.696 -3.963 167 HA ASN 835 HA ASN 835 6.499 -7.575 -6.835 168 1HB ASN 835 1HB ASN 835 6.514 -7.775 -9.181 169 2HB ASN 835 2HB ASN 835 4.984 -8.640 -9.225 170 2HD2 ASN 835 1HD2 ASN 835 5.591 -10.662 -10.133 171 1HD2 ASN 835 2HD2 ASN 835 6.830 -11.648 -9.523 172 HA VAL 836 HA VAL 836 2.658 -5.476 -7.387 173 HB VAL 836 HB VAL 836 2.032 -5.088 -5.276 174 1HG1 VAL 836 1HG1 VAL 836 4.948 -5.581 -4.661 175 2HG1 VAL 836 2HG1 VAL 836 3.630 -5.658 -3.492 176 3HG1 VAL 836 3HG1 VAL 836 3.694 -6.806 -4.824 177 1HG2 VAL 836 1HG2 VAL 836 4.284 -3.073 -5.250 178 2HG2 VAL 836 2HG2 VAL 836 2.556 -2.761 -5.354 179 3HG2 VAL 836 3HG2 VAL 836 3.261 -3.357 -3.855 180 HA GLU 837 HA GLU 837 4.290 -1.683 -8.965 181 1HB GLU 837 1HB GLU 837 3.266 -3.262 -10.835 182 2HB GLU 837 2HB GLU 837 1.960 -2.083 -10.806 183 1HG GLU 837 1HG GLU 837 3.251 -0.438 -11.721 184 2HG GLU 837 2HG GLU 837 4.699 -0.955 -10.856 185 HA ILE 838 HA ILE 838 0.589 0.748 -8.064 186 HB ILE 838 HB ILE 838 3.230 1.717 -7.652 187 1HG1 ILE 838 1HG1 ILE 838 0.589 1.889 -6.330 188 2HG1 ILE 838 2HG1 ILE 838 1.781 3.083 -5.829 189 1HG2 ILE 838 1HG2 ILE 838 2.724 3.568 -9.192 190 2HG2 ILE 838 2HG2 ILE 838 1.289 3.961 -8.244 191 3HG2 ILE 838 3HG2 ILE 838 2.894 4.153 -7.537 192 1HD1 ILE 838 2HD1 ILE 838 2.542 0.173 -6.018 193 2HD1 ILE 838 3HD1 ILE 838 3.275 1.446 -5.043 194 3HD1 ILE 838 1HD1 ILE 838 1.709 0.779 -4.587 195 HA LEU 839 HA LEU 839 -0.291 4.047 -11.112 196 1HB LEU 839 1HB LEU 839 -1.269 1.365 -11.335 197 2HB LEU 839 2HB LEU 839 -2.599 2.450 -11.739 198 HG LEU 839 HG LEU 839 -0.576 3.656 -13.092 199 1HD1 LEU 839 1HD1 LEU 839 0.252 0.879 -12.543 200 2HD1 LEU 839 2HD1 LEU 839 0.307 1.325 -14.248 201 3HD1 LEU 839 3HD1 LEU 839 1.218 2.260 -13.063 202 1HD2 LEU 839 1HD2 LEU 839 -2.373 1.376 -13.973 203 2HD2 LEU 839 2HD2 LEU 839 -2.707 3.104 -14.091 204 3HD2 LEU 839 3HD2 LEU 839 -1.453 2.377 -15.096 205 HA PRO 840 HA PRO 840 -3.498 6.504 -9.349 206 1HB PRO 840 1HB PRO 840 -3.991 7.914 -11.043 207 2HB PRO 840 2HB PRO 840 -5.134 6.737 -11.697 208 1HG PRO 840 1HG PRO 840 -2.577 7.493 -12.765 209 2HG PRO 840 2HG PRO 840 -3.699 6.287 -13.403 210 1HD PRO 840 1HD PRO 840 -2.260 4.637 -12.768 211 2HD PRO 840 2HD PRO 840 -1.165 5.845 -12.051 212 HA SER 841 HA SER 841 -6.350 3.330 -8.132 213 1HB SER 841 1HB SER 841 -7.017 4.324 -6.224 214 2HB SER 841 2HB SER 841 -6.789 5.928 -6.913 215 HG SER 841 HG SER 841 -8.844 5.928 -7.611 216 1HA GLY 842 1HA GLY 842 -10.061 2.189 -10.303 217 2HA GLY 842 2HA GLY 842 -9.951 3.900 -10.710 218 HA GLU 843 HA GLU 843 -7.936 1.729 -14.171 219 1HB GLU 843 1HB GLU 843 -6.146 0.352 -12.174 220 2HB GLU 843 2HB GLU 843 -5.849 0.159 -13.903 221 1HG GLU 843 1HG GLU 843 -6.104 2.841 -12.512 222 2HG GLU 843 2HG GLU 843 -4.566 2.058 -12.880 223 HA ARG 844 HA ARG 844 -9.897 -2.441 -14.009 224 1HB ARG 844 1HB ARG 844 -11.830 -2.080 -12.881 225 2HB ARG 844 2HB ARG 844 -12.049 -0.491 -13.604 226 1HG ARG 844 1HG ARG 844 -13.042 -1.405 -15.565 227 2HG ARG 844 2HG ARG 844 -12.477 -3.032 -15.185 228 1HD ARG 844 1HD ARG 844 -13.934 -2.670 -12.987 229 2HD ARG 844 2HD ARG 844 -14.791 -1.516 -14.030 230 HE ARG 844 HE ARG 844 -14.320 -3.954 -15.475 231 1HH1 ARG 844 1HH1 ARG 844 -16.762 -2.060 -14.373 232 2HH1 ARG 844 2HH1 ARG 844 -17.864 -3.339 -13.982 233 1HH2 ARG 844 1HH2 ARG 844 -15.500 -5.848 -14.354 234 2HH2 ARG 844 2HH2 ARG 844 -17.148 -5.483 -13.971 235 HA PRO 845 HA PRO 845 -11.545 -1.512 -18.458 236 1HB PRO 845 1HB PRO 845 -10.974 1.256 -19.000 237 2HB PRO 845 2HB PRO 845 -12.553 0.474 -18.899 238 1HG PRO 845 1HG PRO 845 -11.427 2.331 -17.053 239 2HG PRO 845 2HG PRO 845 -12.957 1.461 -16.901 240 1HD PRO 845 1HD PRO 845 -12.050 0.250 -15.184 241 2HD PRO 845 2HD PRO 845 -10.459 0.997 -15.453 242 HA GLN 846 HA GLN 846 -7.429 -1.680 -20.075 243 1HB GLN 846 1HB GLN 846 -7.059 0.171 -18.473 244 2HB GLN 846 2HB GLN 846 -6.583 -1.003 -17.244 245 1HG GLN 846 1HG GLN 846 -4.546 -1.411 -18.222 246 2HG GLN 846 2HG GLN 846 -5.160 -1.148 -19.855 247 2HE2 GLN 846 1HE2 GLN 846 -2.882 0.130 -18.025 248 1HE2 GLN 846 2HE2 GLN 846 -3.072 1.788 -18.334 249 HA ALA 847 HA ALA 847 -6.455 -5.736 -18.126 250 1HB ALA 847 1HB ALA 847 -5.293 -4.104 -15.851 251 2HB ALA 847 3HB ALA 847 -4.509 -4.529 -17.373 252 3HB ALA 847 2HB ALA 847 -4.827 -5.776 -16.167 253 HA ASN 848 HA ASN 848 -9.654 -5.708 -14.400 254 1HB ASN 848 1HB ASN 848 -11.244 -4.779 -16.073 255 2HB ASN 848 2HB ASN 848 -11.230 -6.326 -16.921 256 2HD2 ASN 848 1HD2 ASN 848 -11.532 -5.371 -13.443 257 1HD2 ASN 848 2HD2 ASN 848 -12.904 -6.328 -13.154 258 HA GLN 849 HA GLN 849 -9.260 -10.147 -14.833 259 1HB GLN 849 1HB GLN 849 -6.965 -9.112 -15.434 260 2HB GLN 849 2HB GLN 849 -6.974 -10.783 -14.873 261 1HG GLN 849 1HG GLN 849 -6.775 -8.841 -12.678 262 2HG GLN 849 2HG GLN 849 -5.795 -10.268 -13.005 263 2HE2 GLN 849 1HE2 GLN 849 -4.034 -8.641 -12.272 264 1HE2 GLN 849 2HE2 GLN 849 -3.351 -7.652 -13.461 265 HA LYS 850 HA LYS 850 -8.014 -10.884 -10.186 266 1HB LYS 850 1HB LYS 850 -10.019 -12.345 -11.794 267 2HB LYS 850 2HB LYS 850 -9.568 -13.149 -10.291 268 1HG LYS 850 1HG LYS 850 -9.950 -10.295 -9.876 269 2HG LYS 850 2HG LYS 850 -11.394 -11.038 -10.564 270 1HD LYS 850 1HD LYS 850 -11.004 -12.890 -8.765 271 2HD LYS 850 2HD LYS 850 -9.998 -11.675 -7.974 272 1HE LYS 850 1HE LYS 850 -12.169 -10.152 -8.486 273 2HE LYS 850 2HE LYS 850 -12.039 -11.133 -7.013 274 1HZ LYS 850 1HZ LYS 850 -13.120 -12.160 -9.584 275 2HZ LYS 850 2HZ LYS 850 -13.198 -12.904 -8.059 276 3HZ LYS 850 3HZ LYS 850 -14.107 -11.504 -8.372 277 HA ARG 851 HA ARG 851 -6.144 -15.089 -10.062 278 1HB ARG 851 1HB ARG 851 -4.687 -12.649 -10.184 279 2HB ARG 851 2HB ARG 851 -3.864 -13.680 -9.014 280 1HG ARG 851 1HG ARG 851 -4.736 -14.697 -11.724 281 2HG ARG 851 2HG ARG 851 -3.152 -13.969 -11.456 282 1HD ARG 851 1HD ARG 851 -3.370 -15.791 -9.361 283 2HD ARG 851 2HD ARG 851 -2.483 -16.071 -10.873 284 HE ARG 851 HE ARG 851 -5.076 -17.215 -10.170 285 1HH1 ARG 851 1HH1 ARG 851 -2.559 -17.451 -12.294 286 2HH1 ARG 851 2HH1 ARG 851 -3.507 -17.828 -13.693 287 1HH2 ARG 851 1HH2 ARG 851 -6.534 -17.117 -12.159 288 2HH2 ARG 851 2HH2 ARG 851 -5.757 -17.640 -13.616 289 HA ILE 852 HA ILE 852 -6.011 -14.996 -5.439 290 HB ILE 852 HB ILE 852 -3.584 -15.494 -4.619 291 1HG1 ILE 852 1HG1 ILE 852 -1.876 -15.429 -6.321 292 2HG1 ILE 852 2HG1 ILE 852 -3.026 -14.910 -7.547 293 1HG2 ILE 852 1HG2 ILE 852 -5.358 -16.939 -5.891 294 2HG2 ILE 852 2HG2 ILE 852 -4.291 -16.709 -7.275 295 3HG2 ILE 852 3HG2 ILE 852 -3.688 -17.500 -5.818 296 1HD1 ILE 852 3HD1 ILE 852 -2.601 -13.209 -5.104 297 2HD1 ILE 852 1HD1 ILE 852 -1.449 -13.126 -6.429 298 3HD1 ILE 852 2HD1 ILE 852 -3.132 -12.733 -6.712 299 HA THR 853 HA THR 853 -3.577 -11.112 -3.629 300 HB THR 853 HB THR 853 -4.298 -8.873 -4.506 301 HG1 THR 853 HG1 THR 853 -5.468 -10.497 -6.513 302 1HG2 THR 853 1HG2 THR 853 -3.074 -10.848 -6.438 303 2HG2 THR 853 2HG2 THR 853 -3.039 -9.104 -6.654 304 3HG2 THR 853 3HG2 THR 853 -2.216 -9.839 -5.281 305 HA THR 854 HA THR 854 -7.211 -11.737 -1.193 306 HB THR 854 HB THR 854 -5.021 -10.257 0.280 307 HG1 THR 854 HG1 THR 854 -4.547 -12.328 0.306 308 1HG2 THR 854 1HG2 THR 854 -7.384 -9.556 1.015 309 2HG2 THR 854 2HG2 THR 854 -7.575 -11.214 1.574 310 3HG2 THR 854 3HG2 THR 854 -6.319 -10.191 2.267 311 HA PRO 855 HA PRO 855 -9.226 -7.944 -2.480 312 1HB PRO 855 1HB PRO 855 -11.370 -8.731 -2.377 313 2HB PRO 855 2HB PRO 855 -11.368 -8.494 -0.626 314 1HG PRO 855 1HG PRO 855 -11.327 -10.975 -2.056 315 2HG PRO 855 2HG PRO 855 -11.248 -10.740 -0.307 316 1HD PRO 855 1HD PRO 855 -9.068 -11.444 -0.348 317 2HD PRO 855 2HD PRO 855 -9.109 -11.543 -2.126 318 HA TYR 856 HA TYR 856 -7.949 -5.239 0.804 319 1HB TYR 856 1HB TYR 856 -8.628 -7.147 2.168 320 2HB TYR 856 2HB TYR 856 -7.083 -7.926 1.893 321 HD1 TYR 856 HD1 TYR 856 -4.955 -6.536 2.674 322 HD2 TYR 856 HD2 TYR 856 -8.954 -5.876 4.089 323 HE1 TYR 856 HE1 TYR 856 -4.056 -5.446 4.696 324 HE2 TYR 856 HE2 TYR 856 -8.053 -4.781 6.115 325 HH TYR 856 HH TYR 856 -4.827 -5.021 7.049 326 HA MET 857 HA MET 857 -3.858 -5.113 -1.172 327 1HB MET 857 1HB MET 857 -4.844 -2.830 -1.493 328 2HB MET 857 2HB MET 857 -4.357 -2.433 0.148 329 1HG MET 857 1HG MET 857 -2.069 -3.514 -1.151 330 2HG MET 857 2HG MET 857 -2.317 -1.858 -0.609 331 1HE MET 857 3HE MET 857 -4.629 -0.791 -2.141 332 2HE MET 857 1HE MET 857 -3.104 0.070 -1.996 333 3HE MET 857 2HE MET 857 -3.885 -0.070 -3.568 334 HA THR 858 HA THR 858 -1.728 -5.116 2.794 335 HB THR 858 HB THR 858 0.038 -6.843 2.486 336 HG1 THR 858 HG1 THR 858 0.742 -6.033 0.432 337 1HG2 THR 858 1HG2 THR 858 -2.551 -7.189 0.953 338 2HG2 THR 858 2HG2 THR 858 -1.538 -8.512 1.534 339 3HG2 THR 858 3HG2 THR 858 -2.328 -7.435 2.685 340 HA LYS 859 HA LYS 859 0.948 -1.811 3.632 341 1HB LYS 859 1HB LYS 859 2.808 -2.566 5.120 342 2HB LYS 859 2HB LYS 859 1.227 -3.156 5.628 343 1HG LYS 859 1HG LYS 859 1.675 -5.344 4.949 344 2HG LYS 859 2HG LYS 859 2.910 -4.840 3.796 345 1HD LYS 859 1HD LYS 859 4.545 -4.963 5.348 346 2HD LYS 859 2HD LYS 859 3.591 -4.060 6.526 347 1HE LYS 859 1HE LYS 859 2.293 -6.175 6.993 348 2HE LYS 859 2HE LYS 859 4.016 -6.316 7.394 349 1HZ LYS 859 1HZ LYS 859 4.391 -7.241 5.176 350 2HZ LYS 859 2HZ LYS 859 3.281 -8.190 6.039 351 3HZ LYS 859 3HZ LYS 859 2.731 -7.131 4.830 352 HA TYR 860 HA TYR 860 4.800 -3.206 1.171 353 1HB TYR 860 1HB TYR 860 4.659 -5.611 1.000 354 2HB TYR 860 2HB TYR 860 3.362 -5.509 -0.186 355 HD1 TYR 860 HD1 TYR 860 3.880 -4.047 -2.306 356 HD2 TYR 860 HD2 TYR 860 6.914 -5.723 0.223 357 HE1 TYR 860 HE1 TYR 860 5.539 -3.724 -4.097 358 HE2 TYR 860 HE2 TYR 860 8.571 -5.402 -1.589 359 HH TYR 860 HH TYR 860 8.536 -3.526 -3.815 360 HA GLU 861 HA GLU 861 2.217 -2.341 -2.925 361 1HB GLU 861 1HB GLU 861 -0.197 -2.685 -1.134 362 2HB GLU 861 2HB GLU 861 -0.296 -1.740 -2.620 363 1HG GLU 861 1HG GLU 861 0.912 -3.913 -3.618 364 2HG GLU 861 2HG GLU 861 -0.843 -3.806 -3.486 365 HA ARG 862 HA ARG 862 1.241 1.557 -0.159 366 1HB ARG 862 1HB ARG 862 0.203 0.721 1.801 367 2HB ARG 862 2HB ARG 862 1.576 -0.307 2.190 368 1HG ARG 862 1HG ARG 862 2.217 2.573 2.041 369 2HG ARG 862 2HG ARG 862 1.120 2.141 3.346 370 1HD ARG 862 1HD ARG 862 2.712 0.911 4.465 371 2HD ARG 862 2HD ARG 862 3.498 0.382 2.966 372 HE ARG 862 HE ARG 862 4.198 2.896 2.795 373 1HH1 ARG 862 1HH1 ARG 862 3.869 4.442 4.873 374 2HH1 ARG 862 2HH1 ARG 862 4.909 3.936 6.162 375 1HH2 ARG 862 1HH2 ARG 862 5.490 0.794 4.817 376 2HH2 ARG 862 2HH2 ARG 862 5.827 1.871 6.131 377 HA ALA 863 HA ALA 863 5.772 1.189 1.394 378 1HB ALA 863 2HB ALA 863 6.501 -1.579 0.628 379 2HB ALA 863 3HB ALA 863 6.950 -0.660 2.064 380 3HB ALA 863 1HB ALA 863 5.369 -1.437 1.972 381 HA ARG 864 HA ARG 864 6.931 0.335 -3.072 382 1HB ARG 864 1HB ARG 864 4.674 -1.419 -3.247 383 2HB ARG 864 2HB ARG 864 4.568 -0.303 -4.609 384 1HG ARG 864 1HG ARG 864 5.911 -2.286 -5.204 385 2HG ARG 864 2HG ARG 864 7.005 -1.950 -3.864 386 1HD ARG 864 1HD ARG 864 6.557 0.337 -5.700 387 2HD ARG 864 2HD ARG 864 8.075 -0.291 -5.028 388 HE ARG 864 HE ARG 864 6.631 -1.640 -7.281 389 1HH1 ARG 864 1HH1 ARG 864 8.913 -3.004 -5.782 390 2HH1 ARG 864 2HH1 ARG 864 10.250 -2.666 -6.831 391 1HH2 ARG 864 1HH2 ARG 864 8.591 -0.168 -8.573 392 2HH2 ARG 864 2HH2 ARG 864 10.066 -1.060 -8.412 393 HA VAL 865 HA VAL 865 3.099 3.397 -4.077 394 HB VAL 865 HB VAL 865 2.434 2.131 -1.484 395 1HG1 VAL 865 1HG1 VAL 865 2.097 5.039 -1.871 396 2HG1 VAL 865 2HG1 VAL 865 0.786 4.140 -1.108 397 3HG1 VAL 865 3HG1 VAL 865 2.400 4.117 -0.399 398 1HG2 VAL 865 1HG2 VAL 865 1.164 2.833 -3.996 399 2HG2 VAL 865 2HG2 VAL 865 0.934 1.435 -2.953 400 3HG2 VAL 865 3HG2 VAL 865 0.122 2.953 -2.579 401 HA LEU 866 HA LEU 866 4.975 5.959 -0.228 402 1HB LEU 866 1HB LEU 866 5.246 4.538 1.585 403 2HB LEU 866 2HB LEU 866 5.788 3.203 0.576 404 HG LEU 866 HG LEU 866 7.669 5.489 0.729 405 1HD1 LEU 866 1HD1 LEU 866 6.630 5.228 3.073 406 2HD1 LEU 866 2HD1 LEU 866 7.426 3.655 3.116 407 3HD1 LEU 866 3HD1 LEU 866 8.387 5.125 2.960 408 1HD2 LEU 866 1HD2 LEU 866 7.763 2.475 0.822 409 2HD2 LEU 866 2HD2 LEU 866 8.471 3.559 -0.375 410 3HD2 LEU 866 3HD2 LEU 866 9.184 3.433 1.231 411 1HA GLY 867 1HA GLY 867 9.059 4.967 -2.498 412 2HA GLY 867 2HA GLY 867 8.517 3.582 -3.454 413 HA THR 868 HA THR 868 6.766 6.275 -6.476 414 HB THR 868 HB THR 868 4.653 5.667 -7.346 415 HG1 THR 868 HG1 THR 868 3.163 5.948 -5.854 416 1HG2 THR 868 1HG2 THR 868 6.471 3.847 -6.570 417 2HG2 THR 868 2HG2 THR 868 5.036 3.245 -5.737 418 3HG2 THR 868 3HG2 THR 868 5.019 3.453 -7.489 419 HA ARG 869 HA ARG 869 3.915 9.013 -3.852 420 1HB ARG 869 1HB ARG 869 4.275 7.001 -1.769 421 2HB ARG 869 2HB ARG 869 4.572 8.610 -1.110 422 1HG ARG 869 1HG ARG 869 2.388 9.321 -2.225 423 2HG ARG 869 2HG ARG 869 2.230 8.229 -0.850 424 1HD ARG 869 1HD ARG 869 2.569 6.620 -3.195 425 2HD ARG 869 2HD ARG 869 1.116 6.774 -2.187 426 HE ARG 869 HE ARG 869 1.738 8.726 -4.372 427 1HH1 ARG 869 1HH1 ARG 869 -0.179 6.085 -3.587 428 2HH1 ARG 869 2HH1 ARG 869 -1.687 6.839 -3.985 429 1HH2 ARG 869 1HH2 ARG 869 -0.298 9.981 -4.453 430 2HH2 ARG 869 2HH2 ARG 869 -1.754 9.045 -4.474 431 HA ALA 870 HA ALA 870 8.172 10.144 -1.786 432 1HB ALA 870 3HB ALA 870 8.907 8.093 -0.852 433 2HB ALA 870 2HB ALA 870 10.179 8.522 -1.997 434 3HB ALA 870 1HB ALA 870 8.973 7.312 -2.432 435 HA LEU 871 HA LEU 871 10.069 10.284 -5.988 436 1HB LEU 871 1HB LEU 871 9.041 8.794 -8.152 437 2HB LEU 871 2HB LEU 871 10.593 8.570 -7.361 438 HG LEU 871 HG LEU 871 8.216 7.321 -6.085 439 1HD1 LEU 871 1HD1 LEU 871 7.932 6.857 -8.503 440 2HD1 LEU 871 2HD1 LEU 871 9.568 6.201 -8.545 441 3HD1 LEU 871 3HD1 LEU 871 8.323 5.401 -7.586 442 1HD2 LEU 871 1HD2 LEU 871 11.114 6.561 -6.564 443 2HD2 LEU 871 2HD2 LEU 871 10.405 7.100 -5.041 444 3HD2 LEU 871 3HD2 LEU 871 9.957 5.534 -5.718 445 HA GLN 872 HA GLN 872 5.792 11.191 -8.258 446 1HB GLN 872 1HB GLN 872 4.874 10.298 -5.588 447 2HB GLN 872 2HB GLN 872 4.057 11.734 -6.194 448 1HG GLN 872 1HG GLN 872 3.281 10.606 -8.144 449 2HG GLN 872 2HG GLN 872 4.397 9.263 -7.896 450 2HE2 GLN 872 1HE2 GLN 872 2.594 7.715 -7.835 451 1HE2 GLN 872 2HE2 GLN 872 1.571 7.623 -6.483 452 HA ILE 873 HA ILE 873 6.147 15.045 -5.317 453 HB ILE 873 HB ILE 873 7.354 14.767 -2.982 454 1HG1 ILE 873 1HG1 ILE 873 6.209 12.278 -2.399 455 2HG1 ILE 873 2HG1 ILE 873 7.054 12.028 -3.920 456 1HG2 ILE 873 1HG2 ILE 873 4.574 14.211 -3.867 457 2HG2 ILE 873 2HG2 ILE 873 4.969 13.962 -2.169 458 3HG2 ILE 873 3HG2 ILE 873 5.200 15.547 -2.902 459 1HD1 ILE 873 1HD1 ILE 873 8.369 13.443 -1.629 460 2HD1 ILE 873 2HD1 ILE 873 8.389 11.690 -1.767 461 3HD1 ILE 873 3HD1 ILE 873 9.112 12.680 -3.031 462 HA ALA 874 HA ALA 874 10.906 14.263 -4.864 463 1HB ALA 874 2HB ALA 874 10.684 11.803 -6.609 464 2HB ALA 874 1HB ALA 874 10.885 11.760 -4.860 465 3HB ALA 874 3HB ALA 874 12.157 12.430 -5.874 466 HA MET 875 HA MET 875 10.447 15.441 -9.306 467 1HB MET 875 1HB MET 875 8.985 13.614 -10.127 468 2HB MET 875 2HB MET 875 7.573 14.431 -9.457 469 1HG MET 875 1HG MET 875 8.570 16.439 -10.966 470 2HG MET 875 2HG MET 875 9.145 15.060 -11.902 471 1HE MET 875 3HE MET 875 8.195 14.079 -13.441 472 2HE MET 875 2HE MET 875 6.498 13.959 -13.925 473 3HE MET 875 1HE MET 875 7.381 15.465 -14.163 474 HA CYS 876 HA CYS 876 7.615 18.596 -7.333 475 1HB CYS 876 1HB CYS 876 6.656 18.589 -9.607 476 2HB CYS 876 2HB CYS 876 5.372 17.502 -9.085 477 HG CYS 876 HG CYS 876 5.618 20.491 -8.215 478 HA ALA 877 HA ALA 877 4.589 15.667 -4.932 479 1HB ALA 877 3HB ALA 877 4.645 17.694 -3.897 480 2HB ALA 877 1HB ALA 877 3.851 18.517 -5.241 481 3HB ALA 877 2HB ALA 877 2.902 17.546 -4.114 482 HA PRO 878 HA PRO 878 0.779 14.900 -7.740 483 1HB PRO 878 1HB PRO 878 1.706 12.198 -8.020 484 2HB PRO 878 2HB PRO 878 1.533 13.411 -9.293 485 1HG PRO 878 1HG PRO 878 3.781 13.548 -9.447 486 2HG PRO 878 2HG PRO 878 3.952 12.382 -8.141 487 1HD PRO 878 1HD PRO 878 4.670 14.045 -6.769 488 2HD PRO 878 2HD PRO 878 4.425 15.225 -8.073 489 HA VAL 879 HA VAL 879 1.212 11.595 -3.983 490 HB VAL 879 HB VAL 879 2.866 13.954 -3.144 491 1HG1 VAL 879 1HG1 VAL 879 1.320 13.370 -1.197 492 2HG1 VAL 879 2HG1 VAL 879 2.169 11.833 -1.130 493 3HG1 VAL 879 3HG1 VAL 879 3.040 13.337 -0.878 494 1HG2 VAL 879 1HG2 VAL 879 3.554 11.651 -4.311 495 2HG2 VAL 879 2HG2 VAL 879 4.617 12.460 -3.178 496 3HG2 VAL 879 3HG2 VAL 879 3.625 11.119 -2.635 497 HA MET 880 HA MET 880 -2.413 13.591 -2.416 498 1HB MET 880 1HB MET 880 -2.157 11.144 -1.524 499 2HB MET 880 2HB MET 880 -1.977 11.924 0.048 500 1HG MET 880 1HG MET 880 -4.126 13.175 -0.437 501 2HG MET 880 2HG MET 880 -4.320 11.434 -0.229 502 1HE MET 880 1HE MET 880 -6.066 13.519 -1.247 503 2HE MET 880 2HE MET 880 -5.556 14.281 -2.759 504 3HE MET 880 3HE MET 880 -6.806 13.040 -2.773 505 HA VAL 881 HA VAL 881 -0.897 16.561 0.554 506 HB VAL 881 HB VAL 881 1.078 16.179 2.108 507 1HG1 VAL 881 1HG1 VAL 881 -1.356 14.849 1.971 508 2HG1 VAL 881 2HG1 VAL 881 -0.199 13.530 2.135 509 3HG1 VAL 881 3HG1 VAL 881 -0.255 14.814 3.341 510 1HG2 VAL 881 1HG2 VAL 881 2.259 14.850 0.144 511 2HG2 VAL 881 2HG2 VAL 881 2.542 14.394 1.824 512 3HG2 VAL 881 3HG2 VAL 881 1.398 13.478 0.843 513 HA GLU 882 HA GLU 882 2.440 18.603 -1.660 514 1HB GLU 882 1HB GLU 882 0.058 19.758 -1.421 515 2HB GLU 882 2HB GLU 882 0.995 20.961 -0.534 516 1HG GLU 882 1HG GLU 882 2.405 21.394 -2.407 517 2HG GLU 882 2HG GLU 882 1.832 19.961 -3.261 518 HA LEU 883 HA LEU 883 4.785 19.762 2.238 519 1HB LEU 883 1HB LEU 883 5.703 17.504 1.909 520 2HB LEU 883 2HB LEU 883 6.549 18.041 0.459 521 HG LEU 883 HG LEU 883 7.689 19.785 1.958 522 1HD1 LEU 883 1HD1 LEU 883 5.908 19.227 3.808 523 2HD1 LEU 883 2HD1 LEU 883 7.008 17.906 4.204 524 3HD1 LEU 883 3HD1 LEU 883 7.569 19.577 4.283 525 1HD2 LEU 883 3HD2 LEU 883 8.191 16.834 2.470 526 2HD2 LEU 883 1HD2 LEU 883 8.837 17.768 1.121 527 3HD2 LEU 883 2HD2 LEU 883 9.345 18.132 2.770 528 HA GLU 884 HA GLU 884 6.815 22.537 -0.894 529 1HB GLU 884 1HB GLU 884 8.768 21.223 0.716 530 2HB GLU 884 2HB GLU 884 9.589 21.849 -0.712 531 1HG GLU 884 1HG GLU 884 8.073 23.991 -0.157 532 2HG GLU 884 2HG GLU 884 9.656 23.753 0.581 533 1HA GLY 885 1HA GLY 885 7.112 19.558 -4.817 534 2HA GLY 885 2HA GLY 885 8.493 20.651 -4.700 535 HA GLU 886 HA GLU 886 9.942 16.378 -2.431 536 1HB GLU 886 1HB GLU 886 10.517 16.334 -4.718 537 2HB GLU 886 2HB GLU 886 11.372 17.871 -4.626 538 1HG GLU 886 1HG GLU 886 13.160 16.826 -3.313 539 2HG GLU 886 2HG GLU 886 12.284 15.295 -3.311 540 HA THR 887 HA THR 887 13.586 17.646 -0.146 541 HB THR 887 HB THR 887 11.085 17.903 1.576 542 HG1 THR 887 HG1 THR 887 12.570 19.733 0.001 543 1HG2 THR 887 1HG2 THR 887 13.963 18.575 2.051 544 2HG2 THR 887 2HG2 THR 887 12.731 19.658 2.696 545 3HG2 THR 887 3HG2 THR 887 12.755 17.962 3.180 546 HA ASP 888 HA ASP 888 12.899 14.082 2.784 547 1HB ASP 888 1HB ASP 888 10.508 15.048 3.326 548 2HB ASP 888 2HB ASP 888 9.982 13.586 2.497 549 HA PRO 889 HA PRO 889 13.074 11.036 -0.448 550 1HB PRO 889 1HB PRO 889 13.651 8.938 1.430 551 2HB PRO 889 2HB PRO 889 14.785 9.814 0.399 552 1HG PRO 889 1HG PRO 889 14.550 9.992 3.229 553 2HG PRO 889 2HG PRO 889 15.581 10.967 2.177 554 1HD PRO 889 1HD PRO 889 14.293 12.777 2.690 555 2HD PRO 889 2HD PRO 889 13.124 11.749 3.559 556 HA LEU 890 HA LEU 890 8.851 9.543 0.690 557 1HB LEU 890 1HB LEU 890 10.476 7.712 1.151 558 2HB LEU 890 2HB LEU 890 8.907 7.404 1.871 559 HG LEU 890 HG LEU 890 10.872 6.858 3.355 560 1HD1 LEU 890 1HD1 LEU 890 12.199 8.914 2.652 561 2HD1 LEU 890 2HD1 LEU 890 11.140 9.844 3.710 562 3HD1 LEU 890 3HD1 LEU 890 12.160 8.572 4.377 563 1HD2 LEU 890 1HD2 LEU 890 8.439 7.734 4.013 564 2HD2 LEU 890 2HD2 LEU 890 9.661 7.364 5.228 565 3HD2 LEU 890 3HD2 LEU 890 9.388 9.034 4.734 566 HA LEU 891 HA LEU 891 7.842 11.161 5.290 567 1HB LEU 891 1HB LEU 891 8.847 13.237 5.438 568 2HB LEU 891 2HB LEU 891 8.663 13.530 3.720 569 HG LEU 891 HG LEU 891 7.323 15.052 5.231 570 1HD1 LEU 891 1HD1 LEU 891 6.687 14.124 2.738 571 2HD1 LEU 891 2HD1 LEU 891 5.221 13.732 3.638 572 3HD1 LEU 891 3HD1 LEU 891 5.801 15.392 3.580 573 1HD2 LEU 891 1HD2 LEU 891 6.579 12.639 6.421 574 2HD2 LEU 891 2HD2 LEU 891 5.886 14.226 6.755 575 3HD2 LEU 891 3HD2 LEU 891 5.133 13.168 5.562 576 HA ILE 892 HA ILE 892 4.293 12.640 2.329 577 HB ILE 892 HB ILE 892 6.492 12.298 0.396 578 1HG1 ILE 892 1HG1 ILE 892 4.207 14.069 -0.131 579 2HG1 ILE 892 2HG1 ILE 892 5.050 14.359 1.391 580 1HG2 ILE 892 1HG2 ILE 892 3.717 11.390 -0.197 581 2HG2 ILE 892 2HG2 ILE 892 4.592 12.295 -1.421 582 3HG2 ILE 892 3HG2 ILE 892 5.258 10.789 -0.812 583 1HD1 ILE 892 1HD1 ILE 892 6.670 13.858 -1.039 584 2HD1 ILE 892 2HD1 ILE 892 5.907 15.434 -0.871 585 3HD1 ILE 892 3HD1 ILE 892 7.034 14.859 0.359 586 HA ALA 893 HA ALA 893 4.232 8.136 0.807 587 1HB ALA 893 3HB ALA 893 6.232 7.314 0.076 588 2HB ALA 893 1HB ALA 893 7.116 7.993 1.439 589 3HB ALA 893 2HB ALA 893 6.207 6.499 1.635 590 HA MET 894 HA MET 894 4.262 7.181 5.450 591 1HB MET 894 1HB MET 894 5.360 8.293 7.264 592 2HB MET 894 2HB MET 894 5.494 9.798 6.360 593 1HG MET 894 1HG MET 894 6.888 7.331 5.377 594 2HG MET 894 2HG MET 894 7.277 9.026 5.087 595 1HE MET 894 3HE MET 894 7.630 10.664 7.106 596 2HE MET 894 2HE MET 894 9.075 10.318 8.066 597 3HE MET 894 1HE MET 894 9.145 10.241 6.308 598 HA LYS 895 HA LYS 895 1.836 11.305 6.409 599 1HB LYS 895 1HB LYS 895 3.156 13.074 5.535 600 2HB LYS 895 2HB LYS 895 3.170 12.374 3.918 601 1HG LYS 895 1HG LYS 895 1.682 14.294 3.929 602 2HG LYS 895 2HG LYS 895 0.717 12.830 3.751 603 1HD LYS 895 1HD LYS 895 0.625 12.938 6.390 604 2HD LYS 895 2HD LYS 895 -0.467 13.932 5.425 605 1HE LYS 895 1HE LYS 895 2.241 14.995 6.238 606 2HE LYS 895 2HE LYS 895 0.765 15.897 5.838 607 1HZ LYS 895 1HZ LYS 895 1.071 14.083 8.174 608 2HZ LYS 895 2HZ LYS 895 1.143 15.779 8.250 609 3HZ LYS 895 3HZ LYS 895 -0.300 15.007 7.795 610 HA GLU 896 HA GLU 896 -0.496 10.284 2.205 611 1HB GLU 896 1HB GLU 896 2.037 8.879 1.509 612 2HB GLU 896 2HB GLU 896 0.555 8.164 0.900 613 1HG GLU 896 1HG GLU 896 0.781 11.103 0.602 614 2HG GLU 896 2HG GLU 896 1.866 10.136 -0.396 615 HA LEU 897 HA LEU 897 -1.064 5.937 3.855 616 1HB LEU 897 1HB LEU 897 1.204 4.948 3.678 617 2HB LEU 897 2HB LEU 897 1.629 5.674 5.227 618 HG LEU 897 HG LEU 897 0.669 3.139 4.982 619 1HD1 LEU 897 1HD1 LEU 897 1.597 4.396 6.993 620 2HD1 LEU 897 2HD1 LEU 897 -0.055 4.921 7.315 621 3HD1 LEU 897 3HD1 LEU 897 0.347 3.204 7.349 622 1HD2 LEU 897 1HD2 LEU 897 -1.557 4.295 4.192 623 2HD2 LEU 897 2HD2 LEU 897 -1.650 2.995 5.371 624 3HD2 LEU 897 3HD2 LEU 897 -1.767 4.665 5.901 625 HA LYS 898 HA LYS 898 -0.395 7.482 8.513 626 1HB LYS 898 1HB LYS 898 1.654 8.795 8.073 627 2HB LYS 898 2HB LYS 898 0.695 9.952 7.153 628 1HG LYS 898 1HG LYS 898 -0.352 10.810 9.041 629 2HG LYS 898 2HG LYS 898 -0.085 9.343 9.985 630 1HD LYS 898 1HD LYS 898 2.361 10.751 9.072 631 2HD LYS 898 2HD LYS 898 1.400 11.594 10.286 632 1HE LYS 898 1HE LYS 898 1.436 9.530 11.702 633 2HE LYS 898 2HE LYS 898 2.514 8.774 10.511 634 1HZ LYS 898 1HZ LYS 898 3.944 10.804 10.745 635 2HZ LYS 898 2HZ LYS 898 3.004 11.240 12.087 636 3HZ LYS 898 3HZ LYS 898 3.902 9.799 12.114 637 HA ALA 899 HA ALA 899 -3.549 10.533 6.838 638 1HB ALA 899 3HB ALA 899 -3.704 11.532 4.615 639 2HB ALA 899 1HB ALA 899 -2.007 11.513 5.092 640 3HB ALA 899 2HB ALA 899 -2.615 10.313 3.951 641 HA ARG 900 HA ARG 900 -4.025 5.844 4.320 642 1HB ARG 900 1HB ARG 900 -5.364 5.198 6.055 643 2HB ARG 900 2HB ARG 900 -4.970 6.741 6.800 644 1HG ARG 900 1HG ARG 900 -6.946 7.687 5.413 645 2HG ARG 900 2HG ARG 900 -7.413 6.002 5.194 646 1HD ARG 900 1HD ARG 900 -6.751 6.719 7.986 647 2HD ARG 900 2HD ARG 900 -8.195 7.519 7.334 648 HE ARG 900 HE ARG 900 -8.097 4.693 6.646 649 1HH1 ARG 900 1HH1 ARG 900 -10.488 6.490 7.420 650 2HH1 ARG 900 2HH1 ARG 900 -10.987 5.731 8.894 651 1HH2 ARG 900 1HH2 ARG 900 -8.051 3.922 9.264 652 2HH2 ARG 900 2HH2 ARG 900 -9.607 4.276 9.939 653 HA LYS 901 HA LYS 901 -6.735 8.550 1.904 654 1HB LYS 901 1HB LYS 901 -6.096 10.816 1.170 655 2HB LYS 901 2HB LYS 901 -4.465 10.547 1.783 656 1HG LYS 901 1HG LYS 901 -5.211 10.506 4.041 657 2HG LYS 901 2HG LYS 901 -6.074 11.857 3.306 658 1HD LYS 901 1HD LYS 901 -7.841 9.915 2.772 659 2HD LYS 901 2HD LYS 901 -7.102 9.211 4.210 660 1HE LYS 901 1HE LYS 901 -7.480 11.872 4.940 661 2HE LYS 901 2HE LYS 901 -8.557 10.530 5.379 662 1HZ LYS 901 1HZ LYS 901 -8.706 12.023 2.809 663 2HZ LYS 901 2HZ LYS 901 -9.820 10.882 3.397 664 3HZ LYS 901 3HZ LYS 901 -9.669 12.391 4.159 665 HA ILE 902 HA ILE 902 -2.886 7.968 -1.322 666 HB ILE 902 HB ILE 902 -2.008 5.602 -1.247 667 1HG1 ILE 902 1HG1 ILE 902 -4.136 5.269 0.562 668 2HG1 ILE 902 2HG1 ILE 902 -2.891 4.087 0.174 669 1HG2 ILE 902 1HG2 ILE 902 -1.587 7.426 1.129 670 2HG2 ILE 902 2HG2 ILE 902 -0.567 6.033 0.772 671 3HG2 ILE 902 3HG2 ILE 902 -0.653 7.376 -0.366 672 1HD1 ILE 902 3HD1 ILE 902 -2.603 6.201 2.332 673 2HD1 ILE 902 1HD1 ILE 902 -3.118 4.542 2.635 674 3HD1 ILE 902 2HD1 ILE 902 -1.503 4.862 2.006 675 HA PRO 903 HA PRO 903 -6.715 6.099 -3.113 676 1HB PRO 903 1HB PRO 903 -6.702 8.226 -5.048 677 2HB PRO 903 2HB PRO 903 -7.786 8.047 -3.664 678 1HG PRO 903 1HG PRO 903 -5.885 10.075 -3.965 679 2HG PRO 903 2HG PRO 903 -6.657 9.616 -2.441 680 1HD PRO 903 1HD PRO 903 -4.476 9.166 -1.771 681 2HD PRO 903 2HD PRO 903 -3.918 8.932 -3.448 682 HA ILE 904 HA ILE 904 -4.762 4.846 -6.867 683 HB ILE 904 HB ILE 904 -2.692 5.444 -4.979 684 1HG1 ILE 904 1HG1 ILE 904 -2.087 5.567 -7.853 685 2HG1 ILE 904 2HG1 ILE 904 -3.620 6.318 -7.419 686 1HG2 ILE 904 1HG2 ILE 904 -2.137 3.228 -6.952 687 2HG2 ILE 904 2HG2 ILE 904 -0.867 4.282 -6.338 688 3HG2 ILE 904 3HG2 ILE 904 -1.783 3.265 -5.227 689 1HD1 ILE 904 2HD1 ILE 904 -2.447 7.627 -5.653 690 2HD1 ILE 904 3HD1 ILE 904 -0.918 6.927 -6.185 691 3HD1 ILE 904 1HD1 ILE 904 -1.830 7.978 -7.268 692 HA ILE 905 HA ILE 905 -5.042 0.480 -6.876 693 HB ILE 905 HB ILE 905 -6.105 1.371 -8.951 694 1HG1 ILE 905 1HG1 ILE 905 -4.763 -0.824 -10.238 695 2HG1 ILE 905 2HG1 ILE 905 -4.985 -1.208 -8.532 696 1HG2 ILE 905 1HG2 ILE 905 -3.617 2.260 -9.603 697 2HG2 ILE 905 2HG2 ILE 905 -3.699 0.799 -10.580 698 3HG2 ILE 905 3HG2 ILE 905 -4.917 2.059 -10.773 699 1HD1 ILE 905 1HD1 ILE 905 -7.245 -0.028 -10.114 700 2HD1 ILE 905 2HD1 ILE 905 -6.912 -1.756 -10.204 701 3HD1 ILE 905 3HD1 ILE 905 -7.312 -1.011 -8.653 702 HA ILE 906 HA ILE 906 -0.789 -0.731 -7.937 703 HB ILE 906 HB ILE 906 -1.939 -1.690 -5.344 704 1HG1 ILE 906 1HG1 ILE 906 0.365 0.025 -6.244 705 2HG1 ILE 906 2HG1 ILE 906 0.158 -0.450 -4.559 706 1HG2 ILE 906 1HG2 ILE 906 0.458 -2.873 -6.678 707 2HG2 ILE 906 2HG2 ILE 906 0.577 -2.515 -4.957 708 3HG2 ILE 906 3HG2 ILE 906 -0.673 -3.611 -5.545 709 1HD1 ILE 906 1HD1 ILE 906 -2.367 0.441 -5.278 710 2HD1 ILE 906 2HD1 ILE 906 -1.170 1.378 -4.383 711 3HD1 ILE 906 3HD1 ILE 906 -1.295 1.547 -6.131 712 HA ARG 907 HA ARG 907 -1.571 -4.817 -9.545 713 1HB ARG 907 1HB ARG 907 0.971 -3.700 -10.666 714 2HB ARG 907 2HB ARG 907 0.387 -5.289 -11.156 715 1HG ARG 907 1HG ARG 907 -0.502 -3.626 -12.691 716 2HG ARG 907 2HG ARG 907 -1.809 -4.287 -11.712 717 1HD ARG 907 1HD ARG 907 -2.199 -2.290 -10.645 718 2HD ARG 907 2HD ARG 907 -0.477 -1.858 -10.614 719 HE ARG 907 HE ARG 907 -0.770 -0.801 -12.707 720 1HH1 ARG 907 1HH1 ARG 907 -1.576 -2.926 -14.444 721 2HH1 ARG 907 2HH1 ARG 907 -3.233 -2.586 -14.816 722 1HH2 ARG 907 1HH2 ARG 907 -3.658 -0.407 -12.154 723 2HH2 ARG 907 2HH2 ARG 907 -4.412 -1.160 -13.518 724 HA ARG 908 HA ARG 908 0.998 -7.047 -6.654 725 1HB ARG 908 1HB ARG 908 -1.876 -8.010 -6.666 726 2HB ARG 908 2HB ARG 908 -0.649 -8.797 -5.684 727 1HG ARG 908 1HG ARG 908 -0.224 -6.517 -4.621 728 2HG ARG 908 2HG ARG 908 -1.669 -5.950 -5.457 729 1HD ARG 908 1HD ARG 908 -2.500 -8.354 -4.238 730 2HD ARG 908 2HD ARG 908 -2.852 -6.724 -3.621 731 HE ARG 908 HE ARG 908 -0.214 -7.339 -2.820 732 1HH1 ARG 908 1HH1 ARG 908 -3.307 -7.349 -1.639 733 2HH1 ARG 908 2HH1 ARG 908 -3.050 -8.547 -0.415 734 1HH2 ARG 908 1HH2 ARG 908 0.098 -9.430 -1.571 735 2HH2 ARG 908 2HH2 ARG 908 -1.120 -9.725 -0.376 736 HA TYR 909 HA TYR 909 1.126 -10.239 -9.927 737 1HB TYR 909 1HB TYR 909 4.016 -9.556 -10.118 738 2HB TYR 909 2HB TYR 909 2.926 -10.113 -11.367 739 HD1 TYR 909 HD1 TYR 909 4.030 -7.150 -9.442 740 HD2 TYR 909 HD2 TYR 909 1.673 -8.574 -12.719 741 HE1 TYR 909 HE1 TYR 909 3.852 -4.860 -10.282 742 HE2 TYR 909 HE2 TYR 909 1.498 -6.280 -13.580 743 HH TYR 909 HH TYR 909 3.062 -4.078 -13.298 744 HA LEU 910 HA LEU 910 3.854 -12.672 -7.319 745 1HB LEU 910 1HB LEU 910 2.035 -14.378 -9.018 746 2HB LEU 910 2HB LEU 910 2.745 -14.907 -7.491 747 HG LEU 910 HG LEU 910 0.789 -12.639 -7.941 748 1HD1 LEU 910 1HD1 LEU 910 0.637 -15.445 -7.100 749 2HD1 LEU 910 2HD1 LEU 910 -0.177 -14.337 -5.999 750 3HD1 LEU 910 3HD1 LEU 910 -0.630 -14.379 -7.705 751 1HD2 LEU 910 1HD2 LEU 910 2.765 -12.966 -5.871 752 2HD2 LEU 910 2HD2 LEU 910 1.550 -11.699 -6.041 753 3HD2 LEU 910 3HD2 LEU 910 1.161 -13.184 -5.176 754 HA PRO 911 HA PRO 911 7.247 -13.925 -10.025 755 1HB PRO 911 1HB PRO 911 8.671 -14.613 -7.621 756 2HB PRO 911 2HB PRO 911 8.925 -13.203 -8.654 757 1HG PRO 911 1HG PRO 911 8.046 -11.873 -7.047 758 2HG PRO 911 2HG PRO 911 7.771 -13.282 -6.023 759 1HD PRO 911 1HD PRO 911 5.524 -13.114 -6.399 760 2HD PRO 911 2HD PRO 911 5.802 -11.711 -7.455 761 HA ASP 912 HA ASP 912 6.482 -18.137 -7.742 762 1HB ASP 912 1HB ASP 912 4.086 -16.712 -6.703 763 2HB ASP 912 2HB ASP 912 3.895 -18.447 -6.962 764 1HA GLY 913 1HA GLY 913 3.920 -17.370 -11.940 765 2HA GLY 913 2HA GLY 913 3.450 -18.864 -11.133 766 HA SER 914 HA SER 914 -0.154 -15.801 -11.757 767 1HB SER 914 1HB SER 914 0.414 -16.136 -8.827 768 2HB SER 914 2HB SER 914 -1.099 -15.396 -9.340 769 HG SER 914 HG SER 914 -1.674 -17.432 -9.482 770 HA TYR 915 HA TYR 915 0.033 -11.589 -9.616 771 1HB TYR 915 1HB TYR 915 1.291 -11.325 -11.541 772 2HB TYR 915 2HB TYR 915 0.113 -12.152 -12.549 773 HD1 TYR 915 HD1 TYR 915 -0.143 -9.058 -10.395 774 HD2 TYR 915 HD2 TYR 915 -0.478 -10.770 -14.319 775 HE1 TYR 915 HE1 TYR 915 -0.899 -6.878 -11.280 776 HE2 TYR 915 HE2 TYR 915 -1.236 -8.584 -15.203 777 HH TYR 915 HH TYR 915 -0.990 -6.156 -14.551 778 HA GLU 916 HA GLU 916 -4.100 -9.834 -10.711 779 1HB GLU 916 1HB GLU 916 -3.672 -10.930 -8.190 780 2HB GLU 916 2HB GLU 916 -4.326 -9.326 -7.857 781 1HG GLU 916 1HG GLU 916 -5.660 -10.873 -10.014 782 2HG GLU 916 2HG GLU 916 -5.903 -11.446 -8.364 783 HA ASP 917 HA ASP 917 -3.277 -5.501 -9.912 784 1HB ASP 917 1HB ASP 917 -4.272 -4.280 -11.834 785 2HB ASP 917 2HB ASP 917 -3.361 -5.699 -12.307 786 HA TRP 918 HA TRP 918 -6.512 -2.572 -8.677 787 1HB TRP 918 1HB TRP 918 -7.944 -3.783 -7.048 788 2HB TRP 918 2HB TRP 918 -7.936 -4.489 -8.643 789 HD1 TRP 918 HD1 TRP 918 -4.817 -5.778 -7.408 790 HE1 TRP 918 HE1 TRP 918 -5.163 -8.135 -6.400 791 HE3 TRP 918 HE3 TRP 918 -9.760 -5.537 -6.630 792 HZ2 TRP 918 HZ2 TRP 918 -7.375 -9.657 -5.258 793 HZ3 TRP 918 HZ3 TRP 918 -10.988 -7.318 -5.507 794 HH2 TRP 918 HH2 TRP 918 -9.821 -9.424 -4.825 795 1HA GLY 919 1HA GLY 919 -4.863 -2.547 -4.404 796 2HA GLY 919 2HA GLY 919 -4.618 -0.981 -5.159 797 HA VAL 920 HA VAL 920 -7.710 0.181 -2.282 798 HB VAL 920 HB VAL 920 -6.618 2.691 -3.600 799 1HG1 VAL 920 1HG1 VAL 920 -8.151 2.175 -1.055 800 2HG1 VAL 920 2HG1 VAL 920 -7.036 3.538 -1.164 801 3HG1 VAL 920 3HG1 VAL 920 -8.411 3.433 -2.264 802 1HG2 VAL 920 1HG2 VAL 920 -5.598 0.755 -1.554 803 2HG2 VAL 920 2HG2 VAL 920 -4.721 1.594 -2.833 804 3HG2 VAL 920 3HG2 VAL 920 -5.185 2.459 -1.370 805 HA ASP 921 HA ASP 921 -10.617 1.960 -5.453 806 1HB ASP 921 1HB ASP 921 -8.980 2.170 -7.341 807 2HB ASP 921 2HB ASP 921 -9.306 0.485 -7.754 808 HA GLU 922 HA GLU 922 -12.327 -2.253 -5.511 809 1HB GLU 922 1HB GLU 922 -10.482 -2.671 -7.315 810 2HB GLU 922 2HB GLU 922 -9.831 -3.802 -6.132 811 1HG GLU 922 1HG GLU 922 -11.661 -5.233 -6.284 812 2HG GLU 922 2HG GLU 922 -12.758 -3.938 -6.767 813 HA LEU 923 HA LEU 923 -10.607 -3.615 -1.504 814 1HB LEU 923 1HB LEU 923 -8.308 -4.798 -1.327 815 2HB LEU 923 2HB LEU 923 -9.406 -5.296 -2.595 816 HG LEU 923 HG LEU 923 -7.893 -3.150 -3.655 817 1HD1 LEU 923 1HD1 LEU 923 -6.183 -5.277 -2.346 818 2HD1 LEU 923 2HD1 LEU 923 -5.615 -4.088 -3.517 819 3HD1 LEU 923 3HD1 LEU 923 -6.191 -3.564 -1.938 820 1HD2 LEU 923 1HD2 LEU 923 -8.495 -5.952 -4.080 821 2HD2 LEU 923 2HD2 LEU 923 -8.341 -4.626 -5.236 822 3HD2 LEU 923 3HD2 LEU 923 -6.903 -5.485 -4.682 823 HA ILE 924 HA ILE 924 -8.244 -1.300 1.388 824 HB ILE 924 HB ILE 924 -7.084 -3.990 1.578 825 1HG1 ILE 924 1HG1 ILE 924 -7.819 -3.452 3.989 826 2HG1 ILE 924 2HG1 ILE 924 -8.511 -1.996 3.280 827 1HG2 ILE 924 1HG2 ILE 924 -5.005 -2.659 1.868 828 2HG2 ILE 924 2HG2 ILE 924 -5.791 -1.786 3.181 829 3HG2 ILE 924 3HG2 ILE 924 -5.492 -3.513 3.325 830 1HD1 ILE 924 3HD1 ILE 924 -9.043 -4.809 2.310 831 2HD1 ILE 924 1HD1 ILE 924 -10.149 -3.852 3.295 832 3HD1 ILE 924 2HD1 ILE 924 -9.749 -3.332 1.658 833 HA ILE 925 HA ILE 925 -4.464 0.551 -0.004 834 HB ILE 925 HB ILE 925 -4.077 2.447 1.595 835 1HG1 ILE 925 1HG1 ILE 925 -6.433 1.602 3.208 836 2HG1 ILE 925 2HG1 ILE 925 -4.926 0.743 3.521 837 1HG2 ILE 925 1HG2 ILE 925 -6.552 1.771 0.224 838 2HG2 ILE 925 2HG2 ILE 925 -6.852 2.830 1.602 839 3HG2 ILE 925 3HG2 ILE 925 -5.727 3.325 0.337 840 1HD1 ILE 925 1HD1 ILE 925 -5.127 3.763 3.449 841 2HD1 ILE 925 2HD1 ILE 925 -5.273 2.820 4.933 842 3HD1 ILE 925 3HD1 ILE 925 -3.766 2.794 4.015 843 HA THR 926 HA THR 926 -0.924 -0.591 2.610 844 HB THR 926 HB THR 926 -1.794 1.174 4.913 845 HG1 THR 926 HG1 THR 926 -1.598 2.519 3.234 846 1HG2 THR 926 1HG2 THR 926 0.893 0.031 4.113 847 2HG2 THR 926 2HG2 THR 926 0.660 1.227 5.385 848 3HG2 THR 926 3HG2 THR 926 -0.042 -0.381 5.548 849 HA ASP 927 HA ASP 927 -3.947 -3.159 5.164 850 1HB ASP 927 1HB ASP 927 -3.312 -3.045 7.571 851 2HB ASP 927 2HB ASP 927 -1.961 -2.617 6.523 No H/Q in entry = 851 Start of MODEL 8 1 HA MET 801 HA MET 801 -13.276 -34.985 26.532 2 1HB MET 801 1HB MET 801 -14.722 -33.331 27.730 3 2HB MET 801 2HB MET 801 -14.232 -34.672 28.764 4 1HG MET 801 1HG MET 801 -12.424 -32.311 28.728 5 2HG MET 801 2HG MET 801 -13.985 -32.089 29.516 6 1HE MET 801 2HE MET 801 -15.016 -33.499 30.900 7 2HE MET 801 3HE MET 801 -14.362 -34.753 31.963 8 3HE MET 801 1HE MET 801 -14.174 -33.052 32.381 9 HA SER 802 HA SER 802 -9.506 -31.745 25.339 10 1HB SER 802 1HB SER 802 -10.587 -32.830 23.479 11 2HB SER 802 2HB SER 802 -12.158 -32.178 23.938 12 HG SER 802 HG SER 802 -11.632 -30.611 22.638 13 HA ASP 803 HA ASP 803 -12.152 -28.467 27.164 14 1HB ASP 803 1HB ASP 803 -11.519 -30.251 29.304 15 2HB ASP 803 2HB ASP 803 -11.142 -28.614 29.840 16 HA ASN 804 HA ASN 804 -9.171 -25.131 26.022 17 1HB ASN 804 1HB ASN 804 -9.528 -25.693 28.963 18 2HB ASN 804 2HB ASN 804 -8.346 -24.500 28.421 19 2HD2 ASN 804 1HD2 ASN 804 -11.718 -25.046 28.994 20 1HD2 ASN 804 2HD2 ASN 804 -12.280 -23.565 28.384 21 HA GLU 805 HA GLU 805 -5.856 -28.353 26.066 22 1HB GLU 805 1HB GLU 805 -6.366 -28.078 23.638 23 2HB GLU 805 2HB GLU 805 -5.469 -26.559 23.646 24 1HG GLU 805 1HG GLU 805 -3.443 -27.603 23.702 25 2HG GLU 805 2HG GLU 805 -4.018 -28.875 24.780 26 HA ASP 806 HA ASP 806 -3.390 -25.193 28.108 27 1HB ASP 806 1HB ASP 806 -2.908 -27.970 29.151 28 2HB ASP 806 2HB ASP 806 -1.829 -26.664 29.649 29 HA ASN 807 HA ASN 807 0.124 -26.125 25.399 30 1HB ASN 807 1HB ASN 807 -1.897 -25.062 23.926 31 2HB ASN 807 2HB ASN 807 -0.750 -23.723 23.876 32 2HD2 ASN 807 1HD2 ASN 807 0.754 -23.873 22.212 33 1HD2 ASN 807 2HD2 ASN 807 1.256 -25.318 21.476 34 HA PHE 808 HA PHE 808 2.188 -22.261 26.679 35 1HB PHE 808 1HB PHE 808 3.599 -23.903 24.998 36 2HB PHE 808 2HB PHE 808 3.957 -22.321 24.309 37 HD1 PHE 808 HD1 PHE 808 3.907 -24.198 27.542 38 HD2 PHE 808 HD2 PHE 808 5.534 -20.896 25.328 39 HE1 PHE 808 HE1 PHE 808 5.516 -23.760 29.378 40 HE2 PHE 808 HE2 PHE 808 7.143 -20.458 27.162 41 HZ PHE 808 HZ PHE 808 7.134 -21.890 29.188 42 HA ASP 809 HA ASP 809 1.119 -19.017 23.559 43 1HB ASP 809 1HB ASP 809 3.784 -19.876 22.609 44 2HB ASP 809 2HB ASP 809 3.007 -18.656 21.599 45 1HA GLY 810 1HA GLY 810 -0.615 -20.875 19.780 46 2HA GLY 810 2HA GLY 810 -2.031 -21.119 20.803 47 HA ASP 811 HA ASP 811 -2.360 -16.846 18.961 48 1HB ASP 811 1HB ASP 811 -2.318 -16.256 21.938 49 2HB ASP 811 2HB ASP 811 -3.178 -15.267 20.756 50 HA ASP 812 HA ASP 812 0.989 -13.886 19.104 51 1HB ASP 812 1HB ASP 812 -1.381 -12.300 18.067 52 2HB ASP 812 2HB ASP 812 0.304 -11.843 17.815 53 HA PHE 813 HA PHE 813 -0.320 -11.067 22.545 54 1HB PHE 813 1HB PHE 813 -2.130 -12.688 23.182 55 2HB PHE 813 2HB PHE 813 -0.933 -13.601 24.101 56 HD1 PHE 813 HD1 PHE 813 -1.748 -9.955 23.682 57 HD2 PHE 813 HD2 PHE 813 -1.081 -13.222 26.391 58 HE1 PHE 813 HE1 PHE 813 -2.054 -8.422 25.607 59 HE2 PHE 813 HE2 PHE 813 -1.388 -11.689 28.316 60 HZ PHE 813 HZ PHE 813 -1.874 -9.289 27.924 61 HA ASP 814 HA ASP 814 3.612 -12.189 24.461 62 1HB ASP 814 1HB ASP 814 5.026 -14.124 23.769 63 2HB ASP 814 2HB ASP 814 3.326 -14.569 23.923 64 HA ASP 815 HA ASP 815 6.078 -9.730 21.651 65 1HB ASP 815 1HB ASP 815 4.420 -11.138 19.645 66 2HB ASP 815 2HB ASP 815 5.307 -9.746 19.023 67 HA VAL 816 HA VAL 816 3.561 -6.037 21.047 68 HB VAL 816 HB VAL 816 1.012 -5.986 21.164 69 1HG1 VAL 816 1HG1 VAL 816 2.710 -7.718 19.463 70 2HG1 VAL 816 2HG1 VAL 816 0.980 -8.044 19.389 71 3HG1 VAL 816 3HG1 VAL 816 1.592 -6.436 19.004 72 1HG2 VAL 816 1HG2 VAL 816 0.777 -7.731 22.908 73 2HG2 VAL 816 2HG2 VAL 816 -0.116 -8.160 21.449 74 3HG2 VAL 816 3HG2 VAL 816 1.435 -8.927 21.792 75 HA GLU 817 HA GLU 817 2.907 -5.010 25.406 76 1HB GLU 817 1HB GLU 817 4.904 -5.328 26.855 77 2HB GLU 817 2HB GLU 817 4.545 -6.773 25.912 78 1HG GLU 817 1HG GLU 817 6.296 -6.290 24.342 79 2HG GLU 817 2HG GLU 817 6.533 -4.675 25.011 80 HA GLU 818 HA GLU 818 4.781 -1.045 23.967 81 1HB GLU 818 1HB GLU 818 6.587 -2.362 25.584 82 2HB GLU 818 2HB GLU 818 7.646 -1.575 24.414 83 1HG GLU 818 1HG GLU 818 6.998 0.557 25.052 84 2HG GLU 818 2HG GLU 818 5.413 0.021 25.611 85 HA ASP 819 HA ASP 819 7.169 -0.865 20.150 86 1HB ASP 819 1HB ASP 819 4.903 1.150 20.186 87 2HB ASP 819 2HB ASP 819 5.815 0.742 18.733 88 HA GLU 820 HA GLU 820 9.586 2.829 20.941 89 1HB GLU 820 1HB GLU 820 11.010 0.371 20.690 90 2HB GLU 820 2HB GLU 820 11.896 1.579 19.759 91 1HG GLU 820 1HG GLU 820 11.331 3.034 21.971 92 2HG GLU 820 2HG GLU 820 11.419 1.423 22.685 93 1HA GLY 821 1HA GLY 821 7.910 4.328 16.733 94 2HA GLY 821 2HA GLY 821 9.614 4.717 16.969 95 HA LEU 822 HA LEU 822 9.927 0.818 14.510 96 1HB LEU 822 1HB LEU 822 8.736 -0.501 16.454 97 2HB LEU 822 2HB LEU 822 7.466 -0.742 15.252 98 HG LEU 822 HG LEU 822 10.373 -1.355 14.685 99 1HD1 LEU 822 1HD1 LEU 822 9.073 -2.658 16.632 100 2HD1 LEU 822 2HD1 LEU 822 8.403 -3.527 15.251 101 3HD1 LEU 822 3HD1 LEU 822 10.147 -3.497 15.512 102 1HD2 LEU 822 1HD2 LEU 822 7.754 -1.666 13.300 103 2HD2 LEU 822 2HD2 LEU 822 9.354 -1.364 12.623 104 3HD2 LEU 822 3HD2 LEU 822 8.901 -2.993 13.124 105 HA ASP 823 HA ASP 823 6.123 1.074 11.728 106 1HB ASP 823 1HB ASP 823 4.593 2.204 14.027 107 2HB ASP 823 2HB ASP 823 3.976 2.547 12.410 108 HA ASP 824 HA ASP 824 6.670 5.718 11.248 109 1HB ASP 824 1HB ASP 824 7.474 5.775 14.074 110 2HB ASP 824 2HB ASP 824 8.294 6.994 13.097 111 HA LEU 825 HA LEU 825 10.922 4.957 9.944 112 1HB LEU 825 1HB LEU 825 11.167 4.080 12.554 113 2HB LEU 825 2HB LEU 825 11.939 2.779 11.648 114 HG LEU 825 HG LEU 825 13.222 4.613 10.400 115 1HD1 LEU 825 1HD1 LEU 825 11.588 6.394 11.308 116 2HD1 LEU 825 2HD1 LEU 825 12.503 6.282 12.810 117 3HD1 LEU 825 3HD1 LEU 825 13.307 6.792 11.326 118 1HD2 LEU 825 1HD2 LEU 825 13.560 3.799 13.259 119 2HD2 LEU 825 2HD2 LEU 825 14.589 3.456 11.868 120 3HD2 LEU 825 3HD2 LEU 825 14.632 5.048 12.625 121 HA GLU 826 HA GLU 826 10.652 -0.443 9.732 122 1HB GLU 826 1HB GLU 826 8.482 0.704 9.078 123 2HB GLU 826 2HB GLU 826 9.317 1.304 7.647 124 1HG GLU 826 1HG GLU 826 9.919 -1.116 7.130 125 2HG GLU 826 2HG GLU 826 8.206 -0.719 6.986 126 HA ASN 827 HA ASN 827 12.371 0.659 4.913 127 1HB ASN 827 1HB ASN 827 12.770 2.736 6.362 128 2HB ASN 827 2HB ASN 827 14.045 1.812 7.158 129 2HD2 ASN 827 1HD2 ASN 827 15.850 2.987 6.298 130 1HD2 ASN 827 2HD2 ASN 827 16.223 3.016 4.643 131 HA ALA 828 HA ALA 828 14.603 -2.899 6.919 132 1HB ALA 828 2HB ALA 828 12.568 -4.353 5.209 133 2HB ALA 828 1HB ALA 828 12.210 -3.826 6.854 134 3HB ALA 828 3HB ALA 828 13.497 -4.996 6.562 135 HA GLU 829 HA GLU 829 16.719 -3.930 3.106 136 1HB GLU 829 1HB GLU 829 16.536 -6.267 4.373 137 2HB GLU 829 2HB GLU 829 15.767 -6.759 2.864 138 1HG GLU 829 1HG GLU 829 17.703 -6.092 1.580 139 2HG GLU 829 2HG GLU 829 18.455 -5.369 3.004 140 HA GLU 830 HA GLU 830 12.170 -3.222 0.914 141 1HB GLU 830 1HB GLU 830 14.958 -3.018 -0.049 142 2HB GLU 830 2HB GLU 830 13.777 -3.362 -1.312 143 1HG GLU 830 1HG GLU 830 12.391 -1.451 -0.195 144 2HG GLU 830 2HG GLU 830 13.754 -1.020 -1.227 145 HA GLU 831 HA GLU 831 12.884 -7.641 -0.693 146 1HB GLU 831 1HB GLU 831 14.327 -8.016 1.525 147 2HB GLU 831 2HB GLU 831 12.855 -8.832 2.052 148 1HG GLU 831 1HG GLU 831 13.102 -9.864 -0.448 149 2HG GLU 831 2HG GLU 831 14.800 -9.612 -0.045 150 1HA GLY 832 1HA GLY 832 8.707 -8.631 0.609 151 2HA GLY 832 2HA GLY 832 8.458 -7.964 -1.007 152 HA GLN 833 HA GLN 833 8.172 -12.031 -2.675 153 1HB GLN 833 1HB GLN 833 6.763 -13.514 -1.256 154 2HB GLN 833 2HB GLN 833 7.855 -12.539 -0.269 155 1HG GLN 833 1HG GLN 833 5.990 -10.862 -0.008 156 2HG GLN 833 2HG GLN 833 4.919 -12.017 -0.803 157 2HE2 GLN 833 1HE2 GLN 833 3.640 -12.316 1.172 158 1HE2 GLN 833 2HE2 GLN 833 4.256 -13.184 2.493 159 HA GLU 834 HA GLU 834 4.760 -11.236 -5.361 160 1HB GLU 834 1HB GLU 834 3.314 -10.878 -3.538 161 2HB GLU 834 2HB GLU 834 4.111 -9.377 -3.079 162 1HG GLU 834 1HG GLU 834 2.978 -9.140 -5.740 163 2HG GLU 834 2HG GLU 834 1.746 -9.654 -4.588 164 HA ASN 835 HA ASN 835 6.820 -7.979 -7.721 165 1HB ASN 835 1HB ASN 835 4.818 -8.944 -9.759 166 2HB ASN 835 2HB ASN 835 6.418 -8.276 -10.022 167 2HD2 ASN 835 1HD2 ASN 835 5.317 -10.930 -10.967 168 1HD2 ASN 835 2HD2 ASN 835 6.394 -12.091 -10.356 169 HA VAL 836 HA VAL 836 3.209 -5.468 -7.456 170 HB VAL 836 HB VAL 836 4.215 -5.631 -5.248 171 1HG1 VAL 836 1HG1 VAL 836 6.273 -3.884 -6.533 172 2HG1 VAL 836 2HG1 VAL 836 6.007 -3.748 -4.802 173 3HG1 VAL 836 3HG1 VAL 836 6.487 -5.291 -5.500 174 1HG2 VAL 836 1HG2 VAL 836 3.754 -2.738 -6.030 175 2HG2 VAL 836 2HG2 VAL 836 2.542 -3.865 -5.416 176 3HG2 VAL 836 3HG2 VAL 836 3.854 -3.322 -4.369 177 HA GLU 837 HA GLU 837 4.586 -1.882 -9.748 178 1HB GLU 837 1HB GLU 837 3.525 -3.516 -11.469 179 2HB GLU 837 2HB GLU 837 2.052 -2.575 -11.237 180 1HG GLU 837 1HG GLU 837 3.087 -0.578 -12.011 181 2HG GLU 837 2HG GLU 837 4.698 -1.289 -11.911 182 HA ILE 838 HA ILE 838 1.052 0.554 -8.387 183 HB ILE 838 HB ILE 838 3.689 2.050 -8.414 184 1HG1 ILE 838 1HG1 ILE 838 2.707 -0.183 -6.947 185 2HG1 ILE 838 2HG1 ILE 838 4.225 0.667 -6.720 186 1HG2 ILE 838 1HG2 ILE 838 1.125 2.740 -6.967 187 2HG2 ILE 838 2HG2 ILE 838 2.697 3.425 -6.564 188 3HG2 ILE 838 3HG2 ILE 838 1.985 3.728 -8.148 189 1HD1 ILE 838 1HD1 ILE 838 1.633 1.634 -5.493 190 2HD1 ILE 838 2HD1 ILE 838 2.709 0.512 -4.668 191 3HD1 ILE 838 3HD1 ILE 838 3.276 2.123 -5.096 192 HA LEU 839 HA LEU 839 0.318 4.126 -11.127 193 1HB LEU 839 1HB LEU 839 -1.096 1.585 -11.473 194 2HB LEU 839 2HB LEU 839 -2.069 2.957 -12.000 195 HG LEU 839 HG LEU 839 0.378 3.607 -13.046 196 1HD1 LEU 839 1HD1 LEU 839 0.760 1.004 -12.245 197 2HD1 LEU 839 2HD1 LEU 839 0.244 0.795 -13.919 198 3HD1 LEU 839 3HD1 LEU 839 1.650 1.792 -13.548 199 1HD2 LEU 839 1HD2 LEU 839 -1.926 3.533 -14.121 200 2HD2 LEU 839 2HD2 LEU 839 -0.597 3.047 -15.174 201 3HD2 LEU 839 3HD2 LEU 839 -1.636 1.824 -14.442 202 HA PRO 840 HA PRO 840 -2.612 6.715 -9.108 203 1HB PRO 840 1HB PRO 840 -3.033 8.262 -10.698 204 2HB PRO 840 2HB PRO 840 -4.290 7.227 -11.382 205 1HG PRO 840 1HG PRO 840 -1.727 7.840 -12.505 206 2HG PRO 840 2HG PRO 840 -2.949 6.740 -13.153 207 1HD PRO 840 1HD PRO 840 -1.570 4.986 -12.667 208 2HD PRO 840 2HD PRO 840 -0.408 6.082 -11.878 209 HA SER 841 HA SER 841 -5.700 3.747 -7.969 210 1HB SER 841 1HB SER 841 -6.170 4.719 -5.987 211 2HB SER 841 2HB SER 841 -5.936 6.337 -6.641 212 HG SER 841 HG SER 841 -8.023 6.484 -6.605 213 1HA GLY 842 1HA GLY 842 -9.580 3.079 -10.025 214 2HA GLY 842 2HA GLY 842 -9.278 4.769 -10.414 215 HA GLU 843 HA GLU 843 -7.715 2.423 -13.986 216 1HB GLU 843 1HB GLU 843 -5.943 1.000 -12.041 217 2HB GLU 843 2HB GLU 843 -5.815 0.544 -13.740 218 1HG GLU 843 1HG GLU 843 -5.755 3.437 -12.881 219 2HG GLU 843 2HG GLU 843 -4.289 2.456 -12.912 220 HA ARG 844 HA ARG 844 -9.973 -1.553 -13.882 221 1HB ARG 844 1HB ARG 844 -11.698 0.269 -12.516 222 2HB ARG 844 2HB ARG 844 -12.634 -0.660 -13.689 223 1HG ARG 844 1HG ARG 844 -10.686 -1.980 -11.794 224 2HG ARG 844 2HG ARG 844 -12.369 -1.694 -11.353 225 1HD ARG 844 1HD ARG 844 -12.878 -2.858 -13.668 226 2HD ARG 844 2HD ARG 844 -11.255 -3.542 -13.444 227 HE ARG 844 HE ARG 844 -12.344 -3.947 -10.983 228 1HH1 ARG 844 1HH1 ARG 844 -12.474 -5.511 -13.890 229 2HH1 ARG 844 2HH1 ARG 844 -13.930 -6.395 -13.580 230 1HH2 ARG 844 1HH2 ARG 844 -14.690 -4.643 -10.685 231 2HH2 ARG 844 2HH2 ARG 844 -15.185 -5.903 -11.764 232 HA PRO 845 HA PRO 845 -12.697 -0.113 -17.592 233 1HB PRO 845 1HB PRO 845 -12.305 2.722 -17.906 234 2HB PRO 845 2HB PRO 845 -13.796 1.871 -17.490 235 1HG PRO 845 1HG PRO 845 -12.228 3.532 -15.788 236 2HG PRO 845 2HG PRO 845 -13.651 2.581 -15.346 237 1HD PRO 845 1HD PRO 845 -12.294 1.221 -14.099 238 2HD PRO 845 2HD PRO 845 -10.844 2.054 -14.702 239 HA GLN 846 HA GLN 846 -9.158 -0.054 -20.256 240 1HB GLN 846 1HB GLN 846 -8.498 1.851 -18.844 241 2HB GLN 846 2HB GLN 846 -7.676 0.753 -17.735 242 1HG GLN 846 1HG GLN 846 -5.946 0.318 -19.232 243 2HG GLN 846 2HG GLN 846 -6.927 0.727 -20.641 244 2HE2 GLN 846 1HE2 GLN 846 -4.252 1.846 -19.373 245 1HE2 GLN 846 2HE2 GLN 846 -4.491 3.525 -19.439 246 HA ALA 847 HA ALA 847 -6.707 -3.628 -18.678 247 1HB ALA 847 1HB ALA 847 -6.859 -2.497 -15.911 248 2HB ALA 847 3HB ALA 847 -5.445 -2.754 -16.932 249 3HB ALA 847 2HB ALA 847 -6.200 -4.119 -16.110 250 HA ASN 848 HA ASN 848 -10.765 -5.085 -15.395 251 1HB ASN 848 1HB ASN 848 -11.099 -4.543 -18.007 252 2HB ASN 848 2HB ASN 848 -10.702 -6.257 -18.143 253 2HD2 ASN 848 1HD2 ASN 848 -12.271 -7.792 -17.421 254 1HD2 ASN 848 2HD2 ASN 848 -13.796 -7.346 -16.826 255 HA GLN 849 HA GLN 849 -8.478 -8.929 -15.297 256 1HB GLN 849 1HB GLN 849 -6.835 -6.816 -14.663 257 2HB GLN 849 2HB GLN 849 -6.742 -7.796 -13.202 258 1HG GLN 849 1HG GLN 849 -6.160 -9.774 -14.589 259 2HG GLN 849 2HG GLN 849 -6.192 -8.751 -16.027 260 2HE2 GLN 849 1HE2 GLN 849 -4.920 -7.907 -12.782 261 1HE2 GLN 849 2HE2 GLN 849 -3.338 -7.613 -13.298 262 HA LYS 850 HA LYS 850 -8.366 -9.904 -10.484 263 1HB LYS 850 1HB LYS 850 -10.283 -10.898 -12.502 264 2HB LYS 850 2HB LYS 850 -10.081 -11.966 -11.113 265 1HG LYS 850 1HG LYS 850 -10.350 -9.078 -10.487 266 2HG LYS 850 2HG LYS 850 -11.796 -9.864 -11.122 267 1HD LYS 850 1HD LYS 850 -10.936 -11.733 -9.322 268 2HD LYS 850 2HD LYS 850 -10.434 -10.242 -8.526 269 1HE LYS 850 1HE LYS 850 -13.238 -10.787 -9.572 270 2HE LYS 850 2HE LYS 850 -12.747 -10.864 -7.868 271 1HZ LYS 850 1HZ LYS 850 -11.890 -8.566 -8.121 272 2HZ LYS 850 2HZ LYS 850 -12.593 -8.505 -9.667 273 3HZ LYS 850 3HZ LYS 850 -13.576 -8.676 -8.296 274 HA ARG 851 HA ARG 851 -6.995 -14.305 -10.678 275 1HB ARG 851 1HB ARG 851 -5.236 -12.062 -10.690 276 2HB ARG 851 2HB ARG 851 -4.524 -13.293 -9.652 277 1HG ARG 851 1HG ARG 851 -3.907 -14.478 -11.458 278 2HG ARG 851 2HG ARG 851 -5.591 -14.598 -11.967 279 1HD ARG 851 1HD ARG 851 -4.783 -11.948 -12.584 280 2HD ARG 851 2HD ARG 851 -3.480 -13.018 -13.140 281 HE ARG 851 HE ARG 851 -6.340 -13.583 -13.820 282 1HH1 ARG 851 1HH1 ARG 851 -5.635 -15.532 -15.270 283 2HH1 ARG 851 2HH1 ARG 851 -4.671 -15.026 -16.618 284 1HH2 ARG 851 1HH2 ARG 851 -3.959 -11.909 -15.278 285 2HH2 ARG 851 2HH2 ARG 851 -3.723 -12.975 -16.621 286 HA ILE 852 HA ILE 852 -6.642 -14.594 -6.078 287 HB ILE 852 HB ILE 852 -4.899 -16.040 -5.738 288 1HG1 ILE 852 1HG1 ILE 852 -3.358 -14.390 -4.808 289 2HG1 ILE 852 2HG1 ILE 852 -2.497 -15.423 -5.944 290 1HG2 ILE 852 1HG2 ILE 852 -4.118 -14.919 -8.443 291 2HG2 ILE 852 2HG2 ILE 852 -3.608 -16.477 -7.797 292 3HG2 ILE 852 3HG2 ILE 852 -5.310 -16.185 -8.147 293 1HD1 ILE 852 3HD1 ILE 852 -3.682 -13.057 -7.208 294 2HD1 ILE 852 1HD1 ILE 852 -2.485 -12.661 -5.984 295 3HD1 ILE 852 2HD1 ILE 852 -2.053 -13.695 -7.342 296 HA THR 853 HA THR 853 -3.674 -11.183 -4.051 297 HB THR 853 HB THR 853 -4.313 -8.791 -4.659 298 HG1 THR 853 HG1 THR 853 -5.984 -10.206 -6.259 299 1HG2 THR 853 1HG2 THR 853 -3.056 -10.579 -6.752 300 2HG2 THR 853 2HG2 THR 853 -2.905 -8.824 -6.709 301 3HG2 THR 853 3HG2 THR 853 -2.225 -9.804 -5.410 302 HA THR 854 HA THR 854 -7.229 -11.713 -1.480 303 HB THR 854 HB THR 854 -5.315 -11.945 0.057 304 HG1 THR 854 HG1 THR 854 -6.971 -11.759 1.346 305 1HG2 THR 854 1HG2 THR 854 -4.575 -9.460 -0.874 306 2HG2 THR 854 2HG2 THR 854 -5.174 -9.090 0.743 307 3HG2 THR 854 3HG2 THR 854 -3.873 -10.262 0.532 308 HA PRO 855 HA PRO 855 -9.043 -7.815 -2.820 309 1HB PRO 855 1HB PRO 855 -11.218 -8.509 -2.828 310 2HB PRO 855 2HB PRO 855 -11.276 -8.347 -1.069 311 1HG PRO 855 1HG PRO 855 -11.313 -10.763 -2.578 312 2HG PRO 855 2HG PRO 855 -11.199 -10.609 -0.822 313 1HD PRO 855 1HD PRO 855 -9.081 -11.471 -0.975 314 2HD PRO 855 2HD PRO 855 -9.095 -11.334 -2.753 315 HA TYR 856 HA TYR 856 -7.878 -5.175 0.532 316 1HB TYR 856 1HB TYR 856 -8.496 -7.148 1.830 317 2HB TYR 856 2HB TYR 856 -6.951 -7.899 1.481 318 HD1 TYR 856 HD1 TYR 856 -4.819 -6.523 2.283 319 HD2 TYR 856 HD2 TYR 856 -8.793 -5.982 3.814 320 HE1 TYR 856 HE1 TYR 856 -3.889 -5.516 4.334 321 HE2 TYR 856 HE2 TYR 856 -7.861 -4.970 5.868 322 HH TYR 856 HH TYR 856 -4.566 -5.173 6.685 323 HA MET 857 HA MET 857 -3.821 -4.824 -1.453 324 1HB MET 857 1HB MET 857 -4.798 -2.543 -1.635 325 2HB MET 857 2HB MET 857 -4.407 -2.262 0.054 326 1HG MET 857 1HG MET 857 -2.013 -3.154 -1.163 327 2HG MET 857 2HG MET 857 -2.369 -1.537 -0.572 328 1HE MET 857 1HE MET 857 -4.573 -0.471 -2.130 329 2HE MET 857 2HE MET 857 -3.076 0.452 -1.971 330 3HE MET 857 3HE MET 857 -3.859 0.297 -3.542 331 HA THR 858 HA THR 858 -1.659 -5.128 2.476 332 HB THR 858 HB THR 858 0.089 -6.862 2.049 333 HG1 THR 858 HG1 THR 858 0.778 -7.159 0.079 334 1HG2 THR 858 1HG2 THR 858 -2.321 -7.361 2.304 335 2HG2 THR 858 2HG2 THR 858 -2.538 -7.151 0.567 336 3HG2 THR 858 3HG2 THR 858 -1.548 -8.477 1.177 337 HA LYS 859 HA LYS 859 1.020 -1.875 3.471 338 1HB LYS 859 1HB LYS 859 1.273 -3.413 5.359 339 2HB LYS 859 2HB LYS 859 2.835 -2.714 4.934 340 1HG LYS 859 1HG LYS 859 1.949 -5.343 3.752 341 2HG LYS 859 2HG LYS 859 3.586 -4.710 3.929 342 1HD LYS 859 1HD LYS 859 3.539 -5.032 6.313 343 2HD LYS 859 2HD LYS 859 1.815 -5.406 6.285 344 1HE LYS 859 1HE LYS 859 2.381 -7.393 4.790 345 2HE LYS 859 2HE LYS 859 4.085 -7.085 5.182 346 1HZ LYS 859 1HZ LYS 859 3.409 -7.074 7.563 347 2HZ LYS 859 2HZ LYS 859 1.875 -7.620 7.090 348 3HZ LYS 859 3HZ LYS 859 3.243 -8.588 6.809 349 HA TYR 860 HA TYR 860 4.861 -3.122 0.960 350 1HB TYR 860 1HB TYR 860 4.812 -5.528 0.739 351 2HB TYR 860 2HB TYR 860 3.531 -5.445 -0.463 352 HD1 TYR 860 HD1 TYR 860 5.990 -2.773 -0.512 353 HD2 TYR 860 HD2 TYR 860 5.135 -6.693 -2.068 354 HE1 TYR 860 HE1 TYR 860 7.651 -2.406 -2.286 355 HE2 TYR 860 HE2 TYR 860 6.815 -6.314 -3.843 356 HH TYR 860 HH TYR 860 9.077 -3.780 -3.760 357 HA GLU 861 HA GLU 861 2.287 -2.265 -3.132 358 1HB GLU 861 1HB GLU 861 -0.170 -1.968 -3.106 359 2HB GLU 861 2HB GLU 861 -0.212 -2.398 -1.395 360 1HG GLU 861 1HG GLU 861 0.902 -4.236 -3.536 361 2HG GLU 861 2HG GLU 861 0.514 -4.645 -1.867 362 HA ARG 862 HA ARG 862 1.234 1.536 -0.258 363 1HB ARG 862 1HB ARG 862 0.239 0.608 1.691 364 2HB ARG 862 2HB ARG 862 1.673 -0.341 2.067 365 1HG ARG 862 1HG ARG 862 2.054 2.604 1.932 366 2HG ARG 862 2HG ARG 862 1.126 2.007 3.300 367 1HD ARG 862 1HD ARG 862 2.993 1.221 4.312 368 2HD ARG 862 2HD ARG 862 3.485 0.358 2.842 369 HE ARG 862 HE ARG 862 4.100 2.838 2.075 370 1HH1 ARG 862 1HH1 ARG 862 3.978 4.177 4.617 371 2HH1 ARG 862 2HH1 ARG 862 5.539 3.910 5.321 372 1HH2 ARG 862 1HH2 ARG 862 6.330 1.270 3.216 373 2HH2 ARG 862 2HH2 ARG 862 6.869 2.263 4.529 374 HA ALA 863 HA ALA 863 5.786 1.327 1.245 375 1HB ALA 863 2HB ALA 863 6.789 -1.311 0.494 376 2HB ALA 863 3HB ALA 863 6.921 -0.470 2.037 377 3HB ALA 863 1HB ALA 863 5.478 -1.413 1.668 378 HA ARG 864 HA ARG 864 6.840 0.524 -3.271 379 1HB ARG 864 1HB ARG 864 4.667 -1.310 -3.335 380 2HB ARG 864 2HB ARG 864 4.384 -0.180 -4.655 381 1HG ARG 864 1HG ARG 864 5.737 -2.041 -5.448 382 2HG ARG 864 2HG ARG 864 6.920 -1.759 -4.171 383 1HD ARG 864 1HD ARG 864 6.231 0.118 -6.468 384 2HD ARG 864 2HD ARG 864 7.328 0.530 -5.136 385 HE ARG 864 HE ARG 864 8.155 -1.981 -6.162 386 1HH1 ARG 864 1HH1 ARG 864 8.972 1.234 -6.191 387 2HH1 ARG 864 2HH1 ARG 864 9.818 1.207 -7.701 388 1HH2 ARG 864 1HH2 ARG 864 8.780 -1.996 -8.530 389 2HH2 ARG 864 2HH2 ARG 864 9.710 -0.622 -9.026 390 HA VAL 865 HA VAL 865 2.855 3.523 -4.032 391 HB VAL 865 HB VAL 865 2.420 2.219 -1.442 392 1HG1 VAL 865 1HG1 VAL 865 1.844 5.110 -1.792 393 2HG1 VAL 865 2HG1 VAL 865 0.775 4.098 -0.819 394 3HG1 VAL 865 3HG1 VAL 865 2.478 4.255 -0.386 395 1HG2 VAL 865 1HG2 VAL 865 1.188 1.762 -3.493 396 2HG2 VAL 865 2HG2 VAL 865 0.157 2.224 -2.141 397 3HG2 VAL 865 3HG2 VAL 865 0.522 3.393 -3.413 398 HA LEU 866 HA LEU 866 4.967 6.119 -0.472 399 1HB LEU 866 1HB LEU 866 5.382 4.900 1.440 400 2HB LEU 866 2HB LEU 866 5.692 3.432 0.524 401 HG LEU 866 HG LEU 866 7.807 5.529 0.380 402 1HD1 LEU 866 1HD1 LEU 866 6.806 4.432 2.914 403 2HD1 LEU 866 2HD1 LEU 866 8.524 4.127 2.655 404 3HD1 LEU 866 3HD1 LEU 866 7.908 5.779 2.631 405 1HD2 LEU 866 1HD2 LEU 866 7.759 2.518 0.771 406 2HD2 LEU 866 2HD2 LEU 866 8.100 3.368 -0.733 407 3HD2 LEU 866 3HD2 LEU 866 9.228 3.478 0.614 408 1HA GLY 867 1HA GLY 867 8.976 5.094 -2.796 409 2HA GLY 867 2HA GLY 867 8.478 3.615 -3.619 410 HA THR 868 HA THR 868 6.880 6.038 -6.822 411 HB THR 868 HB THR 868 5.110 3.963 -6.657 412 HG1 THR 868 HG1 THR 868 6.112 4.539 -8.519 413 1HG2 THR 868 1HG2 THR 868 3.637 6.604 -6.726 414 2HG2 THR 868 2HG2 THR 868 2.977 5.177 -7.509 415 3HG2 THR 868 3HG2 THR 868 3.259 5.172 -5.770 416 HA ARG 869 HA ARG 869 3.956 8.981 -4.620 417 1HB ARG 869 1HB ARG 869 4.422 7.359 -2.110 418 2HB ARG 869 2HB ARG 869 3.848 9.022 -1.978 419 1HG ARG 869 1HG ARG 869 2.467 7.177 -3.891 420 2HG ARG 869 2HG ARG 869 2.124 7.022 -2.167 421 1HD ARG 869 1HD ARG 869 0.852 8.900 -2.177 422 2HD ARG 869 2HD ARG 869 2.112 9.820 -3.021 423 HE ARG 869 HE ARG 869 1.126 8.140 -4.982 424 1HH1 ARG 869 1HH1 ARG 869 -1.205 8.804 -2.850 425 2HH1 ARG 869 2HH1 ARG 869 -2.108 9.920 -3.821 426 1HH2 ARG 869 1HH2 ARG 869 0.380 10.262 -6.211 427 2HH2 ARG 869 2HH2 ARG 869 -1.211 10.744 -5.724 428 HA ALA 870 HA ALA 870 7.902 10.235 -1.947 429 1HB ALA 870 3HB ALA 870 8.717 8.137 -1.171 430 2HB ALA 870 2HB ALA 870 10.013 8.775 -2.183 431 3HB ALA 870 1HB ALA 870 8.930 7.534 -2.814 432 HA LEU 871 HA LEU 871 9.907 10.768 -6.092 433 1HB LEU 871 1HB LEU 871 8.862 9.426 -8.356 434 2HB LEU 871 2HB LEU 871 10.428 9.178 -7.603 435 HG LEU 871 HG LEU 871 8.094 7.810 -6.356 436 1HD1 LEU 871 1HD1 LEU 871 9.160 7.283 -9.100 437 2HD1 LEU 871 2HD1 LEU 871 8.667 5.923 -8.092 438 3HD1 LEU 871 3HD1 LEU 871 7.502 7.181 -8.505 439 1HD2 LEU 871 1HD2 LEU 871 11.023 7.271 -6.877 440 2HD2 LEU 871 2HD2 LEU 871 10.209 7.440 -5.322 441 3HD2 LEU 871 3HD2 LEU 871 9.939 6.001 -6.306 442 HA GLN 872 HA GLN 872 5.715 11.916 -8.359 443 1HB GLN 872 1HB GLN 872 4.648 10.522 -6.050 444 2HB GLN 872 2HB GLN 872 3.959 12.141 -6.133 445 1HG GLN 872 1HG GLN 872 3.811 11.363 -8.760 446 2HG GLN 872 2HG GLN 872 2.490 11.201 -7.603 447 2HE2 GLN 872 1HE2 GLN 872 5.082 9.430 -9.259 448 1HE2 GLN 872 2HE2 GLN 872 4.513 7.880 -8.863 449 HA ILE 873 HA ILE 873 5.867 15.418 -4.998 450 HB ILE 873 HB ILE 873 6.988 14.917 -2.665 451 1HG1 ILE 873 1HG1 ILE 873 5.912 12.360 -2.350 452 2HG1 ILE 873 2HG1 ILE 873 6.762 12.271 -3.883 453 1HG2 ILE 873 1HG2 ILE 873 4.265 14.397 -3.718 454 2HG2 ILE 873 2HG2 ILE 873 4.598 13.966 -2.045 455 3HG2 ILE 873 3HG2 ILE 873 4.817 15.629 -2.585 456 1HD1 ILE 873 1HD1 ILE 873 8.056 13.508 -1.482 457 2HD1 ILE 873 2HD1 ILE 873 8.103 11.771 -1.756 458 3HD1 ILE 873 3HD1 ILE 873 8.808 12.870 -2.938 459 HA ALA 874 HA ALA 874 10.627 14.674 -4.492 460 1HB ALA 874 1HB ALA 874 10.402 12.349 -6.416 461 2HB ALA 874 3HB ALA 874 10.773 12.229 -4.697 462 3HB ALA 874 2HB ALA 874 11.918 12.994 -5.794 463 HA MET 875 HA MET 875 10.258 16.270 -8.820 464 1HB MET 875 1HB MET 875 8.573 14.378 -9.552 465 2HB MET 875 2HB MET 875 7.346 15.624 -9.328 466 1HG MET 875 1HG MET 875 9.186 17.010 -10.775 467 2HG MET 875 2HG MET 875 9.436 15.387 -11.415 468 1HE MET 875 1HE MET 875 8.843 15.097 -13.297 469 2HE MET 875 2HE MET 875 7.342 14.169 -13.174 470 3HE MET 875 3HE MET 875 7.421 15.588 -14.213 471 HA CYS 876 HA CYS 876 7.332 19.200 -6.646 472 1HB CYS 876 1HB CYS 876 5.595 18.215 -8.855 473 2HB CYS 876 2HB CYS 876 4.812 19.302 -7.709 474 HG CYS 876 HG CYS 876 5.921 21.090 -9.029 475 HA ALA 877 HA ALA 877 4.340 16.009 -4.555 476 1HB ALA 877 3HB ALA 877 4.370 17.969 -3.374 477 2HB ALA 877 1HB ALA 877 3.476 18.850 -4.613 478 3HB ALA 877 2HB ALA 877 2.632 17.729 -3.543 479 HA PRO 878 HA PRO 878 0.572 15.490 -7.524 480 1HB PRO 878 1HB PRO 878 1.591 12.873 -8.112 481 2HB PRO 878 2HB PRO 878 1.383 14.223 -9.232 482 1HG PRO 878 1HG PRO 878 3.833 13.161 -8.149 483 2HG PRO 878 2HG PRO 878 3.630 14.421 -9.357 484 1HD PRO 878 1HD PRO 878 4.516 14.738 -6.674 485 2HD PRO 878 2HD PRO 878 4.137 16.020 -7.844 486 HA VAL 879 HA VAL 879 1.033 11.757 -4.194 487 HB VAL 879 HB VAL 879 2.610 14.030 -3.054 488 1HG1 VAL 879 1HG1 VAL 879 1.010 13.269 -1.218 489 2HG1 VAL 879 2HG1 VAL 879 1.875 11.738 -1.250 490 3HG1 VAL 879 3HG1 VAL 879 2.717 13.226 -0.847 491 1HG2 VAL 879 1HG2 VAL 879 3.313 11.778 -4.370 492 2HG2 VAL 879 2HG2 VAL 879 4.372 12.587 -3.237 493 3HG2 VAL 879 3HG2 VAL 879 3.430 11.205 -2.713 494 HA MET 880 HA MET 880 -2.701 13.414 -2.501 495 1HB MET 880 1HB MET 880 -2.489 10.958 -1.877 496 2HB MET 880 2HB MET 880 -2.072 11.489 -0.254 497 1HG MET 880 1HG MET 880 -4.220 12.734 -0.129 498 2HG MET 880 2HG MET 880 -4.471 11.007 -0.371 499 1HE MET 880 1HE MET 880 -6.256 13.619 -0.784 500 2HE MET 880 2HE MET 880 -5.099 14.573 -1.708 501 3HE MET 880 3HE MET 880 -6.618 14.055 -2.452 502 HA VAL 881 HA VAL 881 -1.377 16.212 0.718 503 HB VAL 881 HB VAL 881 0.560 15.789 2.299 504 1HG1 VAL 881 1HG1 VAL 881 -1.794 14.328 1.932 505 2HG1 VAL 881 2HG1 VAL 881 -0.554 13.089 2.113 506 3HG1 VAL 881 3HG1 VAL 881 -0.778 14.306 3.368 507 1HG2 VAL 881 1HG2 VAL 881 1.841 14.667 0.249 508 2HG2 VAL 881 2HG2 VAL 881 2.138 14.138 1.905 509 3HG2 VAL 881 3HG2 VAL 881 1.060 13.209 0.864 510 HA GLU 882 HA GLU 882 1.931 18.556 -1.219 511 1HB GLU 882 1HB GLU 882 -0.200 20.255 0.085 512 2HB GLU 882 2HB GLU 882 1.018 20.946 -0.988 513 1HG GLU 882 1HG GLU 882 0.177 18.793 -2.456 514 2HG GLU 882 2HG GLU 882 -0.458 20.429 -2.639 515 HA LEU 883 HA LEU 883 4.126 19.413 2.844 516 1HB LEU 883 1HB LEU 883 5.123 17.220 2.323 517 2HB LEU 883 2HB LEU 883 6.005 17.929 0.972 518 HG LEU 883 HG LEU 883 6.802 19.603 2.930 519 1HD1 LEU 883 1HD1 LEU 883 5.409 18.264 4.579 520 2HD1 LEU 883 2HD1 LEU 883 6.534 16.930 4.327 521 3HD1 LEU 883 3HD1 LEU 883 7.107 18.450 5.015 522 1HD2 LEU 883 1HD2 LEU 883 8.013 17.815 1.340 523 2HD2 LEU 883 2HD2 LEU 883 8.859 18.584 2.684 524 3HD2 LEU 883 3HD2 LEU 883 8.195 16.961 2.873 525 HA GLU 884 HA GLU 884 6.147 22.529 0.057 526 1HB GLU 884 1HB GLU 884 8.112 21.116 1.562 527 2HB GLU 884 2HB GLU 884 8.938 21.892 0.211 528 1HG GLU 884 1HG GLU 884 7.806 24.040 0.807 529 2HG GLU 884 2HG GLU 884 7.115 23.244 2.221 530 1HA GLY 885 1HA GLY 885 6.566 19.937 -4.129 531 2HA GLY 885 2HA GLY 885 7.883 21.089 -3.903 532 HA GLU 886 HA GLU 886 9.619 16.729 -2.063 533 1HB GLU 886 1HB GLU 886 10.140 17.015 -4.375 534 2HB GLU 886 2HB GLU 886 11.020 18.510 -4.071 535 1HG GLU 886 1HG GLU 886 12.691 17.147 -2.747 536 2HG GLU 886 2HG GLU 886 11.858 15.698 -3.313 537 HA THR 887 HA THR 887 13.201 18.001 0.321 538 HB THR 887 HB THR 887 10.636 18.047 1.961 539 HG1 THR 887 HG1 THR 887 12.241 20.096 0.830 540 1HG2 THR 887 1HG2 THR 887 13.448 18.900 2.684 541 2HG2 THR 887 2HG2 THR 887 12.024 19.514 3.524 542 3HG2 THR 887 3HG2 THR 887 12.395 17.790 3.562 543 HA ASP 888 HA ASP 888 12.655 14.207 2.989 544 1HB ASP 888 1HB ASP 888 10.239 15.076 3.592 545 2HB ASP 888 2HB ASP 888 9.756 13.647 2.685 546 HA PRO 889 HA PRO 889 12.876 11.363 -0.431 547 1HB PRO 889 1HB PRO 889 13.562 9.183 1.311 548 2HB PRO 889 2HB PRO 889 14.646 10.163 0.320 549 1HG PRO 889 1HG PRO 889 14.462 10.160 3.154 550 2HG PRO 889 2HG PRO 889 15.423 11.248 2.149 551 1HD PRO 889 1HD PRO 889 14.064 12.953 2.819 552 2HD PRO 889 2HD PRO 889 12.947 11.814 3.613 553 HA LEU 890 HA LEU 890 8.753 9.609 0.655 554 1HB LEU 890 1HB LEU 890 8.880 7.462 1.827 555 2HB LEU 890 2HB LEU 890 10.430 7.833 1.096 556 HG LEU 890 HG LEU 890 10.850 6.961 3.298 557 1HD1 LEU 890 1HD1 LEU 890 12.131 9.048 2.557 558 2HD1 LEU 890 2HD1 LEU 890 11.100 9.942 3.673 559 3HD1 LEU 890 3HD1 LEU 890 12.158 8.670 4.276 560 1HD2 LEU 890 1HD2 LEU 890 8.426 7.788 3.995 561 2HD2 LEU 890 2HD2 LEU 890 9.678 7.485 5.197 562 3HD2 LEU 890 3HD2 LEU 890 9.344 9.133 4.670 563 HA LEU 891 HA LEU 891 7.655 11.206 5.241 564 1HB LEU 891 1HB LEU 891 8.586 13.326 5.328 565 2HB LEU 891 2HB LEU 891 8.329 13.591 3.613 566 HG LEU 891 HG LEU 891 6.964 15.049 5.180 567 1HD1 LEU 891 1HD1 LEU 891 6.327 14.116 2.690 568 2HD1 LEU 891 2HD1 LEU 891 4.900 13.636 3.611 569 3HD1 LEU 891 3HD1 LEU 891 5.391 15.325 3.563 570 1HD2 LEU 891 1HD2 LEU 891 6.370 12.611 6.379 571 2HD2 LEU 891 2HD2 LEU 891 5.573 14.149 6.709 572 3HD2 LEU 891 3HD2 LEU 891 4.885 13.035 5.528 573 HA ILE 892 HA ILE 892 4.000 12.477 2.325 574 HB ILE 892 HB ILE 892 6.177 12.291 0.343 575 1HG1 ILE 892 1HG1 ILE 892 3.867 13.974 -0.195 576 2HG1 ILE 892 2HG1 ILE 892 4.534 14.223 1.418 577 1HG2 ILE 892 1HG2 ILE 892 3.411 11.310 -0.216 578 2HG2 ILE 892 2HG2 ILE 892 4.283 12.211 -1.445 579 3HG2 ILE 892 3HG2 ILE 892 4.957 10.714 -0.820 580 1HD1 ILE 892 1HD1 ILE 892 6.408 13.960 -0.866 581 2HD1 ILE 892 2HD1 ILE 892 5.541 15.479 -0.680 582 3HD1 ILE 892 3HD1 ILE 892 6.579 14.887 0.617 583 HA ALA 893 HA ALA 893 4.243 7.991 0.748 584 1HB ALA 893 1HB ALA 893 7.122 8.116 1.317 585 2HB ALA 893 3HB ALA 893 6.276 7.252 0.042 586 3HB ALA 893 2HB ALA 893 6.387 6.558 1.654 587 HA MET 894 HA MET 894 4.346 7.065 5.418 588 1HB MET 894 1HB MET 894 5.404 9.775 6.274 589 2HB MET 894 2HB MET 894 5.356 8.289 7.216 590 1HG MET 894 1HG MET 894 6.940 7.387 5.326 591 2HG MET 894 2HG MET 894 7.246 9.101 5.049 592 1HE MET 894 2HE MET 894 7.565 10.758 7.088 593 2HE MET 894 1HE MET 894 9.056 10.446 7.973 594 3HE MET 894 3HE MET 894 9.050 10.356 6.214 595 HA LYS 895 HA LYS 895 1.678 11.059 6.304 596 1HB LYS 895 1HB LYS 895 2.926 12.841 5.316 597 2HB LYS 895 2HB LYS 895 2.829 12.113 3.715 598 1HG LYS 895 1HG LYS 895 1.277 13.959 3.786 599 2HG LYS 895 2HG LYS 895 0.342 12.465 3.780 600 1HD LYS 895 1HD LYS 895 0.676 12.805 6.453 601 2HD LYS 895 2HD LYS 895 -0.710 13.436 5.563 602 1HE LYS 895 1HE LYS 895 1.554 14.889 6.795 603 2HE LYS 895 2HE LYS 895 1.129 15.434 5.161 604 1HZ LYS 895 1HZ LYS 895 -0.827 14.984 7.352 605 2HZ LYS 895 2HZ LYS 895 -0.231 16.508 6.894 606 3HZ LYS 895 3HZ LYS 895 -1.167 15.597 5.809 607 HA GLU 896 HA GLU 896 -0.761 9.793 2.260 608 1HB GLU 896 1HB GLU 896 1.355 9.505 0.813 609 2HB GLU 896 2HB GLU 896 1.386 7.842 1.400 610 1HG GLU 896 1HG GLU 896 -1.268 8.232 0.640 611 2HG GLU 896 2HG GLU 896 -0.344 9.061 -0.612 612 HA LEU 897 HA LEU 897 -0.796 5.415 4.031 613 1HB LEU 897 1HB LEU 897 1.532 4.653 3.858 614 2HB LEU 897 2HB LEU 897 1.963 5.596 5.282 615 HG LEU 897 HG LEU 897 1.319 2.947 5.365 616 1HD1 LEU 897 1HD1 LEU 897 1.217 5.198 7.317 617 2HD1 LEU 897 2HD1 LEU 897 0.569 3.642 7.839 618 3HD1 LEU 897 3HD1 LEU 897 2.244 3.765 7.304 619 1HD2 LEU 897 1HD2 LEU 897 -1.116 3.835 4.725 620 2HD2 LEU 897 2HD2 LEU 897 -0.909 2.543 5.900 621 3HD2 LEU 897 3HD2 LEU 897 -1.189 4.188 6.451 622 HA LYS 898 HA LYS 898 -0.285 7.205 8.621 623 1HB LYS 898 1HB LYS 898 1.653 8.649 8.156 624 2HB LYS 898 2HB LYS 898 0.633 9.688 7.161 625 1HG LYS 898 1HG LYS 898 -0.538 10.534 8.997 626 2HG LYS 898 2HG LYS 898 -0.108 9.170 10.028 627 1HD LYS 898 1HD LYS 898 2.364 10.140 9.473 628 2HD LYS 898 2HD LYS 898 1.425 11.632 9.413 629 1HE LYS 898 1HE LYS 898 1.125 9.691 11.714 630 2HE LYS 898 2HE LYS 898 2.364 10.963 11.723 631 1HZ LYS 898 1HZ LYS 898 -0.522 11.425 11.184 632 2HZ LYS 898 2HZ LYS 898 0.226 11.705 12.683 633 3HZ LYS 898 3HZ LYS 898 0.686 12.612 11.325 634 HA ALA 899 HA ALA 899 -3.656 9.998 6.846 635 1HB ALA 899 3HB ALA 899 -3.907 10.824 4.560 636 2HB ALA 899 1HB ALA 899 -2.210 10.958 5.013 637 3HB ALA 899 2HB ALA 899 -2.742 9.641 3.968 638 HA ARG 900 HA ARG 900 -3.715 5.115 4.794 639 1HB ARG 900 1HB ARG 900 -5.375 4.401 6.315 640 2HB ARG 900 2HB ARG 900 -4.535 5.647 7.227 641 1HG ARG 900 1HG ARG 900 -6.344 7.031 7.240 642 2HG ARG 900 2HG ARG 900 -6.802 6.628 5.589 643 1HD ARG 900 1HD ARG 900 -7.166 4.274 7.175 644 2HD ARG 900 2HD ARG 900 -7.946 5.630 8.014 645 HE ARG 900 HE ARG 900 -8.687 6.027 5.391 646 1HH1 ARG 900 1HH1 ARG 900 -9.796 4.318 7.998 647 2HH1 ARG 900 2HH1 ARG 900 -10.753 3.185 7.101 648 1HH2 ARG 900 1HH2 ARG 900 -9.484 4.147 4.021 649 2HH2 ARG 900 2HH2 ARG 900 -10.576 3.089 4.850 650 HA LYS 901 HA LYS 901 -6.662 7.242 2.146 651 1HB LYS 901 1HB LYS 901 -4.470 9.216 2.166 652 2HB LYS 901 2HB LYS 901 -5.316 9.085 0.626 653 1HG LYS 901 1HG LYS 901 -7.343 9.072 2.574 654 2HG LYS 901 2HG LYS 901 -6.930 10.398 1.485 655 1HD LYS 901 1HD LYS 901 -5.715 9.887 4.216 656 2HD LYS 901 2HD LYS 901 -5.252 11.193 3.126 657 1HE LYS 901 1HE LYS 901 -7.799 11.806 3.164 658 2HE LYS 901 2HE LYS 901 -7.826 10.840 4.652 659 1HZ LYS 901 1HZ LYS 901 -5.906 13.035 4.077 660 2HZ LYS 901 2HZ LYS 901 -7.261 13.174 5.092 661 3HZ LYS 901 3HZ LYS 901 -5.993 12.129 5.512 662 HA ILE 902 HA ILE 902 -2.204 5.947 -0.569 663 HB ILE 902 HB ILE 902 -4.109 3.835 0.489 664 1HG1 ILE 902 1HG1 ILE 902 -1.816 3.156 1.580 665 2HG1 ILE 902 2HG1 ILE 902 -1.390 4.841 1.281 666 1HG2 ILE 902 1HG2 ILE 902 -2.467 3.735 -1.797 667 2HG2 ILE 902 2HG2 ILE 902 -1.571 2.875 -0.546 668 3HG2 ILE 902 3HG2 ILE 902 -3.206 2.366 -0.967 669 1HD1 ILE 902 1HD1 ILE 902 -4.041 4.700 2.404 670 2HD1 ILE 902 2HD1 ILE 902 -2.914 3.816 3.431 671 3HD1 ILE 902 3HD1 ILE 902 -2.610 5.509 3.045 672 HA PRO 903 HA PRO 903 -6.147 6.470 -3.190 673 1HB PRO 903 1HB PRO 903 -4.974 8.772 -4.444 674 2HB PRO 903 2HB PRO 903 -6.400 8.705 -3.408 675 1HG PRO 903 1HG PRO 903 -3.879 9.855 -2.777 676 2HG PRO 903 2HG PRO 903 -5.258 9.648 -1.692 677 1HD PRO 903 1HD PRO 903 -4.023 8.138 -0.520 678 2HD PRO 903 2HD PRO 903 -2.735 8.166 -1.744 679 HA ILE 904 HA ILE 904 -3.977 5.041 -6.688 680 HB ILE 904 HB ILE 904 -1.895 5.467 -4.772 681 1HG1 ILE 904 1HG1 ILE 904 -1.375 5.576 -7.689 682 2HG1 ILE 904 2HG1 ILE 904 -2.741 6.528 -7.115 683 1HG2 ILE 904 1HG2 ILE 904 -1.429 3.307 -6.836 684 2HG2 ILE 904 2HG2 ILE 904 -0.126 4.217 -6.074 685 3HG2 ILE 904 3HG2 ILE 904 -1.181 3.202 -5.094 686 1HD1 ILE 904 1HD1 ILE 904 -0.544 6.885 -5.299 687 2HD1 ILE 904 2HD1 ILE 904 0.023 7.179 -6.943 688 3HD1 ILE 904 3HD1 ILE 904 -1.342 8.094 -6.305 689 HA ILE 905 HA ILE 905 -4.579 0.708 -6.843 690 HB ILE 905 HB ILE 905 -5.609 1.697 -8.865 691 1HG1 ILE 905 1HG1 ILE 905 -4.285 -0.426 -10.293 692 2HG1 ILE 905 2HG1 ILE 905 -4.521 -0.918 -8.616 693 1HG2 ILE 905 1HG2 ILE 905 -2.790 1.498 -9.972 694 2HG2 ILE 905 2HG2 ILE 905 -4.220 1.826 -10.949 695 3HG2 ILE 905 3HG2 ILE 905 -3.715 2.973 -9.713 696 1HD1 ILE 905 1HD1 ILE 905 -6.752 0.372 -10.161 697 2HD1 ILE 905 2HD1 ILE 905 -6.441 -1.357 -10.302 698 3HD1 ILE 905 3HD1 ILE 905 -6.849 -0.656 -8.733 699 HA ILE 906 HA ILE 906 -0.409 -0.732 -7.973 700 HB ILE 906 HB ILE 906 -1.521 -1.627 -5.338 701 1HG1 ILE 906 1HG1 ILE 906 0.919 -0.125 -6.295 702 2HG1 ILE 906 2HG1 ILE 906 0.644 -0.531 -4.602 703 1HG2 ILE 906 1HG2 ILE 906 1.012 -2.744 -6.582 704 2HG2 ILE 906 2HG2 ILE 906 0.636 -2.834 -4.861 705 3HG2 ILE 906 3HG2 ILE 906 -0.387 -3.665 -6.032 706 1HD1 ILE 906 1HD1 ILE 906 -1.770 0.579 -5.374 707 2HD1 ILE 906 2HD1 ILE 906 -0.493 1.423 -4.502 708 3HD1 ILE 906 3HD1 ILE 906 -0.590 1.546 -6.256 709 HA ARG 907 HA ARG 907 -1.411 -4.834 -9.400 710 1HB ARG 907 1HB ARG 907 1.165 -3.949 -10.682 711 2HB ARG 907 2HB ARG 907 0.260 -5.362 -11.206 712 1HG ARG 907 1HG ARG 907 -0.416 -3.501 -12.597 713 2HG ARG 907 2HG ARG 907 -1.747 -3.904 -11.516 714 1HD ARG 907 1HD ARG 907 -1.659 -1.880 -10.468 715 2HD ARG 907 2HD ARG 907 0.116 -1.889 -10.415 716 HE ARG 907 HE ARG 907 0.160 -0.869 -12.572 717 1HH1 ARG 907 1HH1 ARG 907 -1.238 -1.723 -14.598 718 2HH1 ARG 907 2HH1 ARG 907 -2.806 -0.986 -14.598 719 1HH2 ARG 907 1HH2 ARG 907 -2.625 0.016 -11.284 720 2HH2 ARG 907 2HH2 ARG 907 -3.591 -0.002 -12.721 721 HA ARG 908 HA ARG 908 1.429 -7.079 -6.816 722 1HB ARG 908 1HB ARG 908 -0.739 -8.845 -5.972 723 2HB ARG 908 2HB ARG 908 0.317 -7.851 -4.991 724 1HG ARG 908 1HG ARG 908 -1.168 -5.887 -5.460 725 2HG ARG 908 2HG ARG 908 -2.261 -6.968 -6.329 726 1HD ARG 908 1HD ARG 908 -2.989 -6.649 -3.918 727 2HD ARG 908 2HD ARG 908 -2.559 -8.340 -4.260 728 HE ARG 908 HE ARG 908 -0.319 -6.669 -3.345 729 1HH1 ARG 908 1HH1 ARG 908 -3.095 -7.794 -1.866 730 2HH1 ARG 908 2HH1 ARG 908 -2.292 -8.798 -0.705 731 1HH2 ARG 908 1HH2 ARG 908 0.837 -8.421 -2.151 732 2HH2 ARG 908 2HH2 ARG 908 -0.064 -9.149 -0.864 733 HA TYR 909 HA TYR 909 1.009 -10.400 -9.812 734 1HB TYR 909 1HB TYR 909 3.877 -9.842 -10.366 735 2HB TYR 909 2HB TYR 909 2.634 -10.403 -11.456 736 HD1 TYR 909 HD1 TYR 909 3.840 -7.324 -9.662 737 HD2 TYR 909 HD2 TYR 909 1.484 -8.926 -12.852 738 HE1 TYR 909 HE1 TYR 909 3.587 -5.073 -10.596 739 HE2 TYR 909 HE2 TYR 909 1.233 -6.676 -13.803 740 HH TYR 909 HH TYR 909 1.323 -4.363 -13.081 741 HA LEU 910 HA LEU 910 3.845 -12.725 -7.224 742 1HB LEU 910 1HB LEU 910 2.473 -14.740 -6.763 743 2HB LEU 910 2HB LEU 910 1.609 -14.456 -8.278 744 HG LEU 910 HG LEU 910 0.740 -12.353 -7.480 745 1HD1 LEU 910 3HD1 LEU 910 -0.479 -14.387 -6.855 746 2HD1 LEU 910 1HD1 LEU 910 0.472 -14.517 -5.380 747 3HD1 LEU 910 2HD1 LEU 910 -0.631 -13.159 -5.601 748 1HD2 LEU 910 1HD2 LEU 910 2.947 -12.442 -5.703 749 2HD2 LEU 910 2HD2 LEU 910 1.739 -11.169 -5.854 750 3HD2 LEU 910 3HD2 LEU 910 1.498 -12.481 -4.704 751 HA PRO 911 HA PRO 911 6.621 -14.792 -10.095 752 1HB PRO 911 1HB PRO 911 8.352 -15.215 -7.835 753 2HB PRO 911 2HB PRO 911 8.555 -14.039 -9.137 754 1HG PRO 911 1HG PRO 911 8.059 -12.361 -7.703 755 2HG PRO 911 2HG PRO 911 7.849 -13.534 -6.401 756 1HD PRO 911 1HD PRO 911 5.799 -12.024 -7.773 757 2HD PRO 911 2HD PRO 911 5.589 -13.206 -6.463 758 HA ASP 912 HA ASP 912 5.880 -18.420 -6.951 759 1HB ASP 912 1HB ASP 912 3.746 -16.608 -5.950 760 2HB ASP 912 2HB ASP 912 3.378 -18.331 -5.876 761 1HA GLY 913 1HA GLY 913 3.011 -18.135 -11.000 762 2HA GLY 913 2HA GLY 913 2.485 -19.400 -9.892 763 HA SER 914 HA SER 914 -0.835 -16.082 -10.762 764 1HB SER 914 1HB SER 914 -0.077 -15.995 -7.846 765 2HB SER 914 2HB SER 914 -1.584 -15.277 -8.406 766 HG SER 914 HG SER 914 -2.055 -17.344 -9.356 767 HA TYR 915 HA TYR 915 -0.146 -11.630 -9.282 768 1HB TYR 915 1HB TYR 915 1.126 -11.656 -11.196 769 2HB TYR 915 2HB TYR 915 -0.006 -12.702 -12.037 770 HD1 TYR 915 HD1 TYR 915 -0.312 -9.206 -10.622 771 HD2 TYR 915 HD2 TYR 915 -0.622 -11.763 -14.062 772 HE1 TYR 915 HE1 TYR 915 -1.081 -7.289 -11.985 773 HE2 TYR 915 HE2 TYR 915 -1.387 -9.843 -15.421 774 HH TYR 915 HH TYR 915 -2.235 -7.707 -15.276 775 HA GLU 916 HA GLU 916 -4.013 -9.615 -10.765 776 1HB GLU 916 1HB GLU 916 -4.001 -10.823 -8.300 777 2HB GLU 916 2HB GLU 916 -4.458 -9.165 -7.910 778 1HG GLU 916 1HG GLU 916 -5.809 -10.326 -10.272 779 2HG GLU 916 2HG GLU 916 -6.232 -11.053 -8.720 780 HA ASP 917 HA ASP 917 -3.056 -5.357 -9.822 781 1HB ASP 917 1HB ASP 917 -2.983 -5.600 -12.234 782 2HB ASP 917 2HB ASP 917 -3.700 -4.065 -11.795 783 HA TRP 918 HA TRP 918 -6.192 -2.251 -8.836 784 1HB TRP 918 1HB TRP 918 -7.715 -3.395 -7.201 785 2HB TRP 918 2HB TRP 918 -7.709 -4.073 -8.809 786 HD1 TRP 918 HD1 TRP 918 -4.667 -5.521 -7.506 787 HE1 TRP 918 HE1 TRP 918 -5.151 -7.873 -6.554 788 HE3 TRP 918 HE3 TRP 918 -9.625 -5.103 -6.892 789 HZ2 TRP 918 HZ2 TRP 918 -7.441 -9.327 -5.512 790 HZ3 TRP 918 HZ3 TRP 918 -10.955 -6.854 -5.841 791 HH2 TRP 918 HH2 TRP 918 -9.891 -9.012 -5.158 792 1HA GLY 919 1HA GLY 919 -4.681 -2.199 -4.497 793 2HA GLY 919 2HA GLY 919 -4.441 -0.621 -5.229 794 HA VAL 920 HA VAL 920 -7.595 0.471 -2.388 795 HB VAL 920 HB VAL 920 -6.441 2.993 -3.622 796 1HG1 VAL 920 1HG1 VAL 920 -8.111 2.499 -1.152 797 2HG1 VAL 920 2HG1 VAL 920 -7.033 3.890 -1.266 798 3HG1 VAL 920 3HG1 VAL 920 -8.357 3.704 -2.415 799 1HG2 VAL 920 1HG2 VAL 920 -5.555 1.005 -1.593 800 2HG2 VAL 920 2HG2 VAL 920 -4.593 1.982 -2.703 801 3HG2 VAL 920 3HG2 VAL 920 -5.234 2.698 -1.226 802 HA ASP 921 HA ASP 921 -10.408 2.315 -5.612 803 1HB ASP 921 1HB ASP 921 -8.850 2.593 -7.489 804 2HB ASP 921 2HB ASP 921 -8.929 0.861 -7.822 805 HA GLU 922 HA GLU 922 -12.160 -1.874 -5.715 806 1HB GLU 922 1HB GLU 922 -10.320 -2.264 -7.519 807 2HB GLU 922 2HB GLU 922 -9.680 -3.433 -6.367 808 1HG GLU 922 1HG GLU 922 -11.542 -4.834 -6.542 809 2HG GLU 922 2HG GLU 922 -12.608 -3.517 -7.029 810 HA LEU 923 HA LEU 923 -10.555 -3.385 -1.720 811 1HB LEU 923 1HB LEU 923 -8.254 -4.570 -1.550 812 2HB LEU 923 2HB LEU 923 -9.339 -5.017 -2.846 813 HG LEU 923 HG LEU 923 -7.821 -2.836 -3.814 814 1HD1 LEU 923 1HD1 LEU 923 -6.111 -4.997 -2.559 815 2HD1 LEU 923 2HD1 LEU 923 -5.540 -3.752 -3.668 816 3HD1 LEU 923 3HD1 LEU 923 -6.147 -3.302 -2.079 817 1HD2 LEU 923 1HD2 LEU 923 -8.459 -5.591 -4.354 818 2HD2 LEU 923 2HD2 LEU 923 -8.176 -4.249 -5.467 819 3HD2 LEU 923 3HD2 LEU 923 -6.817 -5.188 -4.856 820 HA ILE 924 HA ILE 924 -8.262 -1.259 1.366 821 HB ILE 924 HB ILE 924 -7.060 -3.940 1.375 822 1HG1 ILE 924 1HG1 ILE 924 -7.819 -3.544 3.830 823 2HG1 ILE 924 2HG1 ILE 924 -8.586 -2.106 3.159 824 1HG2 ILE 924 1HG2 ILE 924 -5.009 -2.609 1.788 825 2HG2 ILE 924 2HG2 ILE 924 -5.825 -1.830 3.141 826 3HG2 ILE 924 3HG2 ILE 924 -5.505 -3.559 3.181 827 1HD1 ILE 924 3HD1 ILE 924 -8.936 -4.905 2.074 828 2HD1 ILE 924 1HD1 ILE 924 -10.104 -4.068 3.095 829 3HD1 ILE 924 2HD1 ILE 924 -9.735 -3.448 1.486 830 HA ILE 925 HA ILE 925 -4.513 0.757 0.138 831 HB ILE 925 HB ILE 925 -4.131 2.495 1.904 832 1HG1 ILE 925 1HG1 ILE 925 -6.423 1.350 3.458 833 2HG1 ILE 925 2HG1 ILE 925 -4.823 0.655 3.707 834 1HG2 ILE 925 1HG2 ILE 925 -6.356 2.133 0.288 835 2HG2 ILE 925 2HG2 ILE 925 -7.061 2.447 1.872 836 3HG2 ILE 925 3HG2 ILE 925 -5.950 3.613 1.156 837 1HD1 ILE 925 1HD1 ILE 925 -5.077 3.634 3.715 838 2HD1 ILE 925 2HD1 ILE 925 -5.644 2.749 5.131 839 3HD1 ILE 925 3HD1 ILE 925 -3.964 2.603 4.614 840 HA THR 926 HA THR 926 -0.922 -0.616 2.549 841 HB THR 926 HB THR 926 -1.692 1.015 4.981 842 HG1 THR 926 HG1 THR 926 -1.541 2.466 3.401 843 1HG2 THR 926 1HG2 THR 926 0.978 -0.037 4.011 844 2HG2 THR 926 2HG2 THR 926 0.749 1.012 5.408 845 3HG2 THR 926 3HG2 THR 926 0.079 -0.619 5.411 846 HA ASP 927 HA ASP 927 -3.930 -3.251 5.092 847 1HB ASP 927 1HB ASP 927 -1.833 -1.993 6.580 848 2HB ASP 927 2HB ASP 927 -3.083 -2.472 7.727 No H/Q in entry = 848 Start of MODEL 9 1 H1 MET 801 H1 MET 801 -7.759 12.401 40.799 2 H2 MET 801 H2 MET 801 -6.510 11.887 41.829 3 H3 MET 801 H3 MET 801 -6.146 12.766 40.421 4 HA MET 801 HA MET 801 -6.684 10.976 39.011 5 1HB MET 801 1HB MET 801 -5.241 10.172 41.553 6 2HB MET 801 2HB MET 801 -5.242 9.179 40.095 7 1HG MET 801 1HG MET 801 -4.552 11.568 39.021 8 2HG MET 801 2HG MET 801 -3.369 10.398 39.604 9 1HE MET 801 1HE MET 801 -2.682 10.096 41.680 10 2HE MET 801 2HE MET 801 -1.527 11.400 41.943 11 3HE MET 801 3HE MET 801 -2.824 11.134 43.104 12 HA SER 802 HA SER 802 -9.145 7.627 41.038 13 1HB SER 802 1HB SER 802 -10.493 9.516 40.152 14 2HB SER 802 2HB SER 802 -10.419 8.802 38.543 15 HG SER 802 HG SER 802 -11.614 7.735 40.887 16 HA ASP 803 HA ASP 803 -8.201 4.577 37.750 17 1HB ASP 803 1HB ASP 803 -5.928 4.718 39.659 18 2HB ASP 803 2HB ASP 803 -6.144 3.180 38.823 19 HA ASN 804 HA ASN 804 -10.357 1.830 40.736 20 1HB ASN 804 1HB ASN 804 -11.924 2.362 38.268 21 2HB ASN 804 2HB ASN 804 -12.312 0.865 39.117 22 2HD2 ASN 804 1HD2 ASN 804 -11.360 4.134 40.328 23 1HD2 ASN 804 2HD2 ASN 804 -12.705 4.303 41.351 24 HA GLU 805 HA GLU 805 -8.628 -1.959 39.259 25 1HB GLU 805 1HB GLU 805 -9.436 -2.457 41.565 26 2HB GLU 805 2HB GLU 805 -10.969 -3.008 40.886 27 1HG GLU 805 1HG GLU 805 -10.066 -4.951 40.066 28 2HG GLU 805 2HG GLU 805 -8.500 -4.208 39.741 29 HA ASP 806 HA ASP 806 -11.550 -3.373 36.143 30 1HB ASP 806 1HB ASP 806 -11.413 -0.738 35.865 31 2HB ASP 806 2HB ASP 806 -10.407 -1.155 34.478 32 HA ASN 807 HA ASN 807 -8.166 -5.066 33.703 33 1HB ASN 807 1HB ASN 807 -7.443 -7.225 34.693 34 2HB ASN 807 2HB ASN 807 -8.865 -7.217 35.736 35 2HD2 ASN 807 1HD2 ASN 807 -7.928 -6.844 37.791 36 1HD2 ASN 807 2HD2 ASN 807 -6.943 -5.509 38.155 37 HA PHE 808 HA PHE 808 -11.080 -8.295 31.958 38 1HB PHE 808 1HB PHE 808 -9.546 -7.176 30.380 39 2HB PHE 808 2HB PHE 808 -8.383 -8.487 30.575 40 HD1 PHE 808 HD1 PHE 808 -12.100 -8.308 30.044 41 HD2 PHE 808 HD2 PHE 808 -8.334 -9.905 28.734 42 HE1 PHE 808 HE1 PHE 808 -13.264 -9.609 28.282 43 HE2 PHE 808 HE2 PHE 808 -9.497 -11.205 26.972 44 HZ PHE 808 HZ PHE 808 -11.963 -11.057 26.746 45 HA ASP 809 HA ASP 809 -9.249 -12.412 32.982 46 1HB ASP 809 1HB ASP 809 -8.817 -12.039 30.291 47 2HB ASP 809 2HB ASP 809 -7.350 -12.892 30.773 48 1HA GLY 810 1HA GLY 810 -5.443 -10.657 35.514 49 2HA GLY 810 2HA GLY 810 -5.302 -12.343 35.014 50 HA ASP 811 HA ASP 811 -2.158 -10.835 32.283 51 1HB ASP 811 1HB ASP 811 -2.969 -13.577 31.802 52 2HB ASP 811 2HB ASP 811 -2.273 -12.886 30.338 53 HA ASP 812 HA ASP 812 -4.654 -9.455 28.678 54 1HB ASP 812 1HB ASP 812 -6.413 -7.773 29.160 55 2HB ASP 812 2HB ASP 812 -6.574 -9.189 30.199 56 HA PHE 813 HA PHE 813 -1.953 -5.686 29.165 57 1HB PHE 813 1HB PHE 813 -0.639 -7.204 30.883 58 2HB PHE 813 2HB PHE 813 0.451 -7.453 29.519 59 HD1 PHE 813 HD1 PHE 813 -1.024 -4.920 31.785 60 HD2 PHE 813 HD2 PHE 813 1.855 -5.679 28.688 61 HE1 PHE 813 HE1 PHE 813 0.013 -2.708 32.208 62 HE2 PHE 813 HE2 PHE 813 2.893 -3.465 29.112 63 HZ PHE 813 HZ PHE 813 1.972 -1.980 30.871 64 HA ASP 814 HA ASP 814 -0.520 -6.531 25.022 65 1HB ASP 814 1HB ASP 814 -1.878 -9.090 25.632 66 2HB ASP 814 2HB ASP 814 -1.672 -8.754 23.913 67 HA ASP 815 HA ASP 815 -5.001 -5.412 23.684 68 1HB ASP 815 1HB ASP 815 -4.863 -3.892 25.757 69 2HB ASP 815 2HB ASP 815 -4.030 -2.737 24.715 70 HA VAL 816 HA VAL 816 -2.395 -3.413 20.495 71 HB VAL 816 HB VAL 816 -0.985 -1.379 20.767 72 1HG1 VAL 816 1HG1 VAL 816 -3.564 -1.574 21.314 73 2HG1 VAL 816 2HG1 VAL 816 -3.025 -1.224 22.955 74 3HG1 VAL 816 3HG1 VAL 816 -2.691 -0.080 21.655 75 1HG2 VAL 816 1HG2 VAL 816 0.115 -2.561 22.900 76 2HG2 VAL 816 2HG2 VAL 816 0.049 -0.805 22.759 77 3HG2 VAL 816 3HG2 VAL 816 -1.142 -1.655 23.742 78 HA GLU 817 HA GLU 817 1.891 -5.078 20.730 79 1HB GLU 817 1HB GLU 817 0.906 -4.209 18.352 80 2HB GLU 817 2HB GLU 817 2.500 -3.453 18.319 81 1HG GLU 817 1HG GLU 817 3.237 -5.893 19.153 82 2HG GLU 817 2HG GLU 817 1.773 -6.344 18.279 83 HA GLU 818 HA GLU 818 3.521 -0.795 22.926 84 1HB GLU 818 1HB GLU 818 4.430 -3.449 22.972 85 2HB GLU 818 2HB GLU 818 5.798 -2.524 22.352 86 1HG GLU 818 1HG GLU 818 5.169 -0.877 24.328 87 2HG GLU 818 2HG GLU 818 4.423 -2.325 25.007 88 HA ASP 819 HA ASP 819 6.253 0.246 19.368 89 1HB ASP 819 1HB ASP 819 6.074 2.732 19.435 90 2HB ASP 819 2HB ASP 819 4.558 1.951 19.888 91 HA GLU 820 HA GLU 820 10.269 1.605 20.874 92 1HB GLU 820 1HB GLU 820 9.719 -0.894 21.490 93 2HB GLU 820 2HB GLU 820 10.810 -1.266 20.154 94 1HG GLU 820 1HG GLU 820 12.507 0.270 21.248 95 2HG GLU 820 2HG GLU 820 11.440 0.322 22.653 96 1HA GLY 821 1HA GLY 821 11.202 1.188 16.159 97 2HA GLY 821 2HA GLY 821 12.576 0.356 16.889 98 HA LEU 822 HA LEU 822 10.945 -2.665 13.935 99 1HB LEU 822 1HB LEU 822 8.755 -2.368 15.333 100 2HB LEU 822 2HB LEU 822 8.058 -1.814 13.810 101 HG LEU 822 HG LEU 822 9.062 -3.975 12.797 102 1HD1 LEU 822 1HD1 LEU 822 9.446 -4.366 15.739 103 2HD1 LEU 822 2HD1 LEU 822 8.965 -5.760 14.771 104 3HD1 LEU 822 3HD1 LEU 822 10.458 -4.900 14.396 105 1HD2 LEU 822 1HD2 LEU 822 6.593 -3.372 13.591 106 2HD2 LEU 822 2HD2 LEU 822 7.003 -5.008 13.075 107 3HD2 LEU 822 3HD2 LEU 822 6.923 -4.620 14.793 108 HA ASP 823 HA ASP 823 9.755 -0.508 10.034 109 1HB ASP 823 1HB ASP 823 7.330 -0.269 11.005 110 2HB ASP 823 2HB ASP 823 7.659 1.462 10.929 111 HA ASP 824 HA ASP 824 11.415 3.749 10.657 112 1HB ASP 824 1HB ASP 824 9.895 3.922 13.221 113 2HB ASP 824 2HB ASP 824 11.125 5.152 12.932 114 HA LEU 825 HA LEU 825 15.043 2.650 13.080 115 1HB LEU 825 1HB LEU 825 13.087 1.175 14.531 116 2HB LEU 825 2HB LEU 825 14.533 0.171 14.461 117 HG LEU 825 HG LEU 825 14.574 1.653 16.437 118 1HD1 LEU 825 1HD1 LEU 825 16.628 1.133 14.766 119 2HD1 LEU 825 2HD1 LEU 825 16.628 2.894 14.679 120 3HD1 LEU 825 3HD1 LEU 825 16.817 2.088 16.237 121 1HD2 LEU 825 1HD2 LEU 825 13.294 3.478 14.951 122 2HD2 LEU 825 2HD2 LEU 825 14.290 3.942 16.331 123 3HD2 LEU 825 3HD2 LEU 825 14.942 4.052 14.697 124 HA GLU 826 HA GLU 826 15.696 -0.017 8.974 125 1HB GLU 826 1HB GLU 826 17.532 1.047 10.630 126 2HB GLU 826 2HB GLU 826 17.696 -0.644 11.105 127 1HG GLU 826 1HG GLU 826 17.671 -0.946 8.424 128 2HG GLU 826 2HG GLU 826 18.368 0.672 8.524 129 HA ASN 827 HA ASN 827 16.836 -4.646 10.491 130 1HB ASN 827 1HB ASN 827 15.120 -3.156 12.495 131 2HB ASN 827 2HB ASN 827 15.379 -4.900 12.561 132 2HD2 ASN 827 1HD2 ASN 827 16.406 -2.384 14.212 133 1HD2 ASN 827 2HD2 ASN 827 18.057 -2.728 14.396 134 HA ALA 828 HA ALA 828 12.704 -4.981 8.627 135 1HB ALA 828 3HB ALA 828 12.151 -3.659 6.699 136 2HB ALA 828 1HB ALA 828 13.208 -2.649 7.687 137 3HB ALA 828 2HB ALA 828 13.850 -3.468 6.262 138 HA GLU 829 HA GLU 829 14.118 -7.969 5.529 139 1HB GLU 829 1HB GLU 829 11.390 -7.071 4.634 140 2HB GLU 829 2HB GLU 829 12.164 -8.435 3.824 141 1HG GLU 829 1HG GLU 829 12.538 -9.445 6.127 142 2HG GLU 829 2HG GLU 829 11.483 -8.183 6.763 143 HA GLU 830 HA GLU 830 14.192 -4.030 1.873 144 1HB GLU 830 1HB GLU 830 16.202 -5.395 3.285 145 2HB GLU 830 2HB GLU 830 16.423 -5.885 1.606 146 1HG GLU 830 1HG GLU 830 16.073 -3.291 1.157 147 2HG GLU 830 2HG GLU 830 17.655 -3.922 1.619 148 HA GLU 831 HA GLU 831 12.799 -7.127 -1.078 149 1HB GLU 831 1HB GLU 831 14.400 -8.649 0.543 150 2HB GLU 831 2HB GLU 831 12.971 -9.677 0.414 151 1HG GLU 831 1HG GLU 831 13.213 -8.971 -2.171 152 2HG GLU 831 2HG GLU 831 14.906 -8.849 -1.691 153 1HA GLY 832 1HA GLY 832 8.925 -9.293 0.173 154 2HA GLY 832 2HA GLY 832 8.549 -8.277 -1.220 155 HA GLN 833 HA GLN 833 8.301 -12.354 -3.070 156 1HB GLN 833 1HB GLN 833 6.986 -14.139 -1.939 157 2HB GLN 833 2HB GLN 833 8.088 -13.346 -0.810 158 1HG GLN 833 1HG GLN 833 6.294 -11.953 0.047 159 2HG GLN 833 2HG GLN 833 5.179 -12.576 -1.168 160 2HE2 GLN 833 1HE2 GLN 833 4.464 -14.845 -0.945 161 1HE2 GLN 833 2HE2 GLN 833 4.599 -15.649 0.543 162 HA GLU 834 HA GLU 834 4.689 -11.220 -5.338 163 1HB GLU 834 1HB GLU 834 3.593 -10.882 -3.164 164 2HB GLU 834 2HB GLU 834 4.185 -9.222 -3.099 165 1HG GLU 834 1HG GLU 834 2.891 -9.359 -5.563 166 2HG GLU 834 2HG GLU 834 1.856 -10.307 -4.494 167 HA ASN 835 HA ASN 835 6.690 -7.743 -7.396 168 1HB ASN 835 1HB ASN 835 6.486 -7.952 -9.744 169 2HB ASN 835 2HB ASN 835 4.932 -8.763 -9.638 170 2HD2 ASN 835 1HD2 ASN 835 8.351 -9.309 -8.578 171 1HD2 ASN 835 2HD2 ASN 835 8.356 -10.964 -8.947 172 HA VAL 836 HA VAL 836 2.859 -5.556 -7.549 173 HB VAL 836 HB VAL 836 2.401 -5.012 -5.423 174 1HG1 VAL 836 3HG1 VAL 836 4.020 -6.810 -5.042 175 2HG1 VAL 836 1HG1 VAL 836 5.320 -5.626 -4.946 176 3HG1 VAL 836 2HG1 VAL 836 4.040 -5.640 -3.730 177 1HG2 VAL 836 1HG2 VAL 836 4.779 -3.155 -5.628 178 2HG2 VAL 836 2HG2 VAL 836 3.071 -2.727 -5.657 179 3HG2 VAL 836 3HG2 VAL 836 3.813 -3.303 -4.166 180 HA GLU 837 HA GLU 837 4.469 -1.944 -9.490 181 1HB GLU 837 1HB GLU 837 2.668 -3.497 -10.967 182 2HB GLU 837 2HB GLU 837 2.003 -1.871 -11.048 183 1HG GLU 837 1HG GLU 837 4.924 -1.982 -11.415 184 2HG GLU 837 2HG GLU 837 4.015 -2.827 -12.668 185 HA ILE 838 HA ILE 838 1.221 0.795 -7.996 186 HB ILE 838 HB ILE 838 3.770 2.395 -8.487 187 1HG1 ILE 838 1HG1 ILE 838 4.113 0.161 -7.368 188 2HG1 ILE 838 2HG1 ILE 838 4.593 1.538 -6.387 189 1HG2 ILE 838 1HG2 ILE 838 1.335 2.882 -6.866 190 2HG2 ILE 838 2HG2 ILE 838 2.876 3.257 -6.099 191 3HG2 ILE 838 3HG2 ILE 838 2.441 4.029 -7.621 192 1HD1 ILE 838 1HD1 ILE 838 1.950 1.228 -5.678 193 2HD1 ILE 838 2HD1 ILE 838 2.466 -0.438 -5.921 194 3HD1 ILE 838 3HD1 ILE 838 3.318 0.589 -4.772 195 HA LEU 839 HA LEU 839 0.295 4.236 -10.836 196 1HB LEU 839 1HB LEU 839 -0.743 1.612 -11.284 197 2HB LEU 839 2HB LEU 839 -2.056 2.752 -11.574 198 HG LEU 839 HG LEU 839 0.147 3.962 -12.782 199 1HD1 LEU 839 1HD1 LEU 839 0.960 1.381 -12.423 200 2HD1 LEU 839 2HD1 LEU 839 0.172 1.265 -13.997 201 3HD1 LEU 839 3HD1 LEU 839 1.497 2.405 -13.755 202 1HD2 LEU 839 1HD2 LEU 839 -2.349 3.557 -13.481 203 2HD2 LEU 839 2HD2 LEU 839 -1.126 3.748 -14.738 204 3HD2 LEU 839 3HD2 LEU 839 -1.701 2.138 -14.304 205 HA PRO 840 HA PRO 840 -2.757 6.648 -8.756 206 1HB PRO 840 1HB PRO 840 -2.968 8.361 -10.226 207 2HB PRO 840 2HB PRO 840 -4.146 7.423 -11.150 208 1HG PRO 840 1HG PRO 840 -1.463 8.089 -11.896 209 2HG PRO 840 2HG PRO 840 -2.614 7.093 -12.794 210 1HD PRO 840 1HD PRO 840 -1.335 5.260 -12.335 211 2HD PRO 840 2HD PRO 840 -0.248 6.244 -11.323 212 HA SER 841 HA SER 841 -6.102 3.818 -7.956 213 1HB SER 841 1HB SER 841 -7.988 4.978 -7.176 214 2HB SER 841 2HB SER 841 -6.700 6.152 -6.924 215 HG SER 841 HG SER 841 -8.856 6.239 -8.591 216 1HA GLY 842 1HA GLY 842 -7.566 3.539 -12.098 217 2HA GLY 842 2HA GLY 842 -7.609 1.857 -11.575 218 HA GLU 843 HA GLU 843 -11.930 2.268 -10.000 219 1HB GLU 843 1HB GLU 843 -11.930 3.423 -12.136 220 2HB GLU 843 2HB GLU 843 -11.534 1.939 -13.000 221 1HG GLU 843 1HG GLU 843 -13.760 1.011 -12.181 222 2HG GLU 843 2HG GLU 843 -13.877 2.334 -13.339 223 HA ARG 844 HA ARG 844 -11.842 -2.234 -9.609 224 1HB ARG 844 1HB ARG 844 -12.495 -2.189 -7.435 225 2HB ARG 844 2HB ARG 844 -13.602 -0.851 -7.717 226 1HG ARG 844 1HG ARG 844 -15.255 -2.398 -8.683 227 2HG ARG 844 2HG ARG 844 -14.134 -3.744 -8.469 228 1HD ARG 844 1HD ARG 844 -14.571 -3.906 -6.228 229 2HD ARG 844 2HD ARG 844 -14.655 -2.144 -6.025 230 HE ARG 844 HE ARG 844 -16.951 -2.201 -6.803 231 1HH1 ARG 844 1HH1 ARG 844 -17.765 -3.931 -8.630 232 2HH1 ARG 844 2HH1 ARG 844 -18.189 -5.423 -7.859 233 1HH2 ARG 844 1HH2 ARG 844 -16.473 -4.706 -4.932 234 2HH2 ARG 844 2HH2 ARG 844 -17.458 -5.861 -5.766 235 HA PRO 845 HA PRO 845 -16.212 -2.533 -11.660 236 1HB PRO 845 1HB PRO 845 -17.005 0.161 -12.288 237 2HB PRO 845 2HB PRO 845 -17.791 -0.970 -11.182 238 1HG PRO 845 1HG PRO 845 -16.343 1.392 -10.500 239 2HG PRO 845 2HG PRO 845 -17.043 0.205 -9.396 240 1HD PRO 845 1HD PRO 845 -14.927 -0.448 -8.818 241 2HD PRO 845 2HD PRO 845 -14.225 0.628 -10.044 242 HA GLN 846 HA GLN 846 -14.323 -1.762 -15.614 243 1HB GLN 846 1HB GLN 846 -13.261 0.121 -14.105 244 2HB GLN 846 2HB GLN 846 -11.776 -0.794 -14.369 245 1HG GLN 846 1HG GLN 846 -12.734 -0.707 -16.906 246 2HG GLN 846 2HG GLN 846 -11.634 0.503 -16.245 247 2HE2 GLN 846 1HE2 GLN 846 -14.921 -0.075 -17.323 248 1HE2 GLN 846 2HE2 GLN 846 -15.481 1.512 -17.098 249 HA ALA 847 HA ALA 847 -10.736 -4.687 -15.625 250 1HB ALA 847 2HB ALA 847 -9.235 -4.162 -13.086 251 2HB ALA 847 1HB ALA 847 -9.304 -2.860 -14.275 252 3HB ALA 847 3HB ALA 847 -8.613 -4.421 -14.716 253 HA ASN 848 HA ASN 848 -13.003 -7.052 -12.274 254 1HB ASN 848 1HB ASN 848 -14.511 -6.947 -14.531 255 2HB ASN 848 2HB ASN 848 -13.920 -8.604 -14.640 256 2HD2 ASN 848 1HD2 ASN 848 -13.971 -9.663 -12.196 257 1HD2 ASN 848 2HD2 ASN 848 -15.476 -9.490 -11.429 258 HA GLN 849 HA GLN 849 -9.825 -10.094 -13.417 259 1HB GLN 849 1HB GLN 849 -8.533 -7.747 -13.318 260 2HB GLN 849 2HB GLN 849 -7.947 -8.412 -11.796 261 1HG GLN 849 1HG GLN 849 -7.590 -10.565 -13.404 262 2HG GLN 849 2HG GLN 849 -7.372 -9.267 -14.578 263 2HE2 GLN 849 1HE2 GLN 849 -5.915 -7.365 -13.578 264 1HE2 GLN 849 2HE2 GLN 849 -4.526 -7.874 -12.765 265 HA LYS 850 HA LYS 850 -8.321 -11.152 -8.924 266 1HB LYS 850 1HB LYS 850 -9.983 -12.987 -8.569 267 2HB LYS 850 2HB LYS 850 -10.731 -11.556 -9.270 268 1HG LYS 850 1HG LYS 850 -10.098 -12.796 -11.550 269 2HG LYS 850 2HG LYS 850 -11.591 -13.170 -10.688 270 1HD LYS 850 1HD LYS 850 -9.104 -14.780 -10.973 271 2HD LYS 850 2HD LYS 850 -9.905 -14.842 -9.403 272 1HE LYS 850 1HE LYS 850 -11.680 -15.096 -11.783 273 2HE LYS 850 2HE LYS 850 -10.618 -16.475 -11.434 274 1HZ LYS 850 1HZ LYS 850 -11.341 -16.328 -9.094 275 2HZ LYS 850 2HZ LYS 850 -12.466 -15.132 -9.533 276 3HZ LYS 850 3HZ LYS 850 -12.619 -16.704 -10.149 277 HA ARG 851 HA ARG 851 -6.583 -15.379 -9.522 278 1HB ARG 851 1HB ARG 851 -5.171 -12.926 -10.149 279 2HB ARG 851 2HB ARG 851 -4.045 -14.146 -9.555 280 1HG ARG 851 1HG ARG 851 -4.290 -15.441 -11.401 281 2HG ARG 851 2HG ARG 851 -6.037 -15.206 -11.442 282 1HD ARG 851 1HD ARG 851 -5.091 -12.695 -12.122 283 2HD ARG 851 2HD ARG 851 -5.605 -13.928 -13.290 284 HE ARG 851 HE ARG 851 -2.775 -13.607 -12.333 285 1HH1 ARG 851 1HH1 ARG 851 -2.756 -16.129 -13.505 286 2HH1 ARG 851 2HH1 ARG 851 -2.662 -15.872 -15.216 287 1HH2 ARG 851 1HH2 ARG 851 -3.692 -12.565 -15.042 288 2HH2 ARG 851 2HH2 ARG 851 -3.191 -13.853 -16.085 289 HA ILE 852 HA ILE 852 -4.773 -15.275 -5.289 290 HB ILE 852 HB ILE 852 -2.349 -14.652 -5.081 291 1HG1 ILE 852 1HG1 ILE 852 -3.261 -12.621 -7.025 292 2HG1 ILE 852 2HG1 ILE 852 -1.762 -13.413 -7.470 293 1HG2 ILE 852 1HG2 ILE 852 -3.345 -16.472 -6.643 294 2HG2 ILE 852 2HG2 ILE 852 -2.964 -15.349 -7.948 295 3HG2 ILE 852 3HG2 ILE 852 -1.678 -15.970 -6.914 296 1HD1 ILE 852 1HD1 ILE 852 -1.165 -12.972 -4.922 297 2HD1 ILE 852 2HD1 ILE 852 -0.952 -11.703 -6.125 298 3HD1 ILE 852 3HD1 ILE 852 -2.374 -11.709 -5.087 299 HA THR 853 HA THR 853 -3.856 -10.879 -3.390 300 HB THR 853 HB THR 853 -4.823 -8.801 -4.427 301 HG1 THR 853 HG1 THR 853 -6.078 -10.653 -5.891 302 1HG2 THR 853 1HG2 THR 853 -2.485 -9.651 -4.886 303 2HG2 THR 853 2HG2 THR 853 -3.116 -10.389 -6.351 304 3HG2 THR 853 3HG2 THR 853 -3.167 -8.640 -6.161 305 HA THR 854 HA THR 854 -7.936 -11.372 -1.789 306 HB THR 854 HB THR 854 -6.401 -12.138 -0.003 307 HG1 THR 854 HG1 THR 854 -8.291 -10.246 0.939 308 1HG2 THR 854 1HG2 THR 854 -5.544 -9.411 -0.091 309 2HG2 THR 854 2HG2 THR 854 -6.137 -9.748 1.534 310 3HG2 THR 854 3HG2 THR 854 -4.857 -10.742 0.839 311 HA PRO 855 HA PRO 855 -9.481 -7.248 -2.220 312 1HB PRO 855 1HB PRO 855 -11.703 -7.717 -2.013 313 2HB PRO 855 2HB PRO 855 -11.549 -7.678 -0.254 314 1HG PRO 855 1HG PRO 855 -11.984 -9.965 -1.919 315 2HG PRO 855 2HG PRO 855 -11.744 -9.940 -0.169 316 1HD PRO 855 1HD PRO 855 -9.704 -10.945 -0.478 317 2HD PRO 855 2HD PRO 855 -9.880 -10.822 -2.247 318 HA TYR 856 HA TYR 856 -7.724 -5.019 1.180 319 1HB TYR 856 1HB TYR 856 -8.438 -7.135 2.291 320 2HB TYR 856 2HB TYR 856 -6.832 -7.783 2.021 321 HD1 TYR 856 HD1 TYR 856 -4.843 -6.266 2.934 322 HD2 TYR 856 HD2 TYR 856 -8.912 -6.028 4.282 323 HE1 TYR 856 HE1 TYR 856 -4.082 -5.240 5.050 324 HE2 TYR 856 HE2 TYR 856 -8.152 -5.012 6.403 325 HH TYR 856 HH TYR 856 -6.275 -3.821 7.304 326 HA MET 857 HA MET 857 -3.761 -5.055 -1.073 327 1HB MET 857 1HB MET 857 -4.718 -2.665 -1.157 328 2HB MET 857 2HB MET 857 -3.834 -2.375 0.336 329 1HG MET 857 1HG MET 857 -1.840 -3.466 -1.051 330 2HG MET 857 2HG MET 857 -2.780 -2.886 -2.419 331 1HE MET 857 2HE MET 857 -4.171 -0.828 -1.900 332 2HE MET 857 1HE MET 857 -3.469 0.703 -1.392 333 3HE MET 857 3HE MET 857 -3.005 -0.014 -2.937 334 HA THR 858 HA THR 858 -1.371 -5.334 2.724 335 HB THR 858 HB THR 858 0.411 -6.999 2.151 336 HG1 THR 858 HG1 THR 858 0.902 -7.342 0.101 337 1HG2 THR 858 1HG2 THR 858 -2.325 -7.301 0.887 338 2HG2 THR 858 2HG2 THR 858 -1.224 -8.640 1.214 339 3HG2 THR 858 3HG2 THR 858 -1.887 -7.696 2.549 340 HA LYS 859 HA LYS 859 1.192 -1.892 3.510 341 1HB LYS 859 1HB LYS 859 1.540 -3.352 5.449 342 2HB LYS 859 2HB LYS 859 3.067 -2.625 4.950 343 1HG LYS 859 1HG LYS 859 2.247 -5.308 3.858 344 2HG LYS 859 2HG LYS 859 3.866 -4.633 4.036 345 1HD LYS 859 1HD LYS 859 3.114 -4.639 6.626 346 2HD LYS 859 2HD LYS 859 2.155 -6.001 6.046 347 1HE LYS 859 1HE LYS 859 4.951 -5.986 5.077 348 2HE LYS 859 2HE LYS 859 4.768 -6.225 6.826 349 1HZ LYS 859 1HZ LYS 859 3.026 -7.879 6.331 350 2HZ LYS 859 2HZ LYS 859 3.373 -7.728 4.675 351 3HZ LYS 859 3HZ LYS 859 4.549 -8.339 5.734 352 HA TYR 860 HA TYR 860 5.056 -3.217 0.976 353 1HB TYR 860 1HB TYR 860 4.958 -5.644 0.889 354 2HB TYR 860 2HB TYR 860 3.669 -5.590 -0.308 355 HD1 TYR 860 HD1 TYR 860 4.187 -4.125 -2.457 356 HD2 TYR 860 HD2 TYR 860 7.205 -5.756 0.127 357 HE1 TYR 860 HE1 TYR 860 5.870 -3.803 -4.226 358 HE2 TYR 860 HE2 TYR 860 8.884 -5.435 -1.664 359 HH TYR 860 HH TYR 860 9.182 -3.967 -3.671 360 HA GLU 861 HA GLU 861 2.392 -2.600 -3.107 361 1HB GLU 861 1HB GLU 861 -0.010 -2.893 -1.279 362 2HB GLU 861 2HB GLU 861 -0.131 -2.176 -2.887 363 1HG GLU 861 1HG GLU 861 0.795 -4.248 -3.873 364 2HG GLU 861 2HG GLU 861 0.886 -4.965 -2.264 365 HA ARG 862 HA ARG 862 1.351 1.366 -0.601 366 1HB ARG 862 1HB ARG 862 0.272 0.131 1.348 367 2HB ARG 862 2HB ARG 862 1.875 0.094 2.086 368 1HG ARG 862 1HG ARG 862 1.313 2.752 1.103 369 2HG ARG 862 2HG ARG 862 0.012 2.226 2.165 370 1HD ARG 862 1HD ARG 862 2.244 1.382 3.551 371 2HD ARG 862 2HD ARG 862 1.424 2.929 3.838 372 HE ARG 862 HE ARG 862 3.168 3.286 1.628 373 1HH1 ARG 862 1HH1 ARG 862 4.995 1.547 3.209 374 2HH1 ARG 862 2HH1 ARG 862 5.802 2.687 4.235 375 1HH2 ARG 862 1HH2 ARG 862 3.472 5.203 3.720 376 2HH2 ARG 862 2HH2 ARG 862 4.940 4.756 4.523 377 HA ALA 863 HA ALA 863 5.764 1.191 1.265 378 1HB ALA 863 2HB ALA 863 6.363 -1.684 0.589 379 2HB ALA 863 3HB ALA 863 7.142 -0.655 1.791 380 3HB ALA 863 1HB ALA 863 5.514 -1.271 2.079 381 HA ARG 864 HA ARG 864 7.240 0.321 -3.112 382 1HB ARG 864 1HB ARG 864 5.026 -1.485 -3.418 383 2HB ARG 864 2HB ARG 864 5.009 -0.384 -4.797 384 1HG ARG 864 1HG ARG 864 7.415 -1.973 -3.854 385 2HG ARG 864 2HG ARG 864 6.418 -2.368 -5.252 386 1HD ARG 864 1HD ARG 864 7.024 0.240 -5.800 387 2HD ARG 864 2HD ARG 864 8.504 -0.292 -4.977 388 HE ARG 864 HE ARG 864 8.537 -2.233 -6.591 389 1HH1 ARG 864 1HH1 ARG 864 5.674 -1.169 -7.487 390 2HH1 ARG 864 2HH1 ARG 864 6.075 -0.654 -9.092 391 1HH2 ARG 864 1HH2 ARG 864 9.500 -0.816 -8.574 392 2HH2 ARG 864 2HH2 ARG 864 8.241 -0.455 -9.707 393 HA VAL 865 HA VAL 865 3.355 3.244 -4.335 394 HB VAL 865 HB VAL 865 2.618 1.953 -1.779 395 1HG1 VAL 865 1HG1 VAL 865 2.113 4.827 -2.256 396 2HG1 VAL 865 2HG1 VAL 865 0.850 3.855 -1.502 397 3HG1 VAL 865 3HG1 VAL 865 2.439 3.973 -0.748 398 1HG2 VAL 865 1HG2 VAL 865 1.114 2.951 -4.152 399 2HG2 VAL 865 2HG2 VAL 865 1.565 1.289 -3.781 400 3HG2 VAL 865 3HG2 VAL 865 0.377 2.119 -2.781 401 HA LEU 866 HA LEU 866 4.905 5.865 -0.393 402 1HB LEU 866 1HB LEU 866 5.168 4.447 1.424 403 2HB LEU 866 2HB LEU 866 5.836 3.152 0.438 404 HG LEU 866 HG LEU 866 7.560 5.554 0.695 405 1HD1 LEU 866 1HD1 LEU 866 6.368 5.022 2.996 406 2HD1 LEU 866 2HD1 LEU 866 7.515 3.684 3.036 407 3HD1 LEU 866 3HD1 LEU 866 8.100 5.346 2.943 408 1HD2 LEU 866 1HD2 LEU 866 8.018 3.197 -0.356 409 2HD2 LEU 866 2HD2 LEU 866 9.280 3.956 0.614 410 3HD2 LEU 866 3HD2 LEU 866 8.267 2.692 1.314 411 1HA GLY 867 1HA GLY 867 9.117 5.117 -2.485 412 2HA GLY 867 2HA GLY 867 8.715 3.691 -3.447 413 HA THR 868 HA THR 868 7.005 6.229 -6.613 414 HB THR 868 HB THR 868 4.982 5.542 -7.598 415 HG1 THR 868 HG1 THR 868 4.197 4.985 -4.936 416 1HG2 THR 868 1HG2 THR 868 6.794 3.810 -6.748 417 2HG2 THR 868 2HG2 THR 868 5.402 3.201 -5.856 418 3HG2 THR 868 3HG2 THR 868 5.342 3.307 -7.616 419 HA ARG 869 HA ARG 869 3.984 8.961 -4.232 420 1HB ARG 869 1HB ARG 869 4.049 6.974 -2.162 421 2HB ARG 869 2HB ARG 869 4.538 8.501 -1.425 422 1HG ARG 869 1HG ARG 869 2.471 9.419 -1.662 423 2HG ARG 869 2HG ARG 869 2.241 8.722 -3.264 424 1HD ARG 869 1HD ARG 869 2.212 6.500 -1.574 425 2HD ARG 869 2HD ARG 869 1.301 7.731 -0.685 426 HE ARG 869 HE ARG 869 -0.168 7.979 -2.638 427 1HH1 ARG 869 1HH1 ARG 869 1.669 7.054 -4.787 428 2HH1 ARG 869 2HH1 ARG 869 1.066 5.468 -5.138 429 1HH2 ARG 869 1HH2 ARG 869 -0.755 5.221 -2.198 430 2HH2 ARG 869 2HH2 ARG 869 -0.306 4.430 -3.672 431 HA ALA 870 HA ALA 870 8.062 10.151 -1.797 432 1HB ALA 870 3HB ALA 870 8.787 8.095 -0.856 433 2HB ALA 870 2HB ALA 870 10.102 8.567 -1.933 434 3HB ALA 870 1HB ALA 870 8.941 7.341 -2.442 435 HA LEU 871 HA LEU 871 10.134 10.382 -5.908 436 1HB LEU 871 1HB LEU 871 9.249 8.893 -8.133 437 2HB LEU 871 2HB LEU 871 10.771 8.704 -7.278 438 HG LEU 871 HG LEU 871 8.373 7.363 -6.136 439 1HD1 LEU 871 1HD1 LEU 871 8.291 6.954 -8.604 440 2HD1 LEU 871 2HD1 LEU 871 9.911 6.267 -8.495 441 3HD1 LEU 871 3HD1 LEU 871 8.566 5.493 -7.655 442 1HD2 LEU 871 1HD2 LEU 871 11.311 6.679 -6.477 443 2HD2 LEU 871 2HD2 LEU 871 10.532 7.223 -4.991 444 3HD2 LEU 871 3HD2 LEU 871 10.138 5.642 -5.666 445 HA GLN 872 HA GLN 872 5.931 11.186 -8.352 446 1HB GLN 872 1HB GLN 872 4.926 10.177 -5.768 447 2HB GLN 872 2HB GLN 872 4.112 11.641 -6.308 448 1HG GLN 872 1HG GLN 872 3.743 10.530 -8.543 449 2HG GLN 872 2HG GLN 872 4.384 9.044 -7.844 450 2HE2 GLN 872 1HE2 GLN 872 2.285 7.958 -8.049 451 1HE2 GLN 872 2HE2 GLN 872 0.993 8.353 -7.021 452 HA ILE 873 HA ILE 873 6.026 15.014 -5.352 453 HB ILE 873 HB ILE 873 7.152 14.747 -2.978 454 1HG1 ILE 873 1HG1 ILE 873 6.061 12.183 -2.518 455 2HG1 ILE 873 2HG1 ILE 873 7.046 12.028 -3.967 456 1HG2 ILE 873 1HG2 ILE 873 4.431 14.097 -3.971 457 2HG2 ILE 873 2HG2 ILE 873 4.776 13.848 -2.262 458 3HG2 ILE 873 3HG2 ILE 873 4.972 15.446 -2.974 459 1HD1 ILE 873 1HD1 ILE 873 8.158 13.525 -1.650 460 2HD1 ILE 873 2HD1 ILE 873 8.134 11.766 -1.601 461 3HD1 ILE 873 3HD1 ILE 873 8.986 12.601 -2.896 462 HA ALA 874 HA ALA 874 10.782 14.397 -4.685 463 1HB ALA 874 1HB ALA 874 10.662 11.906 -6.397 464 2HB ALA 874 3HB ALA 874 10.908 11.930 -4.650 465 3HB ALA 874 2HB ALA 874 12.129 12.610 -5.721 466 HA MET 875 HA MET 875 10.487 15.557 -9.163 467 1HB MET 875 1HB MET 875 8.448 13.662 -9.465 468 2HB MET 875 2HB MET 875 7.663 15.176 -9.913 469 1HG MET 875 1HG MET 875 10.388 14.574 -11.012 470 2HG MET 875 2HG MET 875 8.983 13.783 -11.728 471 1HE MET 875 1HE MET 875 6.826 15.016 -12.062 472 2HE MET 875 2HE MET 875 6.777 16.454 -13.078 473 3HE MET 875 3HE MET 875 7.565 14.982 -13.661 474 HA CYS 876 HA CYS 876 7.554 18.663 -7.255 475 1HB CYS 876 1HB CYS 876 5.765 17.497 -9.359 476 2HB CYS 876 2HB CYS 876 5.081 18.770 -8.350 477 HG CYS 876 HG CYS 876 7.758 19.230 -9.903 478 HA ALA 877 HA ALA 877 4.525 15.647 -4.955 479 1HB ALA 877 3HB ALA 877 4.574 17.698 -3.934 480 2HB ALA 877 1HB ALA 877 3.679 18.481 -5.236 481 3HB ALA 877 2HB ALA 877 2.835 17.449 -4.081 482 HA PRO 878 HA PRO 878 0.800 14.879 -7.874 483 1HB PRO 878 1HB PRO 878 1.751 12.182 -8.128 484 2HB PRO 878 2HB PRO 878 1.608 13.396 -9.403 485 1HG PRO 878 1HG PRO 878 3.861 13.540 -9.490 486 2HG PRO 878 2HG PRO 878 3.998 12.384 -8.172 487 1HD PRO 878 1HD PRO 878 4.674 14.063 -6.797 488 2HD PRO 878 2HD PRO 878 4.436 15.238 -8.108 489 HA VAL 879 HA VAL 879 1.077 11.546 -4.128 490 HB VAL 879 HB VAL 879 2.762 13.856 -3.214 491 1HG1 VAL 879 1HG1 VAL 879 1.155 13.287 -1.319 492 2HG1 VAL 879 2HG1 VAL 879 1.957 11.724 -1.253 493 3HG1 VAL 879 3HG1 VAL 879 2.864 13.197 -0.952 494 1HG2 VAL 879 1HG2 VAL 879 3.409 11.513 -4.377 495 2HG2 VAL 879 2HG2 VAL 879 4.485 12.342 -3.272 496 3HG2 VAL 879 3HG2 VAL 879 3.485 11.025 -2.689 497 HA MET 880 HA MET 880 -2.506 13.684 -2.640 498 1HB MET 880 1HB MET 880 -2.070 11.187 -1.414 499 2HB MET 880 2HB MET 880 -2.673 12.233 -0.130 500 1HG MET 880 1HG MET 880 -3.987 11.970 -2.847 501 2HG MET 880 2HG MET 880 -4.492 11.072 -1.419 502 1HE MET 880 2HE MET 880 -6.112 13.012 -3.320 503 2HE MET 880 3HE MET 880 -6.389 14.658 -2.735 504 3HE MET 880 1HE MET 880 -4.844 14.228 -3.466 505 HA VAL 881 HA VAL 881 -0.935 16.626 0.307 506 HB VAL 881 HB VAL 881 0.928 16.133 1.948 507 1HG1 VAL 881 1HG1 VAL 881 -1.557 15.069 1.848 508 2HG1 VAL 881 2HG1 VAL 881 -0.614 13.581 1.768 509 3HG1 VAL 881 3HG1 VAL 881 -0.418 14.679 3.132 510 1HG2 VAL 881 1HG2 VAL 881 2.137 14.732 0.060 511 2HG2 VAL 881 2HG2 VAL 881 2.296 14.256 1.751 512 3HG2 VAL 881 3HG2 VAL 881 1.159 13.411 0.700 513 HA GLU 882 HA GLU 882 2.739 18.297 -1.737 514 1HB GLU 882 1HB GLU 882 0.272 19.381 -1.959 515 2HB GLU 882 2HB GLU 882 1.167 20.779 -1.365 516 1HG GLU 882 1HG GLU 882 2.871 20.369 -3.169 517 2HG GLU 882 2HG GLU 882 1.811 19.116 -3.814 518 HA LEU 883 HA LEU 883 4.528 20.313 2.084 519 1HB LEU 883 1HB LEU 883 7.170 19.573 1.447 520 2HB LEU 883 2HB LEU 883 6.172 18.898 2.723 521 HG LEU 883 HG LEU 883 5.293 17.230 1.034 522 1HD1 LEU 883 1HD1 LEU 883 5.919 18.571 -0.989 523 2HD1 LEU 883 2HD1 LEU 883 7.618 18.273 -0.619 524 3HD1 LEU 883 3HD1 LEU 883 6.557 16.931 -1.039 525 1HD2 LEU 883 1HD2 LEU 883 7.941 17.403 2.256 526 2HD2 LEU 883 2HD2 LEU 883 6.828 16.036 2.183 527 3HD2 LEU 883 3HD2 LEU 883 7.931 16.348 0.844 528 HA GLU 884 HA GLU 884 6.428 22.915 -1.256 529 1HB GLU 884 1HB GLU 884 8.470 22.014 0.515 530 2HB GLU 884 2HB GLU 884 9.258 22.516 -0.980 531 1HG GLU 884 1HG GLU 884 8.073 24.679 -0.885 532 2HG GLU 884 2HG GLU 884 7.283 24.181 0.612 533 1HA GLY 885 1HA GLY 885 7.016 19.639 -4.818 534 2HA GLY 885 2HA GLY 885 8.430 20.692 -4.748 535 HA GLU 886 HA GLU 886 9.585 16.471 -2.150 536 1HB GLU 886 1HB GLU 886 10.263 16.320 -4.415 537 2HB GLU 886 2HB GLU 886 11.190 17.816 -4.330 538 1HG GLU 886 1HG GLU 886 12.838 16.721 -2.863 539 2HG GLU 886 2HG GLU 886 11.898 15.229 -2.910 540 HA THR 887 HA THR 887 13.202 17.777 0.191 541 HB THR 887 HB THR 887 10.642 17.889 1.837 542 HG1 THR 887 HG1 THR 887 12.187 19.885 0.543 543 1HG2 THR 887 1HG2 THR 887 13.480 18.531 2.509 544 2HG2 THR 887 2HG2 THR 887 12.229 19.623 3.104 545 3HG2 THR 887 3HG2 THR 887 12.192 17.915 3.545 546 HA ASP 888 HA ASP 888 12.634 14.098 3.009 547 1HB ASP 888 1HB ASP 888 10.210 14.971 3.562 548 2HB ASP 888 2HB ASP 888 9.737 13.515 2.693 549 HA PRO 889 HA PRO 889 12.912 11.104 -0.265 550 1HB PRO 889 1HB PRO 889 13.460 8.970 1.581 551 2HB PRO 889 2HB PRO 889 14.613 9.885 0.606 552 1HG PRO 889 1HG PRO 889 14.301 9.989 3.428 553 2HG PRO 889 2HG PRO 889 15.337 11.014 2.430 554 1HD PRO 889 1HD PRO 889 13.999 12.779 2.973 555 2HD PRO 889 2HD PRO 889 12.817 11.701 3.759 556 HA LEU 890 HA LEU 890 8.677 9.532 0.715 557 1HB LEU 890 1HB LEU 890 8.719 7.375 1.858 558 2HB LEU 890 2HB LEU 890 10.307 7.709 1.195 559 HG LEU 890 HG LEU 890 10.638 6.820 3.397 560 1HD1 LEU 890 1HD1 LEU 890 11.968 8.899 2.768 561 2HD1 LEU 890 2HD1 LEU 890 10.868 9.802 3.808 562 3HD1 LEU 890 3HD1 LEU 890 11.879 8.528 4.486 563 1HD2 LEU 890 1HD2 LEU 890 8.176 7.669 3.990 564 2HD2 LEU 890 2HD2 LEU 890 9.362 7.283 5.236 565 3HD2 LEU 890 3HD2 LEU 890 9.095 8.961 4.765 566 HA LEU 891 HA LEU 891 7.545 11.096 5.313 567 1HB LEU 891 1HB LEU 891 8.544 13.177 5.481 568 2HB LEU 891 2HB LEU 891 8.377 13.476 3.762 569 HG LEU 891 HG LEU 891 7.008 14.983 5.254 570 1HD1 LEU 891 1HD1 LEU 891 6.396 14.053 2.757 571 2HD1 LEU 891 2HD1 LEU 891 4.930 13.636 3.647 572 3HD1 LEU 891 3HD1 LEU 891 5.485 15.305 3.597 573 1HD2 LEU 891 1HD2 LEU 891 6.296 12.591 6.468 574 2HD2 LEU 891 2HD2 LEU 891 5.539 14.158 6.753 575 3HD2 LEU 891 3HD2 LEU 891 4.851 13.049 5.569 576 HA ILE 892 HA ILE 892 4.054 12.584 2.286 577 HB ILE 892 HB ILE 892 6.292 12.255 0.403 578 1HG1 ILE 892 1HG1 ILE 892 3.974 13.993 -0.139 579 2HG1 ILE 892 2HG1 ILE 892 4.850 14.305 1.360 580 1HG2 ILE 892 1HG2 ILE 892 3.539 11.328 -0.274 581 2HG2 ILE 892 2HG2 ILE 892 4.462 12.218 -1.473 582 3HG2 ILE 892 3HG2 ILE 892 5.100 10.716 -0.822 583 1HD1 ILE 892 1HD1 ILE 892 6.421 13.786 -1.093 584 2HD1 ILE 892 2HD1 ILE 892 5.643 15.354 -0.941 585 3HD1 ILE 892 3HD1 ILE 892 6.803 14.817 0.277 586 HA ALA 893 HA ALA 893 3.998 8.083 0.769 587 1HB ALA 893 3HB ALA 893 6.031 7.280 0.075 588 2HB ALA 893 1HB ALA 893 6.866 7.888 1.500 589 3HB ALA 893 2HB ALA 893 5.917 6.411 1.601 590 HA MET 894 HA MET 894 3.945 7.149 5.428 591 1HB MET 894 1HB MET 894 5.057 8.230 7.244 592 2HB MET 894 2HB MET 894 5.217 9.739 6.352 593 1HG MET 894 1HG MET 894 6.579 7.255 5.363 594 2HG MET 894 2HG MET 894 6.988 8.944 5.070 595 1HE MET 894 2HE MET 894 7.316 10.575 7.115 596 2HE MET 894 1HE MET 894 8.746 10.232 8.084 597 3HE MET 894 3HE MET 894 8.848 10.166 6.327 598 HA LYS 895 HA LYS 895 1.598 11.313 6.416 599 1HB LYS 895 1HB LYS 895 2.935 13.075 5.579 600 2HB LYS 895 2HB LYS 895 2.970 12.394 3.954 601 1HG LYS 895 1HG LYS 895 0.981 13.333 3.377 602 2HG LYS 895 2HG LYS 895 0.280 13.081 4.975 603 1HD LYS 895 1HD LYS 895 2.248 14.940 5.495 604 2HD LYS 895 2HD LYS 895 1.688 15.429 3.896 605 1HE LYS 895 1HE LYS 895 -0.706 14.990 5.085 606 2HE LYS 895 2HE LYS 895 0.120 16.560 5.170 607 1HZ LYS 895 3HZ LYS 895 0.456 14.315 7.101 608 2HZ LYS 895 1HZ LYS 895 1.208 15.836 7.198 609 3HZ LYS 895 2HZ LYS 895 -0.476 15.704 7.384 610 HA GLU 896 HA GLU 896 -0.753 10.301 2.239 611 1HB GLU 896 1HB GLU 896 1.710 8.712 1.570 612 2HB GLU 896 2HB GLU 896 0.175 8.237 0.862 613 1HG GLU 896 1HG GLU 896 0.499 11.103 0.683 614 2HG GLU 896 2HG GLU 896 1.885 10.281 -0.035 615 HA LEU 897 HA LEU 897 -1.342 5.947 3.943 616 1HB LEU 897 1HB LEU 897 0.810 4.835 3.843 617 2HB LEU 897 2HB LEU 897 1.411 5.788 5.198 618 HG LEU 897 HG LEU 897 0.472 3.287 5.524 619 1HD1 LEU 897 1HD1 LEU 897 1.378 5.134 7.166 620 2HD1 LEU 897 2HD1 LEU 897 -0.325 5.303 7.594 621 3HD1 LEU 897 3HD1 LEU 897 0.486 3.751 7.800 622 1HD2 LEU 897 1HD2 LEU 897 -1.856 4.442 4.710 623 2HD2 LEU 897 2HD2 LEU 897 -1.803 3.097 5.840 624 3HD2 LEU 897 3HD2 LEU 897 -1.963 4.740 6.444 625 HA LYS 898 HA LYS 898 -0.712 7.579 8.582 626 1HB LYS 898 1HB LYS 898 1.372 8.828 8.146 627 2HB LYS 898 2HB LYS 898 0.460 9.989 7.183 628 1HG LYS 898 1HG LYS 898 -0.595 10.918 9.035 629 2HG LYS 898 2HG LYS 898 -0.374 9.471 10.018 630 1HD LYS 898 1HD LYS 898 2.104 10.828 9.092 631 2HD LYS 898 2HD LYS 898 1.153 11.677 10.313 632 1HE LYS 898 1HE LYS 898 1.690 8.751 10.716 633 2HE LYS 898 2HE LYS 898 2.982 9.915 11.069 634 1HZ LYS 898 1HZ LYS 898 1.381 11.202 12.380 635 2HZ LYS 898 2HZ LYS 898 0.201 10.011 12.111 636 3HZ LYS 898 3HZ LYS 898 1.590 9.638 13.009 637 HA ALA 899 HA ALA 899 -3.748 10.721 6.829 638 1HB ALA 899 2HB ALA 899 -3.955 11.316 4.304 639 2HB ALA 899 3HB ALA 899 -2.505 11.857 5.147 640 3HB ALA 899 1HB ALA 899 -2.442 10.430 4.113 641 HA ARG 900 HA ARG 900 -4.507 5.915 4.597 642 1HB ARG 900 1HB ARG 900 -6.292 5.544 6.092 643 2HB ARG 900 2HB ARG 900 -6.705 7.260 6.165 644 1HG ARG 900 1HG ARG 900 -4.053 6.278 7.166 645 2HG ARG 900 2HG ARG 900 -4.922 7.749 7.598 646 1HD ARG 900 1HD ARG 900 -6.427 6.600 9.010 647 2HD ARG 900 2HD ARG 900 -6.098 5.037 8.234 648 HE ARG 900 HE ARG 900 -3.801 5.158 9.244 649 1HH1 ARG 900 1HH1 ARG 900 -3.970 8.065 10.055 650 2HH1 ARG 900 2HH1 ARG 900 -4.262 7.935 11.758 651 1HH2 ARG 900 1HH2 ARG 900 -5.192 4.597 11.611 652 2HH2 ARG 900 2HH2 ARG 900 -4.954 5.972 12.639 653 HA LYS 901 HA LYS 901 -6.962 8.708 2.049 654 1HB LYS 901 1HB LYS 901 -6.068 10.743 3.058 655 2HB LYS 901 2HB LYS 901 -4.584 10.572 2.124 656 1HG LYS 901 1HG LYS 901 -6.300 12.229 1.201 657 2HG LYS 901 2HG LYS 901 -5.709 11.016 0.066 658 1HD LYS 901 1HD LYS 901 -7.720 9.931 -0.037 659 2HD LYS 901 2HD LYS 901 -8.101 10.261 1.653 660 1HE LYS 901 1HE LYS 901 -8.196 12.789 0.681 661 2HE LYS 901 2HE LYS 901 -9.612 11.719 0.675 662 1HZ LYS 901 1HZ LYS 901 -8.943 10.936 -1.521 663 2HZ LYS 901 2HZ LYS 901 -9.163 12.620 -1.542 664 3HZ LYS 901 3HZ LYS 901 -7.596 11.966 -1.505 665 HA ILE 902 HA ILE 902 -3.053 7.901 -1.054 666 HB ILE 902 HB ILE 902 -2.367 5.460 -0.974 667 1HG1 ILE 902 1HG1 ILE 902 -4.551 5.294 0.781 668 2HG1 ILE 902 2HG1 ILE 902 -3.374 4.028 0.450 669 1HG2 ILE 902 1HG2 ILE 902 -1.849 7.299 1.370 670 2HG2 ILE 902 2HG2 ILE 902 -0.956 5.800 1.104 671 3HG2 ILE 902 3HG2 ILE 902 -0.876 7.097 -0.087 672 1HD1 ILE 902 3HD1 ILE 902 -2.991 6.155 2.578 673 2HD1 ILE 902 1HD1 ILE 902 -3.666 4.559 2.900 674 3HD1 ILE 902 2HD1 ILE 902 -2.008 4.714 2.322 675 HA PRO 903 HA PRO 903 -6.893 6.315 -3.069 676 1HB PRO 903 1HB PRO 903 -6.614 8.450 -4.976 677 2HB PRO 903 2HB PRO 903 -7.793 8.342 -3.665 678 1HG PRO 903 1HG PRO 903 -5.737 10.231 -3.828 679 2HG PRO 903 2HG PRO 903 -6.636 9.822 -2.359 680 1HD PRO 903 1HD PRO 903 -4.542 9.208 -1.554 681 2HD PRO 903 2HD PRO 903 -3.892 8.951 -3.194 682 HA ILE 904 HA ILE 904 -4.655 4.973 -6.652 683 HB ILE 904 HB ILE 904 -2.772 5.372 -4.505 684 1HG1 ILE 904 1HG1 ILE 904 -1.952 5.552 -7.346 685 2HG1 ILE 904 2HG1 ILE 904 -3.362 6.506 -6.890 686 1HG2 ILE 904 1HG2 ILE 904 -2.100 3.280 -6.582 687 2HG2 ILE 904 2HG2 ILE 904 -0.890 4.133 -5.622 688 3HG2 ILE 904 3HG2 ILE 904 -2.073 3.092 -4.829 689 1HD1 ILE 904 1HD1 ILE 904 -1.707 7.050 -4.799 690 2HD1 ILE 904 2HD1 ILE 904 -0.530 6.834 -6.094 691 3HD1 ILE 904 3HD1 ILE 904 -1.802 8.045 -6.252 692 HA ILE 905 HA ILE 905 -4.896 0.573 -6.604 693 HB ILE 905 HB ILE 905 -6.051 1.433 -8.605 694 1HG1 ILE 905 1HG1 ILE 905 -4.571 -0.651 -9.986 695 2HG1 ILE 905 2HG1 ILE 905 -4.880 -1.100 -8.310 696 1HG2 ILE 905 1HG2 ILE 905 -3.404 2.209 -9.346 697 2HG2 ILE 905 2HG2 ILE 905 -3.996 1.090 -10.572 698 3HG2 ILE 905 3HG2 ILE 905 -4.913 2.546 -10.192 699 1HD1 ILE 905 1HD1 ILE 905 -7.045 0.025 -10.082 700 2HD1 ILE 905 2HD1 ILE 905 -6.704 -1.704 -10.005 701 3HD1 ILE 905 3HD1 ILE 905 -7.226 -0.839 -8.556 702 HA ILE 906 HA ILE 906 -0.697 -0.678 -7.879 703 HB ILE 906 HB ILE 906 -1.699 -1.542 -5.196 704 1HG1 ILE 906 1HG1 ILE 906 0.581 0.070 -6.318 705 2HG1 ILE 906 2HG1 ILE 906 0.520 -0.373 -4.613 706 1HG2 ILE 906 1HG2 ILE 906 0.719 -2.719 -6.572 707 2HG2 ILE 906 2HG2 ILE 906 0.657 -2.554 -4.818 708 3HG2 ILE 906 3HG2 ILE 906 -0.532 -3.555 -5.652 709 1HD1 ILE 906 1HD1 ILE 906 -2.045 0.597 -5.227 710 2HD1 ILE 906 2HD1 ILE 906 -0.802 1.424 -4.292 711 3HD1 ILE 906 3HD1 ILE 906 -0.925 1.697 -6.027 712 HA ARG 907 HA ARG 907 -1.590 -4.781 -9.343 713 1HB ARG 907 1HB ARG 907 0.903 -3.738 -10.633 714 2HB ARG 907 2HB ARG 907 0.276 -5.329 -11.044 715 1HG ARG 907 1HG ARG 907 -0.640 -3.676 -12.589 716 2HG ARG 907 2HG ARG 907 -1.920 -4.310 -11.557 717 1HD ARG 907 1HD ARG 907 -2.272 -2.287 -10.535 718 2HD ARG 907 2HD ARG 907 -0.543 -1.884 -10.524 719 HE ARG 907 HE ARG 907 -0.844 -0.835 -12.617 720 1HH1 ARG 907 1HH1 ARG 907 -3.878 -1.486 -11.619 721 2HH1 ARG 907 2HH1 ARG 907 -4.566 -1.795 -13.178 722 1HH2 ARG 907 1HH2 ARG 907 -1.502 -1.924 -14.797 723 2HH2 ARG 907 2HH2 ARG 907 -3.221 -2.044 -14.977 724 HA ARG 908 HA ARG 908 1.204 -7.093 -6.765 725 1HB ARG 908 1HB ARG 908 -1.342 -8.647 -6.358 726 2HB ARG 908 2HB ARG 908 -0.033 -8.396 -5.223 727 1HG ARG 908 1HG ARG 908 -0.729 -5.952 -5.123 728 2HG ARG 908 2HG ARG 908 -2.169 -6.404 -6.038 729 1HD ARG 908 1HD ARG 908 -2.678 -8.128 -4.220 730 2HD ARG 908 2HD ARG 908 -2.734 -6.460 -3.619 731 HE ARG 908 HE ARG 908 -0.082 -7.177 -3.287 732 1HH1 ARG 908 1HH1 ARG 908 -2.896 -7.433 -1.571 733 2HH1 ARG 908 2HH1 ARG 908 -2.393 -8.741 -0.552 734 1HH2 ARG 908 1HH2 ARG 908 0.496 -9.387 -2.357 735 2HH2 ARG 908 2HH2 ARG 908 -0.471 -9.846 -0.996 736 HA TYR 909 HA TYR 909 0.994 -10.314 -9.953 737 1HB TYR 909 1HB TYR 909 3.876 -9.655 -10.347 738 2HB TYR 909 2HB TYR 909 2.708 -10.240 -11.511 739 HD1 TYR 909 HD1 TYR 909 1.130 -8.693 -12.600 740 HD2 TYR 909 HD2 TYR 909 4.158 -7.257 -9.937 741 HE1 TYR 909 HE1 TYR 909 0.872 -6.430 -13.512 742 HE2 TYR 909 HE2 TYR 909 3.919 -5.002 -10.848 743 HH TYR 909 HH TYR 909 2.296 -4.359 -13.731 744 HA LEU 910 HA LEU 910 3.881 -12.709 -7.463 745 1HB LEU 910 1HB LEU 910 1.908 -14.446 -8.935 746 2HB LEU 910 2HB LEU 910 2.750 -14.943 -7.466 747 HG LEU 910 HG LEU 910 0.780 -12.665 -7.801 748 1HD1 LEU 910 1HD1 LEU 910 0.760 -15.408 -6.669 749 2HD1 LEU 910 2HD1 LEU 910 -0.108 -14.176 -5.762 750 3HD1 LEU 910 3HD1 LEU 910 -0.530 -14.496 -7.440 751 1HD2 LEU 910 1HD2 LEU 910 2.956 -12.915 -5.931 752 2HD2 LEU 910 2HD2 LEU 910 1.728 -11.654 -6.026 753 3HD2 LEU 910 3HD2 LEU 910 1.433 -13.102 -5.068 754 HA PRO 911 HA PRO 911 7.078 -14.104 -10.310 755 1HB PRO 911 1HB PRO 911 8.639 -14.719 -7.973 756 2HB PRO 911 2HB PRO 911 8.838 -13.346 -9.064 757 1HG PRO 911 1HG PRO 911 8.060 -11.956 -7.453 758 2HG PRO 911 2HG PRO 911 7.842 -13.330 -6.368 759 1HD PRO 911 1HD PRO 911 5.579 -13.166 -6.617 760 2HD PRO 911 2HD PRO 911 5.800 -11.797 -7.727 761 HA ASP 912 HA ASP 912 6.431 -18.232 -7.868 762 1HB ASP 912 1HB ASP 912 4.138 -16.756 -6.677 763 2HB ASP 912 2HB ASP 912 3.923 -18.497 -6.855 764 1HA GLY 913 1HA GLY 913 3.530 -17.587 -11.865 765 2HA GLY 913 2HA GLY 913 3.125 -19.048 -10.967 766 HA SER 914 HA SER 914 -0.510 -15.993 -11.362 767 1HB SER 914 1HB SER 914 0.338 -16.126 -8.476 768 2HB SER 914 2HB SER 914 -1.240 -15.479 -8.916 769 HG SER 914 HG SER 914 -1.548 -17.478 -10.093 770 HA TYR 915 HA TYR 915 -0.060 -11.656 -9.480 771 1HB TYR 915 1HB TYR 915 0.939 -11.195 -11.488 772 2HB TYR 915 2HB TYR 915 0.040 -12.487 -12.271 773 HD1 TYR 915 HD1 TYR 915 -0.450 -8.965 -11.035 774 HD2 TYR 915 HD2 TYR 915 -1.499 -11.954 -13.937 775 HE1 TYR 915 HE1 TYR 915 -1.810 -7.297 -12.263 776 HE2 TYR 915 HE2 TYR 915 -2.857 -10.284 -15.165 777 HH TYR 915 HH TYR 915 -2.637 -6.971 -14.611 778 HA GLU 916 HA GLU 916 -4.192 -9.776 -10.514 779 1HB GLU 916 1HB GLU 916 -3.695 -10.884 -8.015 780 2HB GLU 916 2HB GLU 916 -4.300 -9.266 -7.654 781 1HG GLU 916 1HG GLU 916 -5.731 -10.842 -9.745 782 2HG GLU 916 2HG GLU 916 -5.967 -11.311 -8.061 783 HA ASP 917 HA ASP 917 -3.303 -5.452 -9.733 784 1HB ASP 917 1HB ASP 917 -3.636 -5.828 -12.174 785 2HB ASP 917 2HB ASP 917 -4.095 -4.231 -11.632 786 HA TRP 918 HA TRP 918 -6.418 -2.454 -8.381 787 1HB TRP 918 1HB TRP 918 -7.835 -3.648 -6.729 788 2HB TRP 918 2HB TRP 918 -7.860 -4.362 -8.324 789 HD1 TRP 918 HD1 TRP 918 -4.761 -5.724 -7.271 790 HE1 TRP 918 HE1 TRP 918 -5.082 -8.049 -6.217 791 HE3 TRP 918 HE3 TRP 918 -9.605 -5.348 -6.062 792 HZ2 TRP 918 HZ2 TRP 918 -7.190 -9.499 -4.846 793 HZ3 TRP 918 HZ3 TRP 918 -10.774 -7.089 -4.810 794 HH2 TRP 918 HH2 TRP 918 -9.586 -9.210 -4.201 795 1HA GLY 919 1HA GLY 919 -4.575 -2.397 -4.170 796 2HA GLY 919 2HA GLY 919 -4.347 -0.848 -4.960 797 HA VAL 920 HA VAL 920 -7.460 0.344 -2.071 798 HB VAL 920 HB VAL 920 -6.262 2.790 -3.420 799 1HG1 VAL 920 1HG1 VAL 920 -8.060 2.473 -1.032 800 2HG1 VAL 920 2HG1 VAL 920 -6.830 3.737 -1.020 801 3HG1 VAL 920 3HG1 VAL 920 -8.071 3.726 -2.274 802 1HG2 VAL 920 1HG2 VAL 920 -5.413 0.848 -1.362 803 2HG2 VAL 920 2HG2 VAL 920 -4.439 1.873 -2.419 804 3HG2 VAL 920 3HG2 VAL 920 -5.138 2.538 -0.943 805 HA ASP 921 HA ASP 921 -10.336 2.162 -5.244 806 1HB ASP 921 1HB ASP 921 -8.642 2.192 -7.161 807 2HB ASP 921 2HB ASP 921 -9.199 0.564 -7.557 808 HA GLU 922 HA GLU 922 -12.097 -2.014 -5.050 809 1HB GLU 922 1HB GLU 922 -10.437 -2.538 -6.950 810 2HB GLU 922 2HB GLU 922 -9.619 -3.565 -5.775 811 1HG GLU 922 1HG GLU 922 -11.498 -4.997 -5.539 812 2HG GLU 922 2HG GLU 922 -12.592 -3.815 -6.258 813 HA LEU 923 HA LEU 923 -10.297 -3.317 -1.061 814 1HB LEU 923 1HB LEU 923 -7.977 -4.504 -0.990 815 2HB LEU 923 2HB LEU 923 -9.133 -4.989 -2.213 816 HG LEU 923 HG LEU 923 -7.613 -2.765 -3.205 817 1HD1 LEU 923 1HD1 LEU 923 -6.011 -5.157 -2.273 818 2HD1 LEU 923 2HD1 LEU 923 -5.437 -3.931 -3.403 819 3HD1 LEU 923 3HD1 LEU 923 -5.807 -3.493 -1.742 820 1HD2 LEU 923 1HD2 LEU 923 -8.913 -4.574 -4.309 821 2HD2 LEU 923 2HD2 LEU 923 -7.315 -4.251 -4.986 822 3HD2 LEU 923 3HD2 LEU 923 -7.569 -5.650 -3.939 823 HA ILE 924 HA ILE 924 -7.792 -1.187 1.869 824 HB ILE 924 HB ILE 924 -6.729 -3.880 1.866 825 1HG1 ILE 924 1HG1 ILE 924 -7.071 -3.486 4.323 826 2HG1 ILE 924 2HG1 ILE 924 -7.567 -1.847 3.899 827 1HG2 ILE 924 1HG2 ILE 924 -4.529 -2.705 1.831 828 2HG2 ILE 924 2HG2 ILE 924 -5.019 -1.849 3.291 829 3HG2 ILE 924 3HG2 ILE 924 -4.832 -3.599 3.313 830 1HD1 ILE 924 3HD1 ILE 924 -8.766 -4.351 2.707 831 2HD1 ILE 924 1HD1 ILE 924 -9.494 -3.429 4.024 832 3HD1 ILE 924 2HD1 ILE 924 -9.297 -2.692 2.434 833 HA ILE 925 HA ILE 925 -4.111 0.808 0.452 834 HB ILE 925 HB ILE 925 -3.716 2.608 2.177 835 1HG1 ILE 925 1HG1 ILE 925 -6.073 1.566 3.702 836 2HG1 ILE 925 2HG1 ILE 925 -4.501 0.835 4.023 837 1HG2 ILE 925 1HG2 ILE 925 -6.308 1.940 0.912 838 2HG2 ILE 925 2HG2 ILE 925 -6.383 3.153 2.191 839 3HG2 ILE 925 3HG2 ILE 925 -5.341 3.409 0.792 840 1HD1 ILE 925 1HD1 ILE 925 -3.561 3.113 4.419 841 2HD1 ILE 925 2HD1 ILE 925 -5.174 3.789 4.194 842 3HD1 ILE 925 3HD1 ILE 925 -4.851 2.713 5.552 843 HA THR 926 HA THR 926 -0.513 -0.400 2.976 844 HB THR 926 HB THR 926 -1.384 0.987 5.521 845 HG1 THR 926 HG1 THR 926 -1.502 2.501 3.895 846 1HG2 THR 926 1HG2 THR 926 1.155 -0.111 4.409 847 2HG2 THR 926 2HG2 THR 926 1.257 1.343 5.402 848 3HG2 THR 926 3HG2 THR 926 0.552 -0.130 6.066 849 HA ASP 927 HA ASP 927 -3.578 -3.268 5.220 850 1HB ASP 927 1HB ASP 927 -2.823 -3.451 7.633 851 2HB ASP 927 2HB ASP 927 -1.515 -3.109 6.503 No H/Q in entry = 851 Start of MODEL 10 1 H1 MET 801 H1 MET 801 34.810 -2.650 -2.201 2 H2 MET 801 H2 MET 801 36.192 -2.759 -3.183 3 H3 MET 801 H3 MET 801 34.761 -3.554 -3.636 4 HA MET 801 HA MET 801 34.947 -5.111 -1.856 5 1HB MET 801 1HB MET 801 37.000 -4.564 -3.857 6 2HB MET 801 2HB MET 801 37.652 -5.476 -2.496 7 1HG MET 801 1HG MET 801 35.399 -6.865 -2.812 8 2HG MET 801 2HG MET 801 35.541 -6.256 -4.461 9 1HE MET 801 2HE MET 801 36.990 -6.462 -5.910 10 2HE MET 801 1HE MET 801 38.605 -7.164 -5.868 11 3HE MET 801 3HE MET 801 37.221 -8.182 -6.257 12 HA SER 802 HA SER 802 38.370 -3.818 1.062 13 1HB SER 802 1HB SER 802 39.916 -2.175 -0.968 14 2HB SER 802 2HB SER 802 40.480 -2.549 0.658 15 HG SER 802 HG SER 802 40.762 -4.605 0.104 16 HA ASP 803 HA ASP 803 36.740 0.368 1.670 17 1HB ASP 803 1HB ASP 803 34.183 -1.104 0.970 18 2HB ASP 803 2HB ASP 803 34.262 0.624 1.316 19 HA ASN 804 HA ASN 804 35.431 -1.165 5.777 20 1HB ASN 804 1HB ASN 804 38.145 0.039 5.814 21 2HB ASN 804 2HB ASN 804 37.288 0.045 7.355 22 2HD2 ASN 804 1HD2 ASN 804 37.264 -1.904 8.516 23 1HD2 ASN 804 2HD2 ASN 804 37.754 -3.402 7.886 24 HA GLU 805 HA GLU 805 33.707 2.811 6.898 25 1HB GLU 805 1HB GLU 805 31.950 0.566 6.788 26 2HB GLU 805 2HB GLU 805 31.506 1.507 8.212 27 1HG GLU 805 1HG GLU 805 31.571 3.569 6.711 28 2HG GLU 805 2HG GLU 805 31.669 2.457 5.345 29 HA ASP 806 HA ASP 806 34.489 2.687 11.315 30 1HB ASP 806 1HB ASP 806 36.428 3.829 10.016 31 2HB ASP 806 2HB ASP 806 35.662 5.345 10.491 32 HA ASN 807 HA ASN 807 30.888 5.345 12.080 33 1HB ASN 807 1HB ASN 807 29.755 4.394 14.064 34 2HB ASN 807 2HB ASN 807 31.162 3.380 14.387 35 2HD2 ASN 807 1HD2 ASN 807 29.432 4.135 11.306 36 1HD2 ASN 807 2HD2 ASN 807 29.133 2.512 10.906 37 HA PHE 808 HA PHE 808 33.113 7.079 15.881 38 1HB PHE 808 1HB PHE 808 31.783 8.521 14.170 39 2HB PHE 808 2HB PHE 808 30.663 8.801 15.503 40 HD1 PHE 808 HD1 PHE 808 34.401 8.593 15.163 41 HD2 PHE 808 HD2 PHE 808 31.018 10.837 16.567 42 HE1 PHE 808 HE1 PHE 808 35.927 10.317 16.084 43 HE2 PHE 808 HE2 PHE 808 32.544 12.561 17.489 44 HZ PHE 808 HZ PHE 808 34.998 12.301 17.247 45 HA ASP 809 HA ASP 809 30.028 6.197 19.266 46 1HB ASP 809 1HB ASP 809 30.193 8.862 18.772 47 2HB ASP 809 2HB ASP 809 28.456 8.709 19.040 48 1HA GLY 810 1HA GLY 810 25.758 5.258 18.321 49 2HA GLY 810 2HA GLY 810 26.473 3.689 17.945 50 HA ASP 811 HA ASP 811 24.714 3.126 22.089 51 1HB ASP 811 1HB ASP 811 22.898 1.582 20.207 52 2HB ASP 811 2HB ASP 811 22.611 1.797 21.934 53 HA ASP 812 HA ASP 812 26.325 -1.033 22.460 54 1HB ASP 812 1HB ASP 812 24.355 -0.516 24.615 55 2HB ASP 812 2HB ASP 812 24.960 -2.171 24.529 56 HA PHE 813 HA PHE 813 22.943 -3.747 20.824 57 1HB PHE 813 1HB PHE 813 22.470 -1.272 19.307 58 2HB PHE 813 2HB PHE 813 22.154 -2.731 18.369 59 HD1 PHE 813 HD1 PHE 813 20.996 -4.666 19.977 60 HD2 PHE 813 HD2 PHE 813 20.598 -0.408 20.380 61 HE1 PHE 813 HE1 PHE 813 18.852 -4.981 21.183 62 HE2 PHE 813 HE2 PHE 813 18.454 -0.723 21.586 63 HZ PHE 813 HZ PHE 813 17.581 -3.009 21.987 64 HA ASP 814 HA ASP 814 25.975 -5.152 17.818 65 1HB ASP 814 1HB ASP 814 27.422 -2.577 18.422 66 2HB ASP 814 2HB ASP 814 28.136 -3.764 17.328 67 HA ASP 815 HA ASP 815 28.677 -7.306 20.616 68 1HB ASP 815 1HB ASP 815 29.210 -4.931 21.354 69 2HB ASP 815 2HB ASP 815 28.228 -5.241 22.786 70 HA VAL 816 HA VAL 816 25.986 -8.736 24.135 71 HB VAL 816 HB VAL 816 24.365 -6.184 24.442 72 1HG1 VAL 816 1HG1 VAL 816 24.511 -8.766 25.930 73 2HG1 VAL 816 2HG1 VAL 816 24.378 -7.290 26.886 74 3HG1 VAL 816 3HG1 VAL 816 23.141 -7.681 25.692 75 1HG2 VAL 816 1HG2 VAL 816 26.890 -7.152 25.824 76 2HG2 VAL 816 2HG2 VAL 816 26.752 -5.755 24.755 77 3HG2 VAL 816 3HG2 VAL 816 25.950 -5.746 26.327 78 HA GLU 817 HA GLU 817 22.225 -8.851 21.279 79 1HB GLU 817 1HB GLU 817 23.680 -8.096 19.386 80 2HB GLU 817 2HB GLU 817 22.601 -9.413 18.930 81 1HG GLU 817 1HG GLU 817 25.318 -10.117 19.972 82 2HG GLU 817 2HG GLU 817 24.326 -10.952 18.777 83 HA GLU 818 HA GLU 818 23.630 -13.551 21.052 84 1HB GLU 818 1HB GLU 818 26.053 -12.733 21.949 85 2HB GLU 818 2HB GLU 818 25.408 -13.431 23.434 86 1HG GLU 818 1HG GLU 818 25.455 -14.862 20.761 87 2HG GLU 818 2HG GLU 818 26.661 -15.087 22.029 88 HA ASP 819 HA ASP 819 20.554 -15.487 23.742 89 1HB ASP 819 1HB ASP 819 22.857 -15.345 25.003 90 2HB ASP 819 2HB ASP 819 22.148 -13.914 25.753 91 HA GLU 820 HA GLU 820 17.014 -12.998 25.186 92 1HB GLU 820 1HB GLU 820 18.980 -12.430 26.788 93 2HB GLU 820 2HB GLU 820 19.313 -11.103 25.674 94 1HG GLU 820 1HG GLU 820 16.658 -10.753 25.976 95 2HG GLU 820 2HG GLU 820 17.027 -11.481 27.540 96 1HA GLY 821 1HA GLY 821 16.112 -11.105 21.287 97 2HA GLY 821 2HA GLY 821 17.823 -10.677 21.322 98 HA LEU 822 HA LEU 822 17.555 -14.463 18.529 99 1HB LEU 822 1HB LEU 822 14.633 -14.730 19.163 100 2HB LEU 822 2HB LEU 822 15.278 -15.572 17.753 101 HG LEU 822 HG LEU 822 17.165 -16.278 19.507 102 1HD1 LEU 822 1HD1 LEU 822 15.044 -15.104 21.120 103 2HD1 LEU 822 2HD1 LEU 822 15.318 -16.792 21.551 104 3HD1 LEU 822 3HD1 LEU 822 16.651 -15.639 21.610 105 1HD2 LEU 822 1HD2 LEU 822 14.607 -17.430 18.624 106 2HD2 LEU 822 2HD2 LEU 822 16.209 -18.165 18.682 107 3HD2 LEU 822 3HD2 LEU 822 15.203 -18.129 20.130 108 HA ASP 823 HA ASP 823 15.545 -11.972 15.186 109 1HB ASP 823 1HB ASP 823 13.366 -11.298 17.086 110 2HB ASP 823 2HB ASP 823 13.492 -10.255 15.668 111 HA ASP 824 HA ASP 824 16.918 -7.747 16.758 112 1HB ASP 824 1HB ASP 824 17.504 -9.201 19.244 113 2HB ASP 824 2HB ASP 824 18.666 -7.920 18.899 114 HA LEU 825 HA LEU 825 20.918 -8.754 14.995 115 1HB LEU 825 1HB LEU 825 21.956 -11.020 15.036 116 2HB LEU 825 2HB LEU 825 21.167 -10.629 16.564 117 HG LEU 825 HG LEU 825 19.282 -11.864 14.735 118 1HD1 LEU 825 1HD1 LEU 825 21.911 -13.260 15.237 119 2HD1 LEU 825 2HD1 LEU 825 20.425 -14.168 14.959 120 3HD1 LEU 825 3HD1 LEU 825 21.039 -13.080 13.715 121 1HD2 LEU 825 1HD2 LEU 825 20.395 -12.395 17.489 122 2HD2 LEU 825 2HD2 LEU 825 18.771 -11.872 17.041 123 3HD2 LEU 825 3HD2 LEU 825 19.280 -13.532 16.731 124 HA GLU 826 HA GLU 826 19.557 -9.428 10.790 125 1HB GLU 826 1HB GLU 826 18.186 -11.434 10.233 126 2HB GLU 826 2HB GLU 826 19.299 -11.749 11.565 127 1HG GLU 826 1HG GLU 826 17.548 -11.535 13.194 128 2HG GLU 826 2HG GLU 826 16.425 -10.899 11.991 129 HA ASN 827 HA ASN 827 15.308 -7.378 11.038 130 1HB ASN 827 1HB ASN 827 16.217 -6.078 12.990 131 2HB ASN 827 2HB ASN 827 17.060 -5.035 11.844 132 2HD2 ASN 827 1HD2 ASN 827 15.906 -3.155 11.429 133 1HD2 ASN 827 2HD2 ASN 827 14.213 -3.031 11.397 134 HA ALA 828 HA ALA 828 17.009 -5.926 7.052 135 1HB ALA 828 2HB ALA 828 15.200 -8.232 6.268 136 2HB ALA 828 3HB ALA 828 16.508 -7.524 5.318 137 3HB ALA 828 1HB ALA 828 16.876 -8.460 6.767 138 HA GLU 829 HA GLU 829 13.091 -4.111 5.797 139 1HB GLU 829 1HB GLU 829 12.822 -3.754 3.352 140 2HB GLU 829 2HB GLU 829 14.520 -3.729 3.827 141 1HG GLU 829 1HG GLU 829 14.998 -5.533 2.555 142 2HG GLU 829 2HG GLU 829 13.617 -6.430 3.187 143 HA GLU 830 HA GLU 830 10.773 -8.409 6.633 144 1HB GLU 830 1HB GLU 830 9.832 -5.819 6.287 145 2HB GLU 830 2HB GLU 830 8.996 -6.717 5.021 146 1HG GLU 830 1HG GLU 830 8.674 -8.464 7.033 147 2HG GLU 830 2HG GLU 830 7.541 -7.140 6.751 148 HA GLU 831 HA GLU 831 12.567 -8.856 1.781 149 1HB GLU 831 1HB GLU 831 11.638 -10.729 3.795 150 2HB GLU 831 2HB GLU 831 10.979 -11.146 2.214 151 1HG GLU 831 1HG GLU 831 13.240 -11.087 1.243 152 2HG GLU 831 2HG GLU 831 13.910 -10.648 2.815 153 1HA GLY 832 1HA GLY 832 8.075 -9.076 0.446 154 2HA GLY 832 2HA GLY 832 9.065 -8.627 -0.945 155 HA GLN 833 HA GLN 833 7.580 -12.541 -2.429 156 1HB GLN 833 1HB GLN 833 6.038 -14.019 -1.149 157 2HB GLN 833 2HB GLN 833 7.231 -13.264 -0.092 158 1HG GLN 833 1HG GLN 833 5.589 -11.493 0.472 159 2HG GLN 833 2HG GLN 833 4.391 -12.303 -0.539 160 2HE2 GLN 833 1HE2 GLN 833 3.052 -12.633 1.442 161 1HE2 GLN 833 2HE2 GLN 833 3.453 -13.865 2.538 162 HA GLU 834 HA GLU 834 4.254 -11.195 -4.994 163 1HB GLU 834 1HB GLU 834 3.283 -10.699 -2.639 164 2HB GLU 834 2HB GLU 834 3.534 -8.999 -3.036 165 1HG GLU 834 1HG GLU 834 2.277 -10.099 -5.298 166 2HG GLU 834 2HG GLU 834 1.548 -9.033 -4.099 167 HA ASN 835 HA ASN 835 6.466 -7.744 -6.890 168 1HB ASN 835 1HB ASN 835 6.418 -7.915 -9.233 169 2HB ASN 835 2HB ASN 835 4.802 -8.593 -9.252 170 2HD2 ASN 835 1HD2 ASN 835 8.101 -9.460 -8.050 171 1HD2 ASN 835 2HD2 ASN 835 7.976 -11.103 -8.455 172 HA VAL 836 HA VAL 836 2.741 -5.411 -7.206 173 HB VAL 836 HB VAL 836 2.354 -4.571 -5.132 174 1HG1 VAL 836 1HG1 VAL 836 5.087 -5.766 -4.669 175 2HG1 VAL 836 2HG1 VAL 836 3.917 -5.395 -3.404 176 3HG1 VAL 836 3HG1 VAL 836 3.548 -6.624 -4.614 177 1HG2 VAL 836 1HG2 VAL 836 5.056 -3.242 -5.384 178 2HG2 VAL 836 2HG2 VAL 836 3.471 -2.478 -5.467 179 3HG2 VAL 836 3HG2 VAL 836 4.062 -3.120 -3.935 180 HA GLU 837 HA GLU 837 4.398 -1.839 -9.220 181 1HB GLU 837 1HB GLU 837 2.540 -3.381 -10.697 182 2HB GLU 837 2HB GLU 837 2.030 -1.707 -10.866 183 1HG GLU 837 1HG GLU 837 4.693 -1.398 -11.204 184 2HG GLU 837 2HG GLU 837 4.508 -3.039 -11.828 185 HA ILE 838 HA ILE 838 1.106 0.898 -7.828 186 HB ILE 838 HB ILE 838 3.652 2.470 -8.395 187 1HG1 ILE 838 1HG1 ILE 838 3.984 0.298 -7.185 188 2HG1 ILE 838 2HG1 ILE 838 4.433 1.698 -6.231 189 1HG2 ILE 838 1HG2 ILE 838 1.210 3.298 -7.176 190 2HG2 ILE 838 2HG2 ILE 838 2.446 3.209 -5.923 191 3HG2 ILE 838 3HG2 ILE 838 2.711 4.205 -7.351 192 1HD1 ILE 838 1HD1 ILE 838 1.738 1.348 -5.647 193 2HD1 ILE 838 2HD1 ILE 838 2.376 -0.293 -5.714 194 3HD1 ILE 838 3HD1 ILE 838 3.089 0.886 -4.621 195 HA LEU 839 HA LEU 839 0.041 4.274 -10.692 196 1HB LEU 839 1HB LEU 839 -0.857 1.599 -11.147 197 2HB LEU 839 2HB LEU 839 -2.223 2.673 -11.451 198 HG LEU 839 HG LEU 839 -0.142 4.026 -12.656 199 1HD1 LEU 839 1HD1 LEU 839 0.473 1.130 -12.553 200 2HD1 LEU 839 2HD1 LEU 839 0.594 1.869 -14.149 201 3HD1 LEU 839 3HD1 LEU 839 1.550 2.502 -12.811 202 1HD2 LEU 839 1HD2 LEU 839 -2.411 3.639 -13.564 203 2HD2 LEU 839 2HD2 LEU 839 -1.176 3.258 -14.763 204 3HD2 LEU 839 3HD2 LEU 839 -1.991 1.958 -13.894 205 HA PRO 840 HA PRO 840 -3.169 6.515 -8.659 206 1HB PRO 840 1HB PRO 840 -3.443 8.213 -10.136 207 2HB PRO 840 2HB PRO 840 -4.568 7.221 -11.069 208 1HG PRO 840 1HG PRO 840 -1.900 8.002 -11.778 209 2HG PRO 840 2HG PRO 840 -3.007 6.981 -12.698 210 1HD PRO 840 1HD PRO 840 -1.701 5.171 -12.236 211 2HD PRO 840 2HD PRO 840 -0.623 6.188 -11.247 212 HA SER 841 HA SER 841 -6.450 3.629 -7.776 213 1HB SER 841 1HB SER 841 -8.305 4.797 -7.070 214 2HB SER 841 2HB SER 841 -7.173 6.141 -7.150 215 HG SER 841 HG SER 841 -9.216 5.390 -8.933 216 1HA GLY 842 1HA GLY 842 -7.884 2.954 -11.908 217 2HA GLY 842 2HA GLY 842 -7.541 1.329 -11.326 218 HA GLU 843 HA GLU 843 -11.513 -0.563 -10.108 219 1HB GLU 843 1HB GLU 843 -11.604 1.404 -8.591 220 2HB GLU 843 2HB GLU 843 -11.941 2.446 -9.973 221 1HG GLU 843 1HG GLU 843 -13.767 0.191 -9.928 222 2HG GLU 843 2HG GLU 843 -13.825 1.068 -8.399 223 HA ARG 844 HA ARG 844 -12.318 0.734 -14.463 224 1HB ARG 844 1HB ARG 844 -10.228 -1.436 -14.770 225 2HB ARG 844 2HB ARG 844 -10.929 -0.518 -16.103 226 1HG ARG 844 1HG ARG 844 -9.922 1.196 -13.945 227 2HG ARG 844 2HG ARG 844 -8.663 0.201 -14.677 228 1HD ARG 844 1HD ARG 844 -8.987 1.140 -16.816 229 2HD ARG 844 2HD ARG 844 -10.609 1.733 -16.409 230 HE ARG 844 HE ARG 844 -9.319 3.200 -14.673 231 1HH1 ARG 844 1HH1 ARG 844 -7.025 1.830 -16.580 232 2HH1 ARG 844 2HH1 ARG 844 -6.424 3.298 -17.277 233 1HH2 ARG 844 1HH2 ARG 844 -9.019 5.249 -16.062 234 2HH2 ARG 844 2HH2 ARG 844 -7.553 5.233 -16.983 235 HA PRO 845 HA PRO 845 -15.366 -2.616 -14.197 236 1HB PRO 845 1HB PRO 845 -16.931 -1.167 -16.130 237 2HB PRO 845 2HB PRO 845 -17.221 -1.315 -14.395 238 1HG PRO 845 1HG PRO 845 -16.372 1.008 -15.817 239 2HG PRO 845 2HG PRO 845 -16.578 0.830 -14.073 240 1HD PRO 845 1HD PRO 845 -14.318 0.970 -13.821 241 2HD PRO 845 2HD PRO 845 -14.100 1.011 -15.587 242 HA GLN 846 HA GLN 846 -14.324 -4.739 -17.930 243 1HB GLN 846 1HB GLN 846 -12.803 -3.521 -19.543 244 2HB GLN 846 2HB GLN 846 -14.117 -2.535 -18.909 245 1HG GLN 846 1HG GLN 846 -12.627 -1.058 -18.101 246 2HG GLN 846 2HG GLN 846 -11.912 -2.319 -17.100 247 2HE2 GLN 846 1HE2 GLN 846 -10.314 -3.819 -18.365 248 1HE2 GLN 846 2HE2 GLN 846 -9.321 -3.066 -19.517 249 HA ALA 847 HA ALA 847 -9.936 -6.000 -16.993 250 1HB ALA 847 1HB ALA 847 -9.562 -3.504 -15.414 251 2HB ALA 847 2HB ALA 847 -8.490 -4.844 -15.010 252 3HB ALA 847 3HB ALA 847 -8.527 -4.210 -16.655 253 HA ASN 848 HA ASN 848 -12.092 -7.140 -12.772 254 1HB ASN 848 1HB ASN 848 -14.025 -7.460 -14.616 255 2HB ASN 848 2HB ASN 848 -13.458 -9.128 -14.536 256 2HD2 ASN 848 1HD2 ASN 848 -16.063 -8.355 -13.576 257 1HD2 ASN 848 2HD2 ASN 848 -16.088 -8.574 -11.893 258 HA GLN 849 HA GLN 849 -9.159 -10.487 -13.646 259 1HB GLN 849 1HB GLN 849 -7.853 -8.074 -13.219 260 2HB GLN 849 2HB GLN 849 -7.235 -9.089 -11.918 261 1HG GLN 849 1HG GLN 849 -6.494 -10.770 -13.484 262 2HG GLN 849 2HG GLN 849 -7.300 -9.948 -14.821 263 2HE2 GLN 849 1HE2 GLN 849 -5.540 -8.157 -12.311 264 1HE2 GLN 849 2HE2 GLN 849 -4.280 -7.639 -13.309 265 HA LYS 850 HA LYS 850 -8.081 -11.463 -9.019 266 1HB LYS 850 1HB LYS 850 -10.012 -12.837 -10.762 267 2HB LYS 850 2HB LYS 850 -9.382 -13.867 -9.477 268 1HG LYS 850 1HG LYS 850 -10.087 -11.150 -8.584 269 2HG LYS 850 2HG LYS 850 -11.461 -12.089 -9.171 270 1HD LYS 850 1HD LYS 850 -10.652 -13.988 -7.685 271 2HD LYS 850 2HD LYS 850 -9.524 -12.838 -6.967 272 1HE LYS 850 1HE LYS 850 -11.893 -11.429 -6.872 273 2HE LYS 850 2HE LYS 850 -11.256 -12.401 -5.530 274 1HZ LYS 850 1HZ LYS 850 -12.393 -14.333 -6.483 275 2HZ LYS 850 2HZ LYS 850 -13.499 -13.104 -6.108 276 3HZ LYS 850 3HZ LYS 850 -13.033 -13.362 -7.721 277 HA ARG 851 HA ARG 851 -5.865 -15.505 -9.340 278 1HB ARG 851 1HB ARG 851 -4.610 -12.917 -9.593 279 2HB ARG 851 2HB ARG 851 -3.528 -14.016 -8.735 280 1HG ARG 851 1HG ARG 851 -4.946 -14.886 -11.252 281 2HG ARG 851 2HG ARG 851 -3.422 -14.004 -11.327 282 1HD ARG 851 1HD ARG 851 -2.712 -15.861 -9.516 283 2HD ARG 851 2HD ARG 851 -2.609 -16.180 -11.259 284 HE ARG 851 HE ARG 851 -5.217 -16.840 -10.663 285 1HH1 ARG 851 1HH1 ARG 851 -2.277 -18.352 -10.599 286 2HH1 ARG 851 2HH1 ARG 851 -2.717 -19.599 -9.481 287 1HH2 ARG 851 1HH2 ARG 851 -5.754 -18.147 -8.646 288 2HH2 ARG 851 2HH2 ARG 851 -4.685 -19.483 -8.374 289 HA ILE 852 HA ILE 852 -5.039 -15.291 -4.779 290 HB ILE 852 HB ILE 852 -2.876 -15.977 -4.429 291 1HG1 ILE 852 1HG1 ILE 852 -2.068 -13.722 -3.806 292 2HG1 ILE 852 2HG1 ILE 852 -0.880 -14.584 -4.773 293 1HG2 ILE 852 1HG2 ILE 852 -3.324 -16.503 -6.795 294 2HG2 ILE 852 2HG2 ILE 852 -2.605 -14.965 -7.272 295 3HG2 ILE 852 3HG2 ILE 852 -1.608 -16.207 -6.515 296 1HD1 ILE 852 1HD1 ILE 852 -2.530 -13.223 -6.624 297 2HD1 ILE 852 2HD1 ILE 852 -2.187 -12.070 -5.336 298 3HD1 ILE 852 3HD1 ILE 852 -0.865 -12.836 -6.200 299 HA THR 853 HA THR 853 -3.347 -10.865 -3.383 300 HB THR 853 HB THR 853 -4.466 -8.878 -4.439 301 HG1 THR 853 HG1 THR 853 -5.250 -10.778 -6.387 302 1HG2 THR 853 1HG2 THR 853 -2.231 -9.805 -5.119 303 2HG2 THR 853 2HG2 THR 853 -3.055 -10.693 -6.393 304 3HG2 THR 853 3HG2 THR 853 -3.079 -8.936 -6.396 305 HA THR 854 HA THR 854 -6.907 -11.957 -0.930 306 HB THR 854 HB THR 854 -5.010 -12.157 0.633 307 HG1 THR 854 HG1 THR 854 -6.974 -12.056 1.633 308 1HG2 THR 854 1HG2 THR 854 -4.446 -9.549 -0.165 309 2HG2 THR 854 2HG2 THR 854 -4.985 -9.370 1.505 310 3HG2 THR 854 3HG2 THR 854 -3.634 -10.436 1.125 311 HA PRO 855 HA PRO 855 -9.000 -8.159 -2.049 312 1HB PRO 855 1HB PRO 855 -11.132 -8.958 -1.904 313 2HB PRO 855 2HB PRO 855 -11.078 -8.791 -0.147 314 1HG PRO 855 1HG PRO 855 -11.091 -11.212 -1.647 315 2HG PRO 855 2HG PRO 855 -10.873 -11.044 0.097 316 1HD PRO 855 1HD PRO 855 -8.723 -11.793 -0.187 317 2HD PRO 855 2HD PRO 855 -8.861 -11.675 -1.960 318 HA TYR 856 HA TYR 856 -7.710 -5.406 1.168 319 1HB TYR 856 1HB TYR 856 -8.277 -7.309 2.573 320 2HB TYR 856 2HB TYR 856 -6.757 -8.092 2.190 321 HD1 TYR 856 HD1 TYR 856 -4.575 -6.716 2.856 322 HD2 TYR 856 HD2 TYR 856 -8.478 -6.060 4.520 323 HE1 TYR 856 HE1 TYR 856 -3.551 -5.646 4.825 324 HE2 TYR 856 HE2 TYR 856 -7.449 -5.002 6.502 325 HH TYR 856 HH TYR 856 -5.542 -4.216 7.400 326 HA MET 857 HA MET 857 -3.707 -5.105 -0.947 327 1HB MET 857 1HB MET 857 -4.686 -2.827 -1.166 328 2HB MET 857 2HB MET 857 -4.251 -2.498 0.505 329 1HG MET 857 1HG MET 857 -1.890 -3.441 -0.746 330 2HG MET 857 2HG MET 857 -2.225 -1.806 -0.190 331 1HE MET 857 1HE MET 857 -4.486 -0.798 -1.739 332 2HE MET 857 2HE MET 857 -3.000 0.132 -1.606 333 3HE MET 857 3HE MET 857 -3.782 -0.049 -3.175 334 HA THR 858 HA THR 858 -1.427 -5.318 2.911 335 HB THR 858 HB THR 858 0.373 -6.999 2.432 336 HG1 THR 858 HG1 THR 858 1.093 -6.560 0.447 337 1HG2 THR 858 1HG2 THR 858 -2.341 -7.373 1.135 338 2HG2 THR 858 2HG2 THR 858 -1.258 -8.683 1.613 339 3HG2 THR 858 3HG2 THR 858 -1.962 -7.629 2.838 340 HA LYS 859 HA LYS 859 1.009 -1.768 3.580 341 1HB LYS 859 1HB LYS 859 1.320 -3.102 5.606 342 2HB LYS 859 2HB LYS 859 2.859 -2.399 5.109 343 1HG LYS 859 1HG LYS 859 2.171 -5.097 4.032 344 2HG LYS 859 2HG LYS 859 3.741 -4.438 4.490 345 1HD LYS 859 1HD LYS 859 1.571 -5.136 6.486 346 2HD LYS 859 2HD LYS 859 2.880 -6.233 6.044 347 1HE LYS 859 1HE LYS 859 4.535 -4.848 7.007 348 2HE LYS 859 2HE LYS 859 3.471 -3.427 7.003 349 1HZ LYS 859 1HZ LYS 859 1.968 -4.719 8.503 350 2HZ LYS 859 2HZ LYS 859 3.200 -5.879 8.655 351 3HZ LYS 859 3HZ LYS 859 3.454 -4.290 9.201 352 HA TYR 860 HA TYR 860 4.985 -3.150 1.262 353 1HB TYR 860 1HB TYR 860 5.014 -5.542 1.263 354 2HB TYR 860 2HB TYR 860 3.662 -5.635 0.146 355 HD1 TYR 860 HD1 TYR 860 6.241 -3.036 -0.202 356 HD2 TYR 860 HD2 TYR 860 4.982 -6.918 -1.563 357 HE1 TYR 860 HE1 TYR 860 7.781 -2.846 -2.120 358 HE2 TYR 860 HE2 TYR 860 6.534 -6.717 -3.486 359 HH TYR 860 HH TYR 860 8.803 -5.351 -3.892 360 HA GLU 861 HA GLU 861 2.453 -2.770 -2.936 361 1HB GLU 861 1HB GLU 861 -0.033 -2.863 -1.185 362 2HB GLU 861 2HB GLU 861 -0.046 -2.371 -2.878 363 1HG GLU 861 1HG GLU 861 0.799 -4.558 -3.560 364 2HG GLU 861 2HG GLU 861 0.931 -5.058 -1.872 365 HA ARG 862 HA ARG 862 1.299 1.319 -0.738 366 1HB ARG 862 1HB ARG 862 0.700 -0.305 1.590 367 2HB ARG 862 2HB ARG 862 1.547 1.177 2.050 368 1HG ARG 862 1HG ARG 862 -0.790 1.168 0.134 369 2HG ARG 862 2HG ARG 862 -0.993 1.389 1.864 370 1HD ARG 862 1HD ARG 862 0.326 3.399 1.861 371 2HD ARG 862 2HD ARG 862 0.859 3.105 0.198 372 HE ARG 862 HE ARG 862 -1.611 4.347 0.919 373 1HH1 ARG 862 1HH1 ARG 862 -2.673 1.752 -0.107 374 2HH1 ARG 862 2HH1 ARG 862 -2.820 2.062 -1.804 375 1HH2 ARG 862 1HH2 ARG 862 -0.798 4.870 -1.746 376 2HH2 ARG 862 2HH2 ARG 862 -1.763 3.821 -2.730 377 HA ALA 863 HA ALA 863 5.567 1.287 1.417 378 1HB ALA 863 2HB ALA 863 6.601 -1.431 0.959 379 2HB ALA 863 3HB ALA 863 6.652 -0.449 2.424 380 3HB ALA 863 1HB ALA 863 5.207 -1.382 2.037 381 HA ARG 864 HA ARG 864 7.213 0.162 -2.868 382 1HB ARG 864 1HB ARG 864 4.957 -1.580 -3.131 383 2HB ARG 864 2HB ARG 864 4.943 -0.516 -4.538 384 1HG ARG 864 1HG ARG 864 7.637 -1.459 -3.911 385 2HG ARG 864 2HG ARG 864 6.525 -2.792 -4.223 386 1HD ARG 864 1HD ARG 864 5.778 -1.311 -6.281 387 2HD ARG 864 2HD ARG 864 7.380 -0.577 -6.066 388 HE ARG 864 HE ARG 864 7.261 -3.537 -6.077 389 1HH1 ARG 864 1HH1 ARG 864 7.002 -1.181 -8.417 390 2HH1 ARG 864 2HH1 ARG 864 8.427 -1.626 -9.293 391 1HH2 ARG 864 1HH2 ARG 864 9.528 -3.863 -6.883 392 2HH2 ARG 864 2HH2 ARG 864 9.857 -3.146 -8.425 393 HA VAL 865 HA VAL 865 3.439 3.143 -4.317 394 HB VAL 865 HB VAL 865 2.602 1.958 -1.744 395 1HG1 VAL 865 1HG1 VAL 865 2.212 4.835 -2.294 396 2HG1 VAL 865 2HG1 VAL 865 0.875 3.925 -1.595 397 3HG1 VAL 865 3HG1 VAL 865 2.422 3.992 -0.759 398 1HG2 VAL 865 1HG2 VAL 865 1.376 2.738 -4.312 399 2HG2 VAL 865 2HG2 VAL 865 1.421 1.170 -3.513 400 3HG2 VAL 865 3HG2 VAL 865 0.352 2.433 -2.908 401 HA LEU 866 HA LEU 866 4.924 5.902 -0.441 402 1HB LEU 866 1HB LEU 866 5.057 4.560 1.452 403 2HB LEU 866 2HB LEU 866 5.756 3.212 0.564 404 HG LEU 866 HG LEU 866 7.491 5.609 0.787 405 1HD1 LEU 866 1HD1 LEU 866 6.818 3.887 3.191 406 2HD1 LEU 866 2HD1 LEU 866 8.143 5.048 3.113 407 3HD1 LEU 866 3HD1 LEU 866 6.474 5.608 3.020 408 1HD2 LEU 866 1HD2 LEU 866 7.733 2.610 0.956 409 2HD2 LEU 866 2HD2 LEU 866 8.511 3.718 -0.174 410 3HD2 LEU 866 3HD2 LEU 866 9.056 3.641 1.501 411 1HA GLY 867 1HA GLY 867 9.179 4.930 -2.339 412 2HA GLY 867 2HA GLY 867 8.775 3.469 -3.244 413 HA THR 868 HA THR 868 7.218 5.914 -6.576 414 HB THR 868 HB THR 868 5.176 5.250 -7.566 415 HG1 THR 868 HG1 THR 868 4.378 5.036 -4.892 416 1HG2 THR 868 1HG2 THR 868 6.968 3.535 -6.793 417 2HG2 THR 868 2HG2 THR 868 5.685 2.984 -5.720 418 3HG2 THR 868 3HG2 THR 868 5.435 2.974 -7.465 419 HA ARG 869 HA ARG 869 4.171 8.798 -4.386 420 1HB ARG 869 1HB ARG 869 4.283 6.908 -2.174 421 2HB ARG 869 2HB ARG 869 4.591 8.535 -1.569 422 1HG ARG 869 1HG ARG 869 2.536 9.326 -2.736 423 2HG ARG 869 2HG ARG 869 2.189 8.094 -1.521 424 1HD ARG 869 1HD ARG 869 2.213 7.820 -4.531 425 2HD ARG 869 2HD ARG 869 2.389 6.399 -3.485 426 HE ARG 869 HE ARG 869 0.145 6.695 -2.766 427 1HH1 ARG 869 1HH1 ARG 869 0.609 8.513 -5.477 428 2HH1 ARG 869 2HH1 ARG 869 -0.596 9.708 -5.132 429 1HH2 ARG 869 1HH2 ARG 869 -1.108 8.637 -1.874 430 2HH2 ARG 869 2HH2 ARG 869 -1.568 9.779 -3.093 431 HA ALA 870 HA ALA 870 8.218 10.012 -1.882 432 1HB ALA 870 3HB ALA 870 8.926 7.981 -0.891 433 2HB ALA 870 2HB ALA 870 10.243 8.390 -1.992 434 3HB ALA 870 1HB ALA 870 9.053 7.174 -2.454 435 HA LEU 871 HA LEU 871 10.312 10.122 -5.994 436 1HB LEU 871 1HB LEU 871 9.413 8.562 -8.173 437 2HB LEU 871 2HB LEU 871 10.947 8.415 -7.331 438 HG LEU 871 HG LEU 871 8.573 7.086 -6.123 439 1HD1 LEU 871 1HD1 LEU 871 10.070 6.080 -8.549 440 2HD1 LEU 871 2HD1 LEU 871 8.966 5.110 -7.574 441 3HD1 LEU 871 3HD1 LEU 871 8.358 6.498 -8.477 442 1HD2 LEU 871 1HD2 LEU 871 11.527 6.465 -6.440 443 2HD2 LEU 871 2HD2 LEU 871 10.715 6.995 -4.966 444 3HD2 LEU 871 3HD2 LEU 871 10.381 5.395 -5.632 445 HA GLN 872 HA GLN 872 6.092 10.849 -8.428 446 1HB GLN 872 1HB GLN 872 5.105 9.902 -5.801 447 2HB GLN 872 2HB GLN 872 4.247 11.302 -6.432 448 1HG GLN 872 1HG GLN 872 3.738 10.121 -8.505 449 2HG GLN 872 2HG GLN 872 4.729 8.753 -8.000 450 2HE2 GLN 872 1HE2 GLN 872 3.296 7.082 -7.499 451 1HE2 GLN 872 2HE2 GLN 872 1.911 7.252 -6.533 452 HA ILE 873 HA ILE 873 6.143 14.719 -5.487 453 HB ILE 873 HB ILE 873 7.224 14.530 -3.105 454 1HG1 ILE 873 1HG1 ILE 873 6.225 11.877 -2.709 455 2HG1 ILE 873 2HG1 ILE 873 7.367 11.823 -4.038 456 1HG2 ILE 873 1HG2 ILE 873 4.549 13.702 -4.108 457 2HG2 ILE 873 2HG2 ILE 873 4.889 13.548 -2.387 458 3HG2 ILE 873 3HG2 ILE 873 5.007 15.120 -3.167 459 1HD1 ILE 873 1HD1 ILE 873 8.715 13.410 -2.320 460 2HD1 ILE 873 2HD1 ILE 873 7.838 12.378 -1.190 461 3HD1 ILE 873 3HD1 ILE 873 8.899 11.662 -2.394 462 HA ALA 874 HA ALA 874 10.881 14.186 -4.764 463 1HB ALA 874 1HB ALA 874 10.793 11.596 -6.314 464 2HB ALA 874 3HB ALA 874 11.074 11.753 -4.582 465 3HB ALA 874 2HB ALA 874 12.264 12.365 -5.725 466 HA MET 875 HA MET 875 10.627 15.210 -9.264 467 1HB MET 875 1HB MET 875 8.861 13.175 -9.655 468 2HB MET 875 2HB MET 875 7.786 14.548 -9.928 469 1HG MET 875 1HG MET 875 8.839 15.161 -11.860 470 2HG MET 875 2HG MET 875 10.434 14.724 -11.248 471 1HE MET 875 1HE MET 875 11.686 13.222 -12.349 472 2HE MET 875 2HE MET 875 11.261 12.123 -11.029 473 3HE MET 875 3HE MET 875 11.283 11.542 -12.692 474 HA CYS 876 HA CYS 876 7.530 18.280 -7.586 475 1HB CYS 876 1HB CYS 876 5.738 16.880 -9.551 476 2HB CYS 876 2HB CYS 876 5.079 18.256 -8.667 477 HG CYS 876 HG CYS 876 6.254 19.617 -10.376 478 HA ALA 877 HA ALA 877 4.594 15.325 -5.064 479 1HB ALA 877 3HB ALA 877 4.662 17.393 -4.103 480 2HB ALA 877 1HB ALA 877 3.806 18.157 -5.443 481 3HB ALA 877 2HB ALA 877 2.915 17.200 -4.259 482 HA PRO 878 HA PRO 878 0.781 14.402 -7.752 483 1HB PRO 878 1HB PRO 878 1.761 11.719 -8.030 484 2HB PRO 878 2HB PRO 878 1.550 12.924 -9.304 485 1HG PRO 878 1HG PRO 878 3.997 11.926 -8.270 486 2HG PRO 878 2HG PRO 878 3.786 13.212 -9.450 487 1HD PRO 878 1HD PRO 878 4.568 14.674 -7.911 488 2HD PRO 878 2HD PRO 878 4.581 13.416 -6.660 489 HA VAL 879 HA VAL 879 1.285 11.120 -3.987 490 HB VAL 879 HB VAL 879 2.926 13.486 -3.194 491 1HG1 VAL 879 1HG1 VAL 879 1.366 13.098 -1.235 492 2HG1 VAL 879 2HG1 VAL 879 2.110 11.510 -1.070 493 3HG1 VAL 879 3HG1 VAL 879 3.076 12.966 -0.887 494 1HG2 VAL 879 1HG2 VAL 879 3.443 10.913 -4.079 495 2HG2 VAL 879 2HG2 VAL 879 4.618 11.999 -3.368 496 3HG2 VAL 879 3HG2 VAL 879 3.789 10.826 -2.359 497 HA MET 880 HA MET 880 -2.397 12.991 -2.420 498 1HB MET 880 1HB MET 880 -1.681 10.701 -1.025 499 2HB MET 880 2HB MET 880 -2.151 11.815 0.258 500 1HG MET 880 1HG MET 880 -3.829 11.159 -2.183 501 2HG MET 880 2HG MET 880 -4.083 10.500 -0.568 502 1HE MET 880 2HE MET 880 -5.559 12.078 -2.793 503 2HE MET 880 3HE MET 880 -6.542 13.378 -2.104 504 3HE MET 880 1HE MET 880 -4.998 13.746 -2.868 505 HA VAL 881 HA VAL 881 -1.052 16.442 0.051 506 HB VAL 881 HB VAL 881 0.892 16.294 1.688 507 1HG1 VAL 881 1HG1 VAL 881 -1.508 15.141 1.854 508 2HG1 VAL 881 2HG1 VAL 881 -0.548 13.662 1.788 509 3HG1 VAL 881 3HG1 VAL 881 -0.274 14.838 3.073 510 1HG2 VAL 881 1HG2 VAL 881 2.043 14.676 -0.144 511 2HG2 VAL 881 2HG2 VAL 881 2.452 14.617 1.571 512 3HG2 VAL 881 3HG2 VAL 881 1.307 13.456 0.897 513 HA GLU 882 HA GLU 882 2.394 18.284 -2.206 514 1HB GLU 882 1HB GLU 882 1.451 20.595 -2.702 515 2HB GLU 882 2HB GLU 882 0.341 19.253 -2.972 516 1HG GLU 882 1HG GLU 882 -0.843 19.690 -0.950 517 2HG GLU 882 2HG GLU 882 0.419 20.768 -0.356 518 HA LEU 883 HA LEU 883 4.299 20.174 1.643 519 1HB LEU 883 1HB LEU 883 5.386 17.961 1.701 520 2HB LEU 883 2HB LEU 883 6.340 18.382 0.280 521 HG LEU 883 HG LEU 883 6.977 20.483 1.826 522 1HD1 LEU 883 1HD1 LEU 883 5.454 19.525 3.642 523 2HD1 LEU 883 2HD1 LEU 883 6.650 18.244 3.833 524 3HD1 LEU 883 3HD1 LEU 883 7.098 19.921 4.145 525 1HD2 LEU 883 1HD2 LEU 883 8.327 18.409 0.821 526 2HD2 LEU 883 2HD2 LEU 883 9.053 19.477 2.021 527 3HD2 LEU 883 3HD2 LEU 883 8.371 17.928 2.517 528 HA GLU 884 HA GLU 884 6.421 22.657 -1.658 529 1HB GLU 884 1HB GLU 884 8.321 21.694 0.240 530 2HB GLU 884 2HB GLU 884 9.208 22.201 -1.196 531 1HG GLU 884 1HG GLU 884 7.874 24.355 -1.141 532 2HG GLU 884 2HG GLU 884 7.262 23.851 0.435 533 1HA GLY 885 1HA GLY 885 7.177 19.355 -5.172 534 2HA GLY 885 2HA GLY 885 8.594 20.394 -5.006 535 HA GLU 886 HA GLU 886 9.712 16.322 -2.300 536 1HB GLU 886 1HB GLU 886 10.402 16.050 -4.541 537 2HB GLU 886 2HB GLU 886 11.329 17.547 -4.535 538 1HG GLU 886 1HG GLU 886 12.977 16.520 -3.012 539 2HG GLU 886 2HG GLU 886 12.040 15.026 -3.001 540 HA THR 887 HA THR 887 13.355 17.629 0.002 541 HB THR 887 HB THR 887 10.770 17.958 1.574 542 HG1 THR 887 HG1 THR 887 12.458 19.787 0.215 543 1HG2 THR 887 1HG2 THR 887 13.614 18.481 2.311 544 2HG2 THR 887 2HG2 THR 887 12.416 19.683 2.789 545 3HG2 THR 887 3HG2 THR 887 12.257 18.014 3.334 546 HA ASP 888 HA ASP 888 12.640 14.202 3.082 547 1HB ASP 888 1HB ASP 888 10.221 15.170 3.486 548 2HB ASP 888 2HB ASP 888 9.743 13.640 2.755 549 HA PRO 889 HA PRO 889 12.924 10.856 0.169 550 1HB PRO 889 1HB PRO 889 13.244 8.905 2.256 551 2HB PRO 889 2HB PRO 889 14.502 9.653 1.269 552 1HG PRO 889 1HG PRO 889 14.038 10.067 4.038 553 2HG PRO 889 2HG PRO 889 15.177 10.939 3.008 554 1HD PRO 889 1HD PRO 889 13.898 12.804 3.298 555 2HD PRO 889 2HD PRO 889 12.618 11.860 4.100 556 HA LEU 890 HA LEU 890 8.562 9.589 1.077 557 1HB LEU 890 1HB LEU 890 10.102 7.753 1.833 558 2HB LEU 890 2HB LEU 890 8.445 7.538 2.369 559 HG LEU 890 HG LEU 890 10.228 7.061 4.113 560 1HD1 LEU 890 1HD1 LEU 890 11.642 9.065 3.459 561 2HD1 LEU 890 2HD1 LEU 890 10.455 10.067 4.295 562 3HD1 LEU 890 3HD1 LEU 890 11.372 8.854 5.187 563 1HD2 LEU 890 1HD2 LEU 890 7.720 8.006 4.409 564 2HD2 LEU 890 2HD2 LEU 890 8.768 7.629 5.774 565 3HD2 LEU 890 3HD2 LEU 890 8.614 9.294 5.218 566 HA LEU 891 HA LEU 891 7.318 11.484 5.526 567 1HB LEU 891 1HB LEU 891 8.325 13.528 5.724 568 2HB LEU 891 2HB LEU 891 8.471 13.692 3.988 569 HG LEU 891 HG LEU 891 7.051 15.444 5.043 570 1HD1 LEU 891 1HD1 LEU 891 6.642 14.232 2.636 571 2HD1 LEU 891 2HD1 LEU 891 5.049 14.074 3.378 572 3HD1 LEU 891 3HD1 LEU 891 5.778 15.663 3.187 573 1HD2 LEU 891 1HD2 LEU 891 5.688 13.067 6.087 574 2HD2 LEU 891 2HD2 LEU 891 5.710 14.714 6.708 575 3HD2 LEU 891 3HD2 LEU 891 4.596 14.276 5.416 576 HA ILE 892 HA ILE 892 4.121 12.846 2.156 577 HB ILE 892 HB ILE 892 6.535 12.575 0.556 578 1HG1 ILE 892 1HG1 ILE 892 4.087 14.037 -0.295 579 2HG1 ILE 892 2HG1 ILE 892 4.957 14.573 1.145 580 1HG2 ILE 892 1HG2 ILE 892 4.020 11.331 -0.449 581 2HG2 ILE 892 2HG2 ILE 892 5.023 12.253 -1.554 582 3HG2 ILE 892 3HG2 ILE 892 5.699 10.865 -0.719 583 1HD1 ILE 892 1HD1 ILE 892 6.552 13.873 -1.246 584 2HD1 ILE 892 2HD1 ILE 892 5.657 15.387 -1.290 585 3HD1 ILE 892 3HD1 ILE 892 6.849 15.100 -0.021 586 HA ALA 893 HA ALA 893 3.999 8.356 0.526 587 1HB ALA 893 3HB ALA 893 5.982 7.504 -0.211 588 2HB ALA 893 1HB ALA 893 6.866 8.099 1.194 589 3HB ALA 893 2HB ALA 893 5.911 6.625 1.314 590 HA MET 894 HA MET 894 3.998 7.189 5.133 591 1HB MET 894 1HB MET 894 6.145 7.929 5.895 592 2HB MET 894 2HB MET 894 5.764 9.616 5.563 593 1HG MET 894 1HG MET 894 3.917 8.408 7.487 594 2HG MET 894 2HG MET 894 5.589 8.374 8.043 595 1HE MET 894 1HE MET 894 7.025 10.322 6.939 596 2HE MET 894 3HE MET 894 6.678 12.019 7.255 597 3HE MET 894 2HE MET 894 7.031 10.923 8.594 598 HA LYS 895 HA LYS 895 1.690 11.337 6.311 599 1HB LYS 895 1HB LYS 895 3.109 13.059 5.486 600 2HB LYS 895 2HB LYS 895 2.991 12.470 3.830 601 1HG LYS 895 1HG LYS 895 1.224 13.786 3.445 602 2HG LYS 895 2HG LYS 895 0.351 13.075 4.801 603 1HD LYS 895 1HD LYS 895 2.198 14.701 6.063 604 2HD LYS 895 2HD LYS 895 1.770 15.642 4.635 605 1HE LYS 895 1HE LYS 895 -0.635 14.501 5.748 606 2HE LYS 895 2HE LYS 895 0.250 15.369 7.018 607 1HZ LYS 895 1HZ LYS 895 0.542 17.220 5.441 608 2HZ LYS 895 2HZ LYS 895 -0.442 16.406 4.320 609 3HZ LYS 895 3HZ LYS 895 -1.094 16.928 5.796 610 HA GLU 896 HA GLU 896 -0.866 10.592 2.270 611 1HB GLU 896 1HB GLU 896 -0.294 8.948 0.468 612 2HB GLU 896 2HB GLU 896 0.803 10.319 0.533 613 1HG GLU 896 1HG GLU 896 1.998 8.530 2.231 614 2HG GLU 896 2HG GLU 896 2.437 8.788 0.548 615 HA LEU 897 HA LEU 897 -1.403 6.157 3.689 616 1HB LEU 897 1HB LEU 897 0.741 5.026 3.467 617 2HB LEU 897 2HB LEU 897 1.371 5.876 4.876 618 HG LEU 897 HG LEU 897 0.398 3.386 5.063 619 1HD1 LEU 897 1HD1 LEU 897 1.191 5.284 6.813 620 2HD1 LEU 897 2HD1 LEU 897 -0.503 5.140 7.280 621 3HD1 LEU 897 3HD1 LEU 897 0.544 3.723 7.318 622 1HD2 LEU 897 1HD2 LEU 897 -1.899 4.575 4.256 623 2HD2 LEU 897 2HD2 LEU 897 -1.892 3.206 5.359 624 3HD2 LEU 897 3HD2 LEU 897 -2.044 4.838 5.992 625 HA LYS 898 HA LYS 898 -0.599 7.544 8.382 626 1HB LYS 898 1HB LYS 898 1.494 8.765 7.950 627 2HB LYS 898 2HB LYS 898 0.591 9.981 7.049 628 1HG LYS 898 1HG LYS 898 -0.417 10.857 8.960 629 2HG LYS 898 2HG LYS 898 -0.163 9.384 9.894 630 1HD LYS 898 1HD LYS 898 2.398 10.369 9.067 631 2HD LYS 898 2HD LYS 898 1.498 11.705 9.785 632 1HE LYS 898 1HE LYS 898 1.188 10.525 11.843 633 2HE LYS 898 2HE LYS 898 1.718 8.991 11.122 634 1HZ LYS 898 1HZ LYS 898 3.871 10.066 10.638 635 2HZ LYS 898 2HZ LYS 898 3.360 11.440 11.497 636 3HZ LYS 898 3HZ LYS 898 3.556 9.956 12.301 637 HA ALA 899 HA ALA 899 -3.614 10.848 6.879 638 1HB ALA 899 2HB ALA 899 -3.894 11.696 4.534 639 2HB ALA 899 3HB ALA 899 -2.230 11.837 5.096 640 3HB ALA 899 1HB ALA 899 -2.681 10.535 3.998 641 HA ARG 900 HA ARG 900 -4.525 6.158 4.488 642 1HB ARG 900 1HB ARG 900 -5.301 7.215 6.986 643 2HB ARG 900 2HB ARG 900 -5.754 5.642 6.340 644 1HG ARG 900 1HG ARG 900 -7.309 8.148 5.678 645 2HG ARG 900 2HG ARG 900 -7.809 6.469 5.477 646 1HD ARG 900 1HD ARG 900 -7.283 6.515 8.160 647 2HD ARG 900 2HD ARG 900 -7.881 8.167 7.899 648 HE ARG 900 HE ARG 900 -9.470 6.114 6.545 649 1HH1 ARG 900 1HH1 ARG 900 -10.553 8.725 7.553 650 2HH1 ARG 900 2HH1 ARG 900 -11.461 8.227 8.941 651 1HH2 ARG 900 1HH2 ARG 900 -9.947 5.114 9.144 652 2HH2 ARG 900 2HH2 ARG 900 -11.119 6.182 9.842 653 HA LYS 901 HA LYS 901 -7.190 8.986 2.136 654 1HB LYS 901 1HB LYS 901 -4.923 10.773 2.629 655 2HB LYS 901 2HB LYS 901 -5.688 11.033 1.060 656 1HG LYS 901 1HG LYS 901 -6.960 12.397 2.451 657 2HG LYS 901 2HG LYS 901 -7.909 10.910 2.416 658 1HD LYS 901 1HD LYS 901 -7.296 10.300 4.569 659 2HD LYS 901 2HD LYS 901 -5.793 11.221 4.511 660 1HE LYS 901 1HE LYS 901 -7.323 13.322 4.394 661 2HE LYS 901 2HE LYS 901 -8.596 12.237 4.986 662 1HZ LYS 901 1HZ LYS 901 -5.910 12.446 6.233 663 2HZ LYS 901 2HZ LYS 901 -7.258 13.325 6.776 664 3HZ LYS 901 3HZ LYS 901 -7.270 11.631 6.842 665 HA ILE 902 HA ILE 902 -3.430 8.142 -1.162 666 HB ILE 902 HB ILE 902 -2.607 5.777 -0.951 667 1HG1 ILE 902 1HG1 ILE 902 -4.808 5.533 0.753 668 2HG1 ILE 902 2HG1 ILE 902 -3.537 4.338 0.527 669 1HG2 ILE 902 1HG2 ILE 902 -2.205 7.738 1.311 670 2HG2 ILE 902 2HG2 ILE 902 -1.250 6.265 1.149 671 3HG2 ILE 902 3HG2 ILE 902 -1.196 7.495 -0.112 672 1HD1 ILE 902 1HD1 ILE 902 -3.296 6.589 2.537 673 2HD1 ILE 902 2HD1 ILE 902 -4.023 5.035 2.939 674 3HD1 ILE 902 3HD1 ILE 902 -2.338 5.115 2.436 675 HA PRO 903 HA PRO 903 -7.234 6.203 -2.950 676 1HB PRO 903 1HB PRO 903 -7.157 8.233 -4.988 677 2HB PRO 903 2HB PRO 903 -8.299 8.118 -3.645 678 1HG PRO 903 1HG PRO 903 -6.390 10.138 -3.974 679 2HG PRO 903 2HG PRO 903 -7.235 9.763 -2.465 680 1HD PRO 903 1HD PRO 903 -5.099 9.349 -1.656 681 2HD PRO 903 2HD PRO 903 -4.444 9.055 -3.286 682 HA ILE 904 HA ILE 904 -4.974 4.856 -6.531 683 HB ILE 904 HB ILE 904 -3.110 5.336 -4.377 684 1HG1 ILE 904 1HG1 ILE 904 -2.259 5.529 -7.200 685 2HG1 ILE 904 2HG1 ILE 904 -3.736 6.404 -6.803 686 1HG2 ILE 904 1HG2 ILE 904 -2.358 3.260 -6.448 687 2HG2 ILE 904 2HG2 ILE 904 -1.190 4.140 -5.463 688 3HG2 ILE 904 3HG2 ILE 904 -2.354 3.060 -4.696 689 1HD1 ILE 904 1HD1 ILE 904 -1.458 6.674 -4.903 690 2HD1 ILE 904 2HD1 ILE 904 -1.307 7.492 -6.458 691 3HD1 ILE 904 3HD1 ILE 904 -2.661 7.867 -5.391 692 HA ILE 905 HA ILE 905 -5.039 0.453 -6.398 693 HB ILE 905 HB ILE 905 -6.206 1.309 -8.416 694 1HG1 ILE 905 1HG1 ILE 905 -4.757 -0.814 -9.759 695 2HG1 ILE 905 2HG1 ILE 905 -5.054 -1.227 -8.071 696 1HG2 ILE 905 1HG2 ILE 905 -3.594 2.106 -9.158 697 2HG2 ILE 905 2HG2 ILE 905 -4.092 0.893 -10.334 698 3HG2 ILE 905 3HG2 ILE 905 -5.082 2.326 -10.076 699 1HD1 ILE 905 1HD1 ILE 905 -7.243 -0.083 -9.789 700 2HD1 ILE 905 2HD1 ILE 905 -6.897 -1.812 -9.792 701 3HD1 ILE 905 3HD1 ILE 905 -7.388 -1.010 -8.297 702 HA ILE 906 HA ILE 906 -0.814 -0.644 -7.700 703 HB ILE 906 HB ILE 906 -1.813 -1.510 -5.032 704 1HG1 ILE 906 1HG1 ILE 906 0.479 0.062 -6.174 705 2HG1 ILE 906 2HG1 ILE 906 0.444 -0.377 -4.467 706 1HG2 ILE 906 1HG2 ILE 906 0.510 -2.820 -6.422 707 2HG2 ILE 906 2HG2 ILE 906 0.605 -2.510 -4.690 708 3HG2 ILE 906 3HG2 ILE 906 -0.680 -3.534 -5.332 709 1HD1 ILE 906 1HD1 ILE 906 -2.125 0.632 -5.067 710 2HD1 ILE 906 2HD1 ILE 906 -0.872 1.417 -4.110 711 3HD1 ILE 906 3HD1 ILE 906 -0.979 1.728 -5.840 712 HA ARG 907 HA ARG 907 -1.593 -4.693 -9.325 713 1HB ARG 907 1HB ARG 907 0.907 -3.566 -10.496 714 2HB ARG 907 2HB ARG 907 0.380 -5.185 -10.943 715 1HG ARG 907 1HG ARG 907 -0.570 -3.561 -12.497 716 2HG ARG 907 2HG ARG 907 -1.844 -4.279 -11.516 717 1HD ARG 907 1HD ARG 907 -2.323 -2.299 -10.447 718 2HD ARG 907 2HD ARG 907 -0.624 -1.783 -10.434 719 HE ARG 907 HE ARG 907 -0.863 -1.150 -12.803 720 1HH1 ARG 907 1HH1 ARG 907 -3.188 -2.954 -13.453 721 2HH1 ARG 907 2HH1 ARG 907 -4.495 -1.821 -13.559 722 1HH2 ARG 907 1HH2 ARG 907 -2.779 0.714 -11.929 723 2HH2 ARG 907 2HH2 ARG 907 -4.263 0.256 -12.696 724 HA ARG 908 HA ARG 908 0.993 -7.036 -6.585 725 1HB ARG 908 1HB ARG 908 -1.910 -7.890 -6.555 726 2HB ARG 908 2HB ARG 908 -0.702 -8.812 -5.672 727 1HG ARG 908 1HG ARG 908 -0.091 -6.610 -4.510 728 2HG ARG 908 2HG ARG 908 -1.560 -5.944 -5.225 729 1HD ARG 908 1HD ARG 908 -2.391 -8.396 -4.079 730 2HD ARG 908 2HD ARG 908 -2.681 -6.785 -3.380 731 HE ARG 908 HE ARG 908 -0.159 -7.204 -2.541 732 1HH1 ARG 908 1HH1 ARG 908 -3.069 -8.492 -1.636 733 2HH1 ARG 908 2HH1 ARG 908 -2.428 -9.883 -0.825 734 1HH2 ARG 908 1HH2 ARG 908 0.805 -9.396 -1.980 735 2HH2 ARG 908 2HH2 ARG 908 -0.235 -10.394 -1.021 736 HA TYR 909 HA TYR 909 1.016 -10.128 -9.950 737 1HB TYR 909 1HB TYR 909 3.928 -9.473 -10.064 738 2HB TYR 909 2HB TYR 909 2.884 -10.051 -11.337 739 HD1 TYR 909 HD1 TYR 909 3.967 -7.037 -9.458 740 HD2 TYR 909 HD2 TYR 909 1.573 -8.550 -12.672 741 HE1 TYR 909 HE1 TYR 909 3.804 -4.779 -10.386 742 HE2 TYR 909 HE2 TYR 909 1.391 -6.290 -13.599 743 HH TYR 909 HH TYR 909 1.553 -3.952 -12.805 744 HA LEU 910 HA LEU 910 3.705 -12.715 -7.416 745 1HB LEU 910 1HB LEU 910 2.014 -14.349 -9.308 746 2HB LEU 910 2HB LEU 910 2.675 -14.967 -7.793 747 HG LEU 910 HG LEU 910 0.712 -12.683 -8.136 748 1HD1 LEU 910 1HD1 LEU 910 0.402 -15.501 -7.877 749 2HD1 LEU 910 2HD1 LEU 910 -0.129 -14.770 -6.371 750 3HD1 LEU 910 3HD1 LEU 910 -0.856 -14.269 -7.893 751 1HD2 LEU 910 1HD2 LEU 910 2.584 -13.241 -6.013 752 2HD2 LEU 910 2HD2 LEU 910 1.400 -11.938 -6.126 753 3HD2 LEU 910 3HD2 LEU 910 0.941 -13.488 -5.426 754 HA PRO 911 HA PRO 911 7.297 -13.633 -9.959 755 1HB PRO 911 1HB PRO 911 8.566 -14.546 -7.543 756 2HB PRO 911 2HB PRO 911 8.847 -13.026 -8.398 757 1HG PRO 911 1HG PRO 911 7.808 -11.895 -6.732 758 2HG PRO 911 2HG PRO 911 7.510 -13.415 -5.885 759 1HD PRO 911 1HD PRO 911 5.292 -13.270 -6.410 760 2HD PRO 911 2HD PRO 911 5.597 -11.755 -7.286 761 HA ASP 912 HA ASP 912 6.535 -18.103 -8.267 762 1HB ASP 912 1HB ASP 912 4.034 -16.893 -7.201 763 2HB ASP 912 2HB ASP 912 3.927 -18.587 -7.676 764 1HA GLY 913 1HA GLY 913 4.166 -16.840 -12.487 765 2HA GLY 913 2HA GLY 913 3.765 -18.462 -11.922 766 HA SER 914 HA SER 914 -0.009 -15.562 -12.262 767 1HB SER 914 1HB SER 914 -0.687 -15.396 -9.544 768 2HB SER 914 2HB SER 914 -0.914 -16.792 -10.589 769 HG SER 914 HG SER 914 0.324 -17.384 -8.809 770 HA TYR 915 HA TYR 915 0.019 -11.580 -9.755 771 1HB TYR 915 1HB TYR 915 1.132 -10.915 -11.641 772 2HB TYR 915 2HB TYR 915 0.149 -11.944 -12.670 773 HD1 TYR 915 HD1 TYR 915 -0.067 -8.712 -10.755 774 HD2 TYR 915 HD2 TYR 915 -1.310 -10.962 -14.197 775 HE1 TYR 915 HE1 TYR 915 -1.238 -6.715 -11.638 776 HE2 TYR 915 HE2 TYR 915 -2.479 -8.962 -15.079 777 HH TYR 915 HH TYR 915 -2.018 -5.835 -13.764 778 HA GLU 916 HA GLU 916 -4.168 -9.759 -10.631 779 1HB GLU 916 1HB GLU 916 -3.514 -10.921 -8.177 780 2HB GLU 916 2HB GLU 916 -4.211 -9.353 -7.763 781 1HG GLU 916 1HG GLU 916 -5.583 -10.985 -9.853 782 2HG GLU 916 2HG GLU 916 -5.773 -11.465 -8.167 783 HA ASP 917 HA ASP 917 -3.360 -5.448 -9.749 784 1HB ASP 917 1HB ASP 917 -3.691 -5.691 -12.151 785 2HB ASP 917 2HB ASP 917 -4.423 -4.209 -11.576 786 HA TRP 918 HA TRP 918 -6.528 -2.605 -8.204 787 1HB TRP 918 1HB TRP 918 -7.856 -3.885 -6.545 788 2HB TRP 918 2HB TRP 918 -7.924 -4.535 -8.163 789 HD1 TRP 918 HD1 TRP 918 -4.735 -5.836 -7.125 790 HE1 TRP 918 HE1 TRP 918 -5.010 -8.237 -6.193 791 HE3 TRP 918 HE3 TRP 918 -9.627 -5.669 -6.098 792 HZ2 TRP 918 HZ2 TRP 918 -7.155 -9.822 -4.992 793 HZ3 TRP 918 HZ3 TRP 918 -10.793 -7.495 -4.984 794 HH2 TRP 918 HH2 TRP 918 -9.582 -9.618 -4.433 795 1HA GLY 919 1HA GLY 919 -4.719 -2.616 -3.995 796 2HA GLY 919 2HA GLY 919 -4.489 -1.052 -4.762 797 HA VAL 920 HA VAL 920 -7.598 0.107 -1.891 798 HB VAL 920 HB VAL 920 -6.520 2.624 -3.212 799 1HG1 VAL 920 1HG1 VAL 920 -8.048 2.122 -0.656 800 2HG1 VAL 920 2HG1 VAL 920 -6.996 3.525 -0.830 801 3HG1 VAL 920 3HG1 VAL 920 -8.374 3.317 -1.911 802 1HG2 VAL 920 1HG2 VAL 920 -5.496 0.700 -1.172 803 2HG2 VAL 920 2HG2 VAL 920 -4.614 1.610 -2.398 804 3HG2 VAL 920 3HG2 VAL 920 -5.149 2.410 -0.922 805 HA ASP 921 HA ASP 921 -10.496 1.850 -5.076 806 1HB ASP 921 1HB ASP 921 -8.503 1.191 -7.051 807 2HB ASP 921 2HB ASP 921 -10.078 0.646 -7.628 808 HA GLU 922 HA GLU 922 -12.158 -2.370 -5.106 809 1HB GLU 922 1HB GLU 922 -10.290 -2.776 -6.897 810 2HB GLU 922 2HB GLU 922 -9.660 -3.914 -5.710 811 1HG GLU 922 1HG GLU 922 -11.531 -5.314 -5.857 812 2HG GLU 922 2HG GLU 922 -12.575 -4.014 -6.428 813 HA LEU 923 HA LEU 923 -10.430 -3.727 -1.087 814 1HB LEU 923 1HB LEU 923 -8.105 -4.884 -0.930 815 2HB LEU 923 2HB LEU 923 -9.222 -5.396 -2.176 816 HG LEU 923 HG LEU 923 -7.748 -3.236 -3.270 817 1HD1 LEU 923 1HD1 LEU 923 -5.995 -5.339 -1.980 818 2HD1 LEU 923 2HD1 LEU 923 -5.462 -4.164 -3.181 819 3HD1 LEU 923 3HD1 LEU 923 -6.004 -3.622 -1.597 820 1HD2 LEU 923 1HD2 LEU 923 -8.316 -6.051 -3.665 821 2HD2 LEU 923 2HD2 LEU 923 -8.229 -4.729 -4.826 822 3HD2 LEU 923 3HD2 LEU 923 -6.755 -5.551 -4.315 823 HA ILE 924 HA ILE 924 -8.077 -1.490 1.876 824 HB ILE 924 HB ILE 924 -6.857 -4.144 1.939 825 1HG1 ILE 924 1HG1 ILE 924 -7.411 -3.640 4.413 826 2HG1 ILE 924 2HG1 ILE 924 -8.183 -2.195 3.763 827 1HG2 ILE 924 1HG2 ILE 924 -4.763 -2.818 2.115 828 2HG2 ILE 924 2HG2 ILE 924 -5.456 -1.972 3.495 829 3HG2 ILE 924 3HG2 ILE 924 -5.150 -3.703 3.584 830 1HD1 ILE 924 3HD1 ILE 924 -8.710 -4.992 2.754 831 2HD1 ILE 924 1HD1 ILE 924 -9.742 -4.144 3.904 832 3HD1 ILE 924 2HD1 ILE 924 -9.542 -3.517 2.267 833 HA ILE 925 HA ILE 925 -4.427 0.568 0.448 834 HB ILE 925 HB ILE 925 -4.091 2.456 2.087 835 1HG1 ILE 925 1HG1 ILE 925 -6.326 1.107 3.636 836 2HG1 ILE 925 2HG1 ILE 925 -4.632 1.028 4.117 837 1HG2 ILE 925 1HG2 ILE 925 -6.548 1.702 0.700 838 2HG2 ILE 925 2HG2 ILE 925 -6.853 2.794 2.050 839 3HG2 ILE 925 3HG2 ILE 925 -5.733 3.264 0.772 840 1HD1 ILE 925 1HD1 ILE 925 -6.040 3.655 3.619 841 2HD1 ILE 925 2HD1 ILE 925 -6.032 2.880 5.202 842 3HD1 ILE 925 3HD1 ILE 925 -4.514 3.384 4.461 843 HA THR 926 HA THR 926 -0.774 -0.443 2.902 844 HB THR 926 HB THR 926 -1.529 1.283 5.281 845 HG1 THR 926 HG1 THR 926 -1.531 2.546 3.437 846 1HG2 THR 926 1HG2 THR 926 1.070 0.134 4.255 847 2HG2 THR 926 2HG2 THR 926 1.004 1.436 5.441 848 3HG2 THR 926 3HG2 THR 926 0.312 -0.140 5.824 849 HA ASP 927 HA ASP 927 -3.547 -3.263 5.433 850 1HB ASP 927 1HB ASP 927 -3.106 -2.947 7.912 851 2HB ASP 927 2HB ASP 927 -1.716 -2.598 6.885 No H/Q in entry = 851 Start of MODEL 11 1 H1 MET 801 H1 MET 801 29.752 15.740 38.653 2 H2 MET 801 H2 MET 801 29.628 17.429 38.567 3 H3 MET 801 H3 MET 801 30.121 16.687 40.015 4 HA MET 801 HA MET 801 27.986 15.846 40.465 5 1HB MET 801 1HB MET 801 28.612 18.481 40.308 6 2HB MET 801 2HB MET 801 27.212 18.440 39.235 7 1HG MET 801 1HG MET 801 27.047 17.045 41.883 8 2HG MET 801 2HG MET 801 26.879 18.799 41.831 9 1HE MET 801 3HE MET 801 24.757 19.473 42.289 10 2HE MET 801 1HE MET 801 23.236 18.672 41.903 11 3HE MET 801 2HE MET 801 24.383 17.892 42.989 12 HA SER 802 HA SER 802 26.410 14.919 36.207 13 1HB SER 802 1HB SER 802 25.806 17.789 36.613 14 2HB SER 802 2HB SER 802 25.300 17.138 35.058 15 HG SER 802 HG SER 802 24.265 15.442 36.250 16 HA ASP 803 HA ASP 803 29.420 16.269 33.005 17 1HB ASP 803 1HB ASP 803 30.435 13.655 34.148 18 2HB ASP 803 2HB ASP 803 31.206 14.470 32.786 19 HA ASN 804 HA ASN 804 26.792 13.424 30.522 20 1HB ASN 804 1HB ASN 804 26.716 16.239 29.438 21 2HB ASN 804 2HB ASN 804 26.003 14.907 28.528 22 2HD2 ASN 804 1HD2 ASN 804 25.130 17.279 30.649 23 1HD2 ASN 804 2HD2 ASN 804 23.837 16.510 31.435 24 HA GLU 805 HA GLU 805 30.685 13.027 28.089 25 1HB GLU 805 1HB GLU 805 30.756 11.239 29.974 26 2HB GLU 805 2HB GLU 805 29.986 10.177 28.795 27 1HG GLU 805 1HG GLU 805 32.306 11.682 27.757 28 2HG GLU 805 2HG GLU 805 32.694 10.511 29.019 29 HA ASP 806 HA ASP 806 27.807 12.118 24.717 30 1HB ASP 806 1HB ASP 806 28.720 13.289 22.714 31 2HB ASP 806 2HB ASP 806 28.656 14.347 24.124 32 HA ASN 807 HA ASN 807 30.322 8.502 23.734 33 1HB ASN 807 1HB ASN 807 27.907 7.877 24.738 34 2HB ASN 807 2HB ASN 807 27.625 7.401 23.064 35 2HD2 ASN 807 1HD2 ASN 807 27.611 5.102 23.694 36 1HD2 ASN 807 2HD2 ASN 807 29.058 4.300 24.076 37 HA PHE 808 HA PHE 808 28.582 8.510 19.268 38 1HB PHE 808 1HB PHE 808 31.142 8.432 20.046 39 2HB PHE 808 2HB PHE 808 31.114 6.922 19.133 40 HD1 PHE 808 HD1 PHE 808 29.686 10.379 18.745 41 HD2 PHE 808 HD2 PHE 808 31.791 7.111 16.920 42 HE1 PHE 808 HE1 PHE 808 29.831 11.657 16.624 43 HE2 PHE 808 HE2 PHE 808 31.936 8.389 14.799 44 HZ PHE 808 HZ PHE 808 30.955 10.661 14.651 45 HA ASP 809 HA ASP 809 27.680 3.943 18.846 46 1HB ASP 809 1HB ASP 809 30.356 4.362 17.638 47 2HB ASP 809 2HB ASP 809 29.728 2.717 17.526 48 1HA GLY 810 1HA GLY 810 28.536 2.026 23.083 49 2HA GLY 810 2HA GLY 810 29.097 0.971 21.785 50 HA ASP 811 HA ASP 811 33.201 2.794 22.687 51 1HB ASP 811 1HB ASP 811 32.525 1.007 24.273 52 2HB ASP 811 2HB ASP 811 34.231 0.878 23.856 53 HA ASP 812 HA ASP 812 35.747 1.157 19.372 54 1HB ASP 812 1HB ASP 812 37.300 2.008 21.272 55 2HB ASP 812 2HB ASP 812 37.814 0.327 21.409 56 HA PHE 813 HA PHE 813 35.622 -3.294 19.081 57 1HB PHE 813 1HB PHE 813 35.035 -2.908 21.909 58 2HB PHE 813 2HB PHE 813 34.339 -4.415 21.318 59 HD1 PHE 813 HD1 PHE 813 36.065 -5.569 19.460 60 HD2 PHE 813 HD2 PHE 813 37.142 -3.169 22.855 61 HE1 PHE 813 HE1 PHE 813 38.310 -6.621 19.492 62 HE2 PHE 813 HE2 PHE 813 39.388 -4.221 22.887 63 HZ PHE 813 HZ PHE 813 39.971 -5.947 21.205 64 HA ASP 814 HA ASP 814 31.018 -3.491 18.417 65 1HB ASP 814 1HB ASP 814 31.797 -1.047 16.826 66 2HB ASP 814 2HB ASP 814 30.231 -1.821 16.582 67 HA ASP 815 HA ASP 815 33.686 -6.488 15.567 68 1HB ASP 815 1HB ASP 815 31.050 -6.585 16.168 69 2HB ASP 815 2HB ASP 815 30.944 -6.096 14.477 70 HA VAL 816 HA VAL 816 35.537 -2.913 13.054 71 HB VAL 816 HB VAL 816 33.877 -4.935 11.513 72 1HG1 VAL 816 1HG1 VAL 816 35.919 -2.872 10.792 73 2HG1 VAL 816 2HG1 VAL 816 35.921 -4.392 9.898 74 3HG1 VAL 816 3HG1 VAL 816 34.478 -3.379 9.910 75 1HG2 VAL 816 1HG2 VAL 816 36.689 -5.018 12.627 76 2HG2 VAL 816 2HG2 VAL 816 35.396 -6.196 12.853 77 3HG2 VAL 816 3HG2 VAL 816 36.187 -6.045 11.284 78 HA GLU 817 HA GLU 817 31.804 -0.430 12.715 79 1HB GLU 817 1HB GLU 817 33.502 1.001 13.872 80 2HB GLU 817 2HB GLU 817 34.164 1.432 12.295 81 1HG GLU 817 1HG GLU 817 32.373 2.765 11.750 82 2HG GLU 817 2HG GLU 817 31.229 1.782 12.663 83 HA GLU 818 HA GLU 818 34.043 -1.202 7.993 84 1HB GLU 818 1HB GLU 818 31.272 -1.300 9.020 85 2HB GLU 818 2HB GLU 818 31.411 -0.748 7.351 86 1HG GLU 818 1HG GLU 818 33.166 -2.896 7.450 87 2HG GLU 818 2HG GLU 818 31.529 -2.937 6.794 88 HA ASP 819 HA ASP 819 33.983 2.972 6.581 89 1HB ASP 819 1HB ASP 819 33.201 3.295 4.242 90 2HB ASP 819 2HB ASP 819 34.112 1.795 4.421 91 HA GLU 820 HA GLU 820 30.149 4.799 7.805 92 1HB GLU 820 1HB GLU 820 32.171 6.672 7.170 93 2HB GLU 820 2HB GLU 820 30.679 7.335 6.502 94 1HG GLU 820 1HG GLU 820 29.635 6.715 8.800 95 2HG GLU 820 2HG GLU 820 31.305 6.623 9.361 96 1HA GLY 821 1HA GLY 821 26.570 6.021 5.195 97 2HA GLY 821 2HA GLY 821 27.773 5.442 4.040 98 HA LEU 822 HA LEU 822 25.580 1.563 5.979 99 1HB LEU 822 1HB LEU 822 23.726 3.524 7.157 100 2HB LEU 822 2HB LEU 822 22.926 2.067 6.570 101 HG LEU 822 HG LEU 822 24.625 0.709 7.838 102 1HD1 LEU 822 1HD1 LEU 822 26.154 2.873 7.915 103 2HD1 LEU 822 2HD1 LEU 822 25.265 3.180 9.408 104 3HD1 LEU 822 3HD1 LEU 822 26.201 1.696 9.229 105 1HD2 LEU 822 1HD2 LEU 822 22.290 1.586 8.687 106 2HD2 LEU 822 2HD2 LEU 822 23.398 0.818 9.824 107 3HD2 LEU 822 3HD2 LEU 822 23.272 2.576 9.767 108 HA ASP 823 HA ASP 823 22.236 2.511 2.554 109 1HB ASP 823 1HB ASP 823 23.699 5.128 2.120 110 2HB ASP 823 2HB ASP 823 22.496 4.511 0.986 111 HA ASP 824 HA ASP 824 25.921 1.800 -0.260 112 1HB ASP 824 1HB ASP 824 27.309 3.685 0.695 113 2HB ASP 824 2HB ASP 824 28.048 2.510 1.783 114 HA LEU 825 HA LEU 825 26.868 -2.085 1.837 115 1HB LEU 825 1HB LEU 825 25.319 -0.808 3.998 116 2HB LEU 825 2HB LEU 825 25.294 -2.571 4.046 117 HG LEU 825 HG LEU 825 27.917 -2.191 3.555 118 1HD1 LEU 825 1HD1 LEU 825 26.896 0.295 4.923 119 2HD1 LEU 825 2HD1 LEU 825 28.542 -0.277 5.189 120 3HD1 LEU 825 3HD1 LEU 825 28.015 0.169 3.567 121 1HD2 LEU 825 3HD2 LEU 825 26.577 -2.017 6.274 122 2HD2 LEU 825 1HD2 LEU 825 26.956 -3.505 5.405 123 3HD2 LEU 825 2HD2 LEU 825 28.258 -2.472 5.995 124 HA GLU 826 HA GLU 826 22.887 -4.227 1.023 125 1HB GLU 826 1HB GLU 826 21.699 -3.098 3.550 126 2HB GLU 826 2HB GLU 826 20.785 -4.244 2.569 127 1HG GLU 826 1HG GLU 826 23.014 -5.639 2.639 128 2HG GLU 826 2HG GLU 826 21.904 -5.685 4.010 129 HA ASN 827 HA ASN 827 18.393 -1.561 0.706 130 1HB ASN 827 1HB ASN 827 20.507 0.045 1.226 131 2HB ASN 827 2HB ASN 827 20.520 0.106 -0.537 132 2HD2 ASN 827 1HD2 ASN 827 19.759 2.324 1.275 133 1HD2 ASN 827 2HD2 ASN 827 18.145 2.704 0.910 134 HA ALA 828 HA ALA 828 19.489 -3.098 -3.454 135 1HB ALA 828 2HB ALA 828 20.117 -5.622 -3.599 136 2HB ALA 828 1HB ALA 828 20.206 -5.542 -1.839 137 3HB ALA 828 3HB ALA 828 21.260 -4.525 -2.821 138 HA GLU 829 HA GLU 829 15.930 -5.966 -4.110 139 1HB GLU 829 1HB GLU 829 17.181 -8.062 -2.349 140 2HB GLU 829 2HB GLU 829 15.561 -8.313 -2.999 141 1HG GLU 829 1HG GLU 829 17.844 -7.493 -4.791 142 2HG GLU 829 2HG GLU 829 17.560 -9.189 -4.394 143 HA GLU 830 HA GLU 830 15.256 -4.923 1.100 144 1HB GLU 830 1HB GLU 830 14.611 -3.376 -0.914 145 2HB GLU 830 2HB GLU 830 13.138 -4.345 -0.965 146 1HG GLU 830 1HG GLU 830 13.413 -3.787 1.735 147 2HG GLU 830 2HG GLU 830 13.952 -2.294 0.967 148 HA GLU 831 HA GLU 831 13.599 -9.627 -0.136 149 1HB GLU 831 1HB GLU 831 13.265 -7.944 2.315 150 2HB GLU 831 2HB GLU 831 12.210 -9.344 2.132 151 1HG GLU 831 1HG GLU 831 14.174 -10.076 3.325 152 2HG GLU 831 2HG GLU 831 14.274 -10.732 1.689 153 1HA GLY 832 1HA GLY 832 8.884 -9.017 0.090 154 2HA GLY 832 2HA GLY 832 9.541 -8.449 -1.446 155 HA GLN 833 HA GLN 833 8.027 -12.395 -2.812 156 1HB GLN 833 1HB GLN 833 6.544 -13.844 -1.424 157 2HB GLN 833 2HB GLN 833 7.841 -13.131 -0.462 158 1HG GLN 833 1HG GLN 833 6.275 -11.290 0.190 159 2HG GLN 833 2HG GLN 833 4.984 -12.142 -0.655 160 2HE2 GLN 833 1HE2 GLN 833 6.987 -12.151 2.240 161 1HE2 GLN 833 2HE2 GLN 833 6.202 -13.445 3.009 162 HA GLU 834 HA GLU 834 4.575 -10.952 -5.152 163 1HB GLU 834 1HB GLU 834 3.506 -10.694 -2.953 164 2HB GLU 834 2HB GLU 834 4.139 -9.054 -2.814 165 1HG GLU 834 1HG GLU 834 2.464 -8.204 -4.067 166 2HG GLU 834 2HG GLU 834 2.667 -9.442 -5.305 167 HA ASN 835 HA ASN 835 6.657 -7.396 -7.008 168 1HB ASN 835 1HB ASN 835 6.628 -7.580 -9.365 169 2HB ASN 835 2HB ASN 835 5.104 -8.459 -9.380 170 2HD2 ASN 835 1HD2 ASN 835 5.857 -10.399 -10.415 171 1HD2 ASN 835 2HD2 ASN 835 7.052 -11.404 -9.751 172 HA VAL 836 HA VAL 836 2.849 -5.219 -7.454 173 HB VAL 836 HB VAL 836 2.336 -4.547 -5.357 174 1HG1 VAL 836 1HG1 VAL 836 5.166 -5.452 -4.827 175 2HG1 VAL 836 2HG1 VAL 836 3.916 -5.260 -3.600 176 3HG1 VAL 836 3HG1 VAL 836 3.734 -6.479 -4.863 177 1HG2 VAL 836 1HG2 VAL 836 4.854 -2.895 -5.537 178 2HG2 VAL 836 2HG2 VAL 836 3.184 -2.336 -5.506 179 3HG2 VAL 836 3HG2 VAL 836 3.924 -2.998 -4.048 180 HA GLU 837 HA GLU 837 4.366 -1.426 -9.191 181 1HB GLU 837 1HB GLU 837 2.969 -3.147 -10.867 182 2HB GLU 837 2HB GLU 837 2.061 -1.644 -10.997 183 1HG GLU 837 1HG GLU 837 4.618 -0.707 -11.138 184 2HG GLU 837 2HG GLU 837 4.803 -2.281 -11.912 185 HA ILE 838 HA ILE 838 0.624 0.911 -8.168 186 HB ILE 838 HB ILE 838 3.276 2.021 -7.934 187 1HG1 ILE 838 1HG1 ILE 838 0.777 1.868 -6.325 188 2HG1 ILE 838 2HG1 ILE 838 2.006 3.019 -5.818 189 1HG2 ILE 838 1HG2 ILE 838 1.059 4.067 -8.128 190 2HG2 ILE 838 2HG2 ILE 838 2.678 4.386 -7.507 191 3HG2 ILE 838 3HG2 ILE 838 2.454 3.943 -9.199 192 1HD1 ILE 838 1HD1 ILE 838 2.964 0.285 -6.505 193 2HD1 ILE 838 2HD1 ILE 838 3.497 1.372 -5.227 194 3HD1 ILE 838 3HD1 ILE 838 2.022 0.431 -5.025 195 HA LEU 839 HA LEU 839 -0.472 4.241 -11.103 196 1HB LEU 839 1HB LEU 839 -1.348 1.530 -11.380 197 2HB LEU 839 2HB LEU 839 -2.737 2.568 -11.696 198 HG LEU 839 HG LEU 839 -0.792 3.896 -13.071 199 1HD1 LEU 839 1HD1 LEU 839 0.279 1.294 -12.518 200 2HD1 LEU 839 2HD1 LEU 839 -0.065 1.400 -14.244 201 3HD1 LEU 839 3HD1 LEU 839 0.991 2.588 -13.481 202 1HD2 LEU 839 1HD2 LEU 839 -2.769 1.762 -13.827 203 2HD2 LEU 839 2HD2 LEU 839 -2.813 3.489 -14.176 204 3HD2 LEU 839 3HD2 LEU 839 -1.708 2.438 -15.064 205 HA PRO 840 HA PRO 840 -3.683 6.526 -9.128 206 1HB PRO 840 1HB PRO 840 -4.236 8.007 -10.738 207 2HB PRO 840 2HB PRO 840 -5.368 6.842 -11.430 208 1HG PRO 840 1HG PRO 840 -2.847 7.704 -12.506 209 2HG PRO 840 2HG PRO 840 -3.959 6.510 -13.184 210 1HD PRO 840 1HD PRO 840 -2.477 4.858 -12.662 211 2HD PRO 840 2HD PRO 840 -1.390 6.051 -11.908 212 HA SER 841 HA SER 841 -6.468 3.227 -8.071 213 1HB SER 841 1HB SER 841 -8.373 4.451 -6.722 214 2HB SER 841 2HB SER 841 -6.754 4.354 -6.048 215 HG SER 841 HG SER 841 -7.665 6.486 -6.013 216 1HA GLY 842 1HA GLY 842 -10.351 2.425 -10.135 217 2HA GLY 842 2HA GLY 842 -10.002 4.074 -10.639 218 HA GLU 843 HA GLU 843 -8.836 1.296 -14.086 219 1HB GLU 843 1HB GLU 843 -6.642 1.641 -12.665 220 2HB GLU 843 2HB GLU 843 -6.579 -0.120 -12.690 221 1HG GLU 843 1HG GLU 843 -6.937 0.117 -15.250 222 2HG GLU 843 2HG GLU 843 -5.341 0.491 -14.599 223 HA ARG 844 HA ARG 844 -10.054 -3.007 -13.155 224 1HB ARG 844 1HB ARG 844 -11.987 -1.461 -11.753 225 2HB ARG 844 2HB ARG 844 -12.824 -2.696 -12.693 226 1HG ARG 844 1HG ARG 844 -10.502 -3.222 -10.813 227 2HG ARG 844 2HG ARG 844 -12.200 -3.518 -10.435 228 1HD ARG 844 1HD ARG 844 -11.154 -4.726 -12.961 229 2HD ARG 844 2HD ARG 844 -10.643 -5.463 -11.430 230 HE ARG 844 HE ARG 844 -13.429 -4.968 -11.237 231 1HH1 ARG 844 1HH1 ARG 844 -11.159 -7.339 -11.978 232 2HH1 ARG 844 2HH1 ARG 844 -12.282 -8.425 -12.727 233 1HH2 ARG 844 1HH2 ARG 844 -14.914 -6.169 -12.666 234 2HH2 ARG 844 2HH2 ARG 844 -14.407 -7.762 -13.116 235 HA PRO 845 HA PRO 845 -13.464 -2.827 -16.558 236 1HB PRO 845 1HB PRO 845 -13.844 -0.063 -17.266 237 2HB PRO 845 2HB PRO 845 -15.010 -1.166 -16.528 238 1HG PRO 845 1HG PRO 845 -13.727 1.058 -15.296 239 2HG PRO 845 2HG PRO 845 -14.795 -0.122 -14.530 240 1HD PRO 845 1HD PRO 845 -12.995 -0.910 -13.354 241 2HD PRO 845 2HD PRO 845 -11.889 0.134 -14.273 242 HA GLN 846 HA GLN 846 -10.382 -2.431 -19.718 243 1HB GLN 846 1HB GLN 846 -10.190 -0.151 -18.862 244 2HB GLN 846 2HB GLN 846 -9.035 -0.679 -17.640 245 1HG GLN 846 1HG GLN 846 -7.364 -1.142 -19.277 246 2HG GLN 846 2HG GLN 846 -8.526 -1.029 -20.599 247 2HE2 GLN 846 1HE2 GLN 846 -6.028 0.602 -20.154 248 1HE2 GLN 846 2HE2 GLN 846 -6.549 2.217 -20.120 249 HA ALA 847 HA ALA 847 -6.813 -4.741 -17.946 250 1HB ALA 847 2HB ALA 847 -6.932 -3.653 -15.119 251 2HB ALA 847 1HB ALA 847 -6.204 -2.783 -16.469 252 3HB ALA 847 3HB ALA 847 -5.521 -4.321 -15.941 253 HA ASN 848 HA ASN 848 -9.754 -7.383 -15.201 254 1HB ASN 848 1HB ASN 848 -10.880 -7.321 -17.977 255 2HB ASN 848 2HB ASN 848 -11.169 -8.764 -17.005 256 2HD2 ASN 848 1HD2 ASN 848 -13.255 -6.865 -17.777 257 1HD2 ASN 848 2HD2 ASN 848 -13.856 -6.174 -16.347 258 HA GLN 849 HA GLN 849 -7.230 -10.755 -16.723 259 1HB GLN 849 1HB GLN 849 -4.851 -10.305 -15.558 260 2HB GLN 849 2HB GLN 849 -5.402 -9.380 -16.950 261 1HG GLN 849 1HG GLN 849 -5.395 -7.475 -15.750 262 2HG GLN 849 2HG GLN 849 -6.426 -8.190 -14.518 263 2HE2 GLN 849 1HE2 GLN 849 -3.872 -6.465 -14.375 264 1HE2 GLN 849 2HE2 GLN 849 -2.900 -7.298 -13.268 265 HA LYS 850 HA LYS 850 -7.072 -12.780 -12.609 266 1HB LYS 850 1HB LYS 850 -4.763 -10.968 -11.933 267 2HB LYS 850 2HB LYS 850 -5.078 -12.460 -11.053 268 1HG LYS 850 1HG LYS 850 -5.162 -12.814 -13.962 269 2HG LYS 850 2HG LYS 850 -3.592 -12.264 -13.377 270 1HD LYS 850 1HD LYS 850 -3.467 -14.108 -11.804 271 2HD LYS 850 2HD LYS 850 -5.108 -14.614 -12.208 272 1HE LYS 850 1HE LYS 850 -4.052 -14.661 -14.687 273 2HE LYS 850 2HE LYS 850 -2.584 -14.996 -13.747 274 1HZ LYS 850 1HZ LYS 850 -3.862 -16.673 -12.500 275 2HZ LYS 850 2HZ LYS 850 -5.184 -16.420 -13.532 276 3HZ LYS 850 3HZ LYS 850 -3.735 -17.055 -14.151 277 HA ARG 851 HA ARG 851 -7.958 -10.494 -8.577 278 1HB ARG 851 1HB ARG 851 -9.757 -11.725 -9.760 279 2HB ARG 851 2HB ARG 851 -9.213 -13.226 -9.008 280 1HG ARG 851 1HG ARG 851 -9.830 -10.897 -7.233 281 2HG ARG 851 2HG ARG 851 -11.177 -11.799 -7.928 282 1HD ARG 851 1HD ARG 851 -9.300 -13.730 -6.995 283 2HD ARG 851 2HD ARG 851 -9.519 -12.539 -5.698 284 HE ARG 851 HE ARG 851 -11.991 -13.437 -7.037 285 1HH1 ARG 851 1HH1 ARG 851 -10.004 -15.223 -5.166 286 2HH1 ARG 851 2HH1 ARG 851 -11.032 -15.316 -3.774 287 1HH2 ARG 851 1HH2 ARG 851 -13.240 -12.898 -4.914 288 2HH2 ARG 851 2HH2 ARG 851 -12.864 -14.000 -3.632 289 HA ILE 852 HA ILE 852 -6.417 -14.774 -6.261 290 HB ILE 852 HB ILE 852 -3.969 -15.273 -6.738 291 1HG1 ILE 852 1HG1 ILE 852 -4.473 -13.022 -8.625 292 2HG1 ILE 852 2HG1 ILE 852 -3.541 -14.380 -9.254 293 1HG2 ILE 852 1HG2 ILE 852 -5.955 -16.498 -7.727 294 2HG2 ILE 852 2HG2 ILE 852 -5.781 -15.477 -9.155 295 3HG2 ILE 852 3HG2 ILE 852 -4.481 -16.575 -8.692 296 1HD1 ILE 852 1HD1 ILE 852 -2.365 -14.057 -6.825 297 2HD1 ILE 852 2HD1 ILE 852 -1.790 -13.274 -8.297 298 3HD1 ILE 852 3HD1 ILE 852 -2.827 -12.394 -7.179 299 HA THR 853 HA THR 853 -3.266 -11.334 -4.708 300 HB THR 853 HB THR 853 -4.158 -8.889 -5.253 301 HG1 THR 853 HG1 THR 853 -5.891 -10.108 -6.502 302 1HG2 THR 853 1HG2 THR 853 -1.940 -9.861 -5.883 303 2HG2 THR 853 2HG2 THR 853 -2.681 -10.512 -7.341 304 3HG2 THR 853 3HG2 THR 853 -2.589 -8.768 -7.106 305 HA THR 854 HA THR 854 -6.449 -12.027 -1.626 306 HB THR 854 HB THR 854 -4.205 -10.257 -0.629 307 HG1 THR 854 HG1 THR 854 -5.024 -12.922 -0.118 308 1HG2 THR 854 1HG2 THR 854 -6.820 -10.431 0.471 309 2HG2 THR 854 2HG2 THR 854 -5.760 -11.383 1.508 310 3HG2 THR 854 3HG2 THR 854 -5.392 -9.690 1.191 311 HA PRO 855 HA PRO 855 -8.819 -8.421 -3.011 312 1HB PRO 855 1HB PRO 855 -10.880 -9.407 -2.960 313 2HB PRO 855 2HB PRO 855 -10.911 -9.239 -1.202 314 1HG PRO 855 1HG PRO 855 -10.643 -11.648 -2.715 315 2HG PRO 855 2HG PRO 855 -10.569 -11.470 -0.959 316 1HD PRO 855 1HD PRO 855 -8.348 -11.996 -1.051 317 2HD PRO 855 2HD PRO 855 -8.385 -11.987 -2.832 318 HA TYR 856 HA TYR 856 -7.823 -5.716 0.360 319 1HB TYR 856 1HB TYR 856 -8.338 -7.665 1.701 320 2HB TYR 856 2HB TYR 856 -6.795 -8.396 1.312 321 HD1 TYR 856 HD1 TYR 856 -4.655 -6.961 2.064 322 HD2 TYR 856 HD2 TYR 856 -8.597 -6.555 3.717 323 HE1 TYR 856 HE1 TYR 856 -3.696 -5.958 4.100 324 HE2 TYR 856 HE2 TYR 856 -7.633 -5.564 5.765 325 HH TYR 856 HH TYR 856 -5.389 -5.641 6.966 326 HA MET 857 HA MET 857 -3.792 -5.083 -1.566 327 1HB MET 857 1HB MET 857 -4.886 -2.866 -1.708 328 2HB MET 857 2HB MET 857 -4.536 -2.599 -0.006 329 1HG MET 857 1HG MET 857 -2.071 -3.315 -1.189 330 2HG MET 857 2HG MET 857 -2.541 -1.730 -0.593 331 1HE MET 857 1HE MET 857 -4.787 -0.816 -2.175 332 2HE MET 857 2HE MET 857 -3.373 0.228 -2.014 333 3HE MET 857 3HE MET 857 -4.130 0.000 -3.588 334 HA THR 858 HA THR 858 -1.614 -5.389 2.342 335 HB THR 858 HB THR 858 0.179 -7.054 1.912 336 HG1 THR 858 HG1 THR 858 0.941 -7.281 -0.039 337 1HG2 THR 858 1HG2 THR 858 -2.229 -7.641 2.073 338 2HG2 THR 858 2HG2 THR 858 -2.376 -7.440 0.328 339 3HG2 THR 858 3HG2 THR 858 -1.359 -8.723 0.986 340 HA LYS 859 HA LYS 859 0.905 -1.977 3.254 341 1HB LYS 859 1HB LYS 859 1.193 -3.426 5.201 342 2HB LYS 859 2HB LYS 859 2.736 -2.693 4.766 343 1HG LYS 859 1HG LYS 859 1.923 -5.412 3.725 344 2HG LYS 859 2HG LYS 859 3.539 -4.706 3.798 345 1HD LYS 859 1HD LYS 859 3.821 -5.241 6.002 346 2HD LYS 859 2HD LYS 859 2.127 -4.947 6.396 347 1HE LYS 859 1HE LYS 859 1.548 -7.095 5.198 348 2HE LYS 859 2HE LYS 859 2.593 -7.345 6.611 349 1HZ LYS 859 1HZ LYS 859 4.514 -7.151 5.072 350 2HZ LYS 859 2HZ LYS 859 3.538 -8.497 4.743 351 3HZ LYS 859 3HZ LYS 859 3.432 -7.113 3.763 352 HA TYR 860 HA TYR 860 4.827 -3.165 0.827 353 1HB TYR 860 1HB TYR 860 4.833 -5.576 0.665 354 2HB TYR 860 2HB TYR 860 3.567 -5.553 -0.554 355 HD1 TYR 860 HD1 TYR 860 5.936 -2.814 -0.701 356 HD2 TYR 860 HD2 TYR 860 5.257 -6.843 -2.043 357 HE1 TYR 860 HE1 TYR 860 7.604 -2.481 -2.483 358 HE2 TYR 860 HE2 TYR 860 6.943 -6.499 -3.831 359 HH TYR 860 HH TYR 860 7.875 -4.366 -5.111 360 HA GLU 861 HA GLU 861 2.276 -2.441 -3.324 361 1HB GLU 861 1HB GLU 861 -0.198 -2.662 -1.563 362 2HB GLU 861 2HB GLU 861 -0.217 -2.067 -3.224 363 1HG GLU 861 1HG GLU 861 0.684 -4.217 -4.018 364 2HG GLU 861 2HG GLU 861 0.729 -4.816 -2.362 365 HA ARG 862 HA ARG 862 1.141 1.410 -0.555 366 1HB ARG 862 1HB ARG 862 0.065 0.548 1.366 367 2HB ARG 862 2HB ARG 862 1.440 -0.466 1.785 368 1HG ARG 862 1HG ARG 862 1.955 2.462 1.698 369 2HG ARG 862 2HG ARG 862 0.947 1.891 3.023 370 1HD ARG 862 1HD ARG 862 2.836 0.040 3.252 371 2HD ARG 862 2HD ARG 862 3.821 1.274 2.443 372 HE ARG 862 HE ARG 862 2.466 1.611 5.070 373 1HH1 ARG 862 1HH1 ARG 862 3.004 3.792 2.720 374 2HH1 ARG 862 2HH1 ARG 862 4.251 4.687 3.521 375 1HH2 ARG 862 1HH2 ARG 862 4.697 2.337 6.030 376 2HH2 ARG 862 2HH2 ARG 862 5.208 3.865 5.395 377 HA ALA 863 HA ALA 863 5.605 1.232 1.198 378 1HB ALA 863 2HB ALA 863 6.601 -1.445 0.513 379 2HB ALA 863 3HB ALA 863 6.745 -0.552 2.026 380 3HB ALA 863 1HB ALA 863 5.278 -1.466 1.679 381 HA ARG 864 HA ARG 864 7.024 0.432 -3.196 382 1HB ARG 864 1HB ARG 864 4.821 -1.380 -3.489 383 2HB ARG 864 2HB ARG 864 4.772 -0.268 -4.859 384 1HG ARG 864 1HG ARG 864 7.498 -1.127 -4.270 385 2HG ARG 864 2HG ARG 864 6.444 -2.498 -4.604 386 1HD ARG 864 1HD ARG 864 5.647 -0.831 -6.590 387 2HD ARG 864 2HD ARG 864 7.002 -1.962 -6.786 388 HE ARG 864 HE ARG 864 7.337 0.895 -5.920 389 1HH1 ARG 864 1HH1 ARG 864 9.075 -1.913 -6.285 390 2HH1 ARG 864 2HH1 ARG 864 10.245 -1.272 -7.391 391 1HH2 ARG 864 1HH2 ARG 864 8.543 1.709 -7.879 392 2HH2 ARG 864 2HH2 ARG 864 9.943 0.778 -8.293 393 HA VAL 865 HA VAL 865 3.143 3.381 -4.343 394 HB VAL 865 HB VAL 865 2.403 2.063 -1.802 395 1HG1 VAL 865 1HG1 VAL 865 1.846 4.949 -2.231 396 2HG1 VAL 865 2HG1 VAL 865 0.682 3.930 -1.386 397 3HG1 VAL 865 3HG1 VAL 865 2.319 4.108 -0.756 398 1HG2 VAL 865 1HG2 VAL 865 0.957 3.094 -4.187 399 2HG2 VAL 865 2HG2 VAL 865 1.276 1.425 -3.732 400 3HG2 VAL 865 3HG2 VAL 865 0.137 2.384 -2.795 401 HA LEU 866 HA LEU 866 4.775 5.993 -0.452 402 1HB LEU 866 1HB LEU 866 5.036 4.695 1.433 403 2HB LEU 866 2HB LEU 866 5.484 3.278 0.493 404 HG LEU 866 HG LEU 866 7.536 5.416 0.554 405 1HD1 LEU 866 1HD1 LEU 866 6.412 5.309 2.901 406 2HD1 LEU 866 2HD1 LEU 866 7.198 3.736 3.030 407 3HD1 LEU 866 3HD1 LEU 866 8.168 5.192 2.805 408 1HD2 LEU 866 1HD2 LEU 866 7.441 2.412 0.920 409 2HD2 LEU 866 2HD2 LEU 866 8.095 3.308 -0.450 410 3HD2 LEU 866 3HD2 LEU 866 8.927 3.342 1.104 411 1HA GLY 867 1HA GLY 867 8.978 5.055 -2.503 412 2HA GLY 867 2HA GLY 867 8.515 3.644 -3.461 413 HA THR 868 HA THR 868 6.910 6.241 -6.633 414 HB THR 868 HB THR 868 4.850 5.635 -7.607 415 HG1 THR 868 HG1 THR 868 4.071 5.166 -4.932 416 1HG2 THR 868 1HG2 THR 868 6.600 3.820 -6.677 417 2HG2 THR 868 2HG2 THR 868 5.107 3.248 -5.929 418 3HG2 THR 868 3HG2 THR 868 5.204 3.419 -7.680 419 HA ARG 869 HA ARG 869 3.985 9.085 -4.239 420 1HB ARG 869 1HB ARG 869 4.767 7.786 -1.590 421 2HB ARG 869 2HB ARG 869 3.579 9.069 -1.805 422 1HG ARG 869 1HG ARG 869 2.933 6.842 -3.527 423 2HG ARG 869 2HG ARG 869 3.121 6.284 -1.866 424 1HD ARG 869 1HD ARG 869 1.562 8.097 -1.118 425 2HD ARG 869 2HD ARG 869 0.788 6.983 -2.261 426 HE ARG 869 HE ARG 869 2.122 9.416 -3.346 427 1HH1 ARG 869 1HH1 ARG 869 -0.762 8.845 -1.820 428 2HH1 ARG 869 2HH1 ARG 869 -1.780 9.243 -3.166 429 1HH2 ARG 869 1HH2 ARG 869 0.835 9.400 -5.437 430 2HH2 ARG 869 2HH2 ARG 869 -0.875 9.556 -5.213 431 HA ALA 870 HA ALA 870 8.120 10.142 -1.850 432 1HB ALA 870 3HB ALA 870 8.780 8.071 -0.903 433 2HB ALA 870 2HB ALA 870 10.106 8.488 -1.988 434 3HB ALA 870 1HB ALA 870 8.900 7.302 -2.485 435 HA LEU 871 HA LEU 871 10.183 10.290 -5.966 436 1HB LEU 871 1HB LEU 871 9.237 8.828 -8.184 437 2HB LEU 871 2HB LEU 871 10.754 8.586 -7.333 438 HG LEU 871 HG LEU 871 8.313 7.334 -6.179 439 1HD1 LEU 871 1HD1 LEU 871 8.164 6.895 -8.617 440 2HD1 LEU 871 2HD1 LEU 871 9.795 6.225 -8.569 441 3HD1 LEU 871 3HD1 LEU 871 8.488 5.431 -7.690 442 1HD2 LEU 871 1HD2 LEU 871 11.228 6.563 -6.520 443 2HD2 LEU 871 2HD2 LEU 871 10.456 7.109 -5.032 444 3HD2 LEU 871 3HD2 LEU 871 10.025 5.546 -5.726 445 HA GLN 872 HA GLN 872 6.006 11.243 -8.387 446 1HB GLN 872 1HB GLN 872 4.958 10.234 -5.820 447 2HB GLN 872 2HB GLN 872 4.196 11.732 -6.345 448 1HG GLN 872 1HG GLN 872 3.956 10.571 -8.652 449 2HG GLN 872 2HG GLN 872 4.280 9.078 -7.773 450 2HE2 GLN 872 1HE2 GLN 872 1.920 8.649 -8.542 451 1HE2 GLN 872 2HE2 GLN 872 0.675 9.187 -7.521 452 HA ILE 873 HA ILE 873 6.181 15.038 -5.353 453 HB ILE 873 HB ILE 873 7.244 14.744 -2.968 454 1HG1 ILE 873 1HG1 ILE 873 6.147 12.173 -2.548 455 2HG1 ILE 873 2HG1 ILE 873 7.168 12.032 -3.974 456 1HG2 ILE 873 1HG2 ILE 873 4.543 14.109 -4.024 457 2HG2 ILE 873 2HG2 ILE 873 4.847 13.815 -2.314 458 3HG2 ILE 873 3HG2 ILE 873 5.062 15.431 -2.980 459 1HD1 ILE 873 1HD1 ILE 873 8.291 13.561 -1.712 460 2HD1 ILE 873 2HD1 ILE 873 8.131 11.822 -1.491 461 3HD1 ILE 873 3HD1 ILE 873 9.074 12.458 -2.837 462 HA ALA 874 HA ALA 874 10.902 14.293 -4.646 463 1HB ALA 874 1HB ALA 874 10.690 11.790 -6.326 464 2HB ALA 874 3HB ALA 874 11.047 11.857 -4.600 465 3HB ALA 874 2HB ALA 874 12.208 12.484 -5.765 466 HA MET 875 HA MET 875 10.671 15.523 -9.103 467 1HB MET 875 1HB MET 875 8.623 13.658 -9.466 468 2HB MET 875 2HB MET 875 7.848 15.185 -9.884 469 1HG MET 875 1HG MET 875 10.169 15.527 -11.198 470 2HG MET 875 2HG MET 875 8.780 14.727 -11.933 471 1HE MET 875 1HE MET 875 8.340 12.748 -12.318 472 2HE MET 875 3HE MET 875 9.538 11.570 -12.845 473 3HE MET 875 2HE MET 875 8.806 11.436 -11.240 474 HA CYS 876 HA CYS 876 7.751 18.636 -7.183 475 1HB CYS 876 1HB CYS 876 6.894 18.683 -9.499 476 2HB CYS 876 2HB CYS 876 5.590 17.584 -9.059 477 HG CYS 876 HG CYS 876 5.775 20.569 -8.193 478 HA ALA 877 HA ALA 877 4.638 15.656 -4.978 479 1HB ALA 877 3HB ALA 877 4.653 17.706 -3.957 480 2HB ALA 877 1HB ALA 877 3.814 18.493 -5.296 481 3HB ALA 877 2HB ALA 877 2.918 17.473 -4.169 482 HA PRO 878 HA PRO 878 0.968 14.909 -7.983 483 1HB PRO 878 1HB PRO 878 1.943 12.228 -8.290 484 2HB PRO 878 2HB PRO 878 1.802 13.470 -9.538 485 1HG PRO 878 1HG PRO 878 4.188 12.449 -8.311 486 2HG PRO 878 2HG PRO 878 4.054 13.638 -9.600 487 1HD PRO 878 1HD PRO 878 4.832 14.097 -6.884 488 2HD PRO 878 2HD PRO 878 4.604 15.300 -8.168 489 HA VAL 879 HA VAL 879 1.224 11.496 -4.315 490 HB VAL 879 HB VAL 879 2.834 13.811 -3.273 491 1HG1 VAL 879 1HG1 VAL 879 1.179 13.065 -1.469 492 2HG1 VAL 879 2HG1 VAL 879 2.078 11.554 -1.441 493 3HG1 VAL 879 3HG1 VAL 879 2.878 13.067 -1.050 494 1HG2 VAL 879 1HG2 VAL 879 3.564 11.511 -4.510 495 2HG2 VAL 879 2HG2 VAL 879 4.603 12.368 -3.390 496 3HG2 VAL 879 3HG2 VAL 879 3.658 11.003 -2.828 497 HA MET 880 HA MET 880 -2.423 13.567 -2.948 498 1HB MET 880 1HB MET 880 -2.085 10.978 -1.909 499 2HB MET 880 2HB MET 880 -2.786 11.916 -0.590 500 1HG MET 880 1HG MET 880 -4.524 12.752 -2.206 501 2HG MET 880 2HG MET 880 -4.602 11.013 -1.919 502 1HE MET 880 1HE MET 880 -5.527 13.142 -3.903 503 2HE MET 880 2HE MET 880 -4.323 13.632 -5.091 504 3HE MET 880 3HE MET 880 -5.526 12.402 -5.503 505 HA VAL 881 HA VAL 881 -1.138 16.119 0.473 506 HB VAL 881 HB VAL 881 0.822 15.670 2.029 507 1HG1 VAL 881 1HG1 VAL 881 -1.452 13.933 1.457 508 2HG1 VAL 881 2HG1 VAL 881 -0.122 13.027 2.172 509 3HG1 VAL 881 3HG1 VAL 881 -0.792 14.425 3.013 510 1HG2 VAL 881 1HG2 VAL 881 2.038 14.528 -0.067 511 2HG2 VAL 881 2HG2 VAL 881 2.400 14.052 1.593 512 3HG2 VAL 881 3HG2 VAL 881 1.293 13.084 0.619 513 HA GLU 882 HA GLU 882 2.093 18.493 -1.528 514 1HB GLU 882 1HB GLU 882 1.233 20.825 -1.359 515 2HB GLU 882 2HB GLU 882 -0.052 19.644 -1.612 516 1HG GLU 882 1HG GLU 882 -0.999 20.077 0.402 517 2HG GLU 882 2HG GLU 882 0.560 20.095 1.226 518 HA LEU 883 HA LEU 883 4.554 19.239 2.401 519 1HB LEU 883 1HB LEU 883 5.441 17.018 1.848 520 2HB LEU 883 2HB LEU 883 6.246 17.671 0.424 521 HG LEU 883 HG LEU 883 7.531 19.211 1.943 522 1HD1 LEU 883 1HD1 LEU 883 6.016 17.601 3.994 523 2HD1 LEU 883 2HD1 LEU 883 7.569 18.338 4.385 524 3HD1 LEU 883 3HD1 LEU 883 6.211 19.350 3.896 525 1HD2 LEU 883 1HD2 LEU 883 7.726 16.209 2.154 526 2HD2 LEU 883 2HD2 LEU 883 8.754 17.321 1.248 527 3HD2 LEU 883 3HD2 LEU 883 8.874 17.244 3.006 528 HA GLU 884 HA GLU 884 6.540 22.265 -0.532 529 1HB GLU 884 1HB GLU 884 8.476 20.867 1.016 530 2HB GLU 884 2HB GLU 884 9.320 21.581 -0.356 531 1HG GLU 884 1HG GLU 884 8.709 23.763 0.232 532 2HG GLU 884 2HG GLU 884 7.337 23.221 1.199 533 1HA GLY 885 1HA GLY 885 6.950 19.564 -4.658 534 2HA GLY 885 2HA GLY 885 8.293 20.689 -4.443 535 HA GLU 886 HA GLU 886 9.920 16.395 -2.418 536 1HB GLU 886 1HB GLU 886 10.503 16.550 -4.720 537 2HB GLU 886 2HB GLU 886 11.386 18.054 -4.477 538 1HG GLU 886 1HG GLU 886 13.024 16.763 -3.053 539 2HG GLU 886 2HG GLU 886 12.192 15.288 -3.538 540 HA THR 887 HA THR 887 13.486 17.666 -0.013 541 HB THR 887 HB THR 887 10.862 18.028 1.482 542 HG1 THR 887 HG1 THR 887 10.944 19.625 0.100 543 1HG2 THR 887 1HG2 THR 887 13.693 18.461 2.376 544 2HG2 THR 887 2HG2 THR 887 12.449 19.592 2.909 545 3HG2 THR 887 3HG2 THR 887 12.307 17.878 3.297 546 HA ASP 888 HA ASP 888 12.648 14.201 2.997 547 1HB ASP 888 1HB ASP 888 10.228 15.193 3.341 548 2HB ASP 888 2HB ASP 888 9.757 13.677 2.578 549 HA PRO 889 HA PRO 889 12.990 10.928 0.003 550 1HB PRO 889 1HB PRO 889 13.349 8.952 2.060 551 2HB PRO 889 2HB PRO 889 14.590 9.730 1.074 552 1HG PRO 889 1HG PRO 889 14.131 10.102 3.853 553 2HG PRO 889 2HG PRO 889 15.264 10.991 2.831 554 1HD PRO 889 1HD PRO 889 13.978 12.849 3.130 555 2HD PRO 889 2HD PRO 889 12.714 11.895 3.948 556 HA LEU 890 HA LEU 890 8.647 9.611 0.913 557 1HB LEU 890 1HB LEU 890 8.538 7.561 2.221 558 2HB LEU 890 2HB LEU 890 10.183 7.775 1.651 559 HG LEU 890 HG LEU 890 10.331 7.074 3.936 560 1HD1 LEU 890 1HD1 LEU 890 11.771 9.048 3.228 561 2HD1 LEU 890 2HD1 LEU 890 10.638 10.071 4.107 562 3HD1 LEU 890 3HD1 LEU 890 11.554 8.833 4.962 563 1HD2 LEU 890 1HD2 LEU 890 7.858 8.057 4.294 564 2HD2 LEU 890 2HD2 LEU 890 8.943 7.714 5.640 565 3HD2 LEU 890 3HD2 LEU 890 8.782 9.362 5.037 566 HA LEU 891 HA LEU 891 7.450 11.578 5.360 567 1HB LEU 891 1HB LEU 891 8.420 13.672 5.364 568 2HB LEU 891 2HB LEU 891 8.338 13.794 3.618 569 HG LEU 891 HG LEU 891 6.909 15.444 4.881 570 1HD1 LEU 891 1HD1 LEU 891 6.417 14.264 2.470 571 2HD1 LEU 891 2HD1 LEU 891 4.905 13.943 3.323 572 3HD1 LEU 891 3HD1 LEU 891 5.476 15.596 3.130 573 1HD2 LEU 891 1HD2 LEU 891 6.093 13.151 6.259 574 2HD2 LEU 891 2HD2 LEU 891 5.408 14.768 6.414 575 3HD2 LEU 891 3HD2 LEU 891 4.698 13.616 5.285 576 HA ILE 892 HA ILE 892 4.022 12.664 2.137 577 HB ILE 892 HB ILE 892 6.321 12.382 0.325 578 1HG1 ILE 892 1HG1 ILE 892 3.984 13.950 -0.471 579 2HG1 ILE 892 2HG1 ILE 892 4.607 14.355 1.128 580 1HG2 ILE 892 1HG2 ILE 892 3.652 11.248 -0.378 581 2HG2 ILE 892 2HG2 ILE 892 4.547 12.142 -1.594 582 3HG2 ILE 892 3HG2 ILE 892 5.265 10.718 -0.860 583 1HD1 ILE 892 1HD1 ILE 892 6.523 13.933 -1.101 584 2HD1 ILE 892 2HD1 ILE 892 5.643 15.454 -1.028 585 3HD1 ILE 892 3HD1 ILE 892 6.674 14.961 0.317 586 HA ALA 893 HA ALA 893 4.064 8.147 0.683 587 1HB ALA 893 3HB ALA 893 6.031 7.404 -0.191 588 2HB ALA 893 1HB ALA 893 6.984 8.089 1.120 589 3HB ALA 893 2HB ALA 893 6.141 6.564 1.350 590 HA MET 894 HA MET 894 4.503 7.100 5.291 591 1HB MET 894 1HB MET 894 6.616 8.051 5.897 592 2HB MET 894 2HB MET 894 6.056 9.688 5.571 593 1HG MET 894 1HG MET 894 4.563 9.589 7.519 594 2HG MET 894 2HG MET 894 5.062 7.926 7.834 595 1HE MET 894 2HE MET 894 6.223 11.196 6.804 596 2HE MET 894 1HE MET 894 6.867 11.888 8.289 597 3HE MET 894 3HE MET 894 7.963 11.155 7.123 598 HA LYS 895 HA LYS 895 1.831 10.957 6.598 599 1HB LYS 895 1HB LYS 895 3.029 12.866 5.840 600 2HB LYS 895 2HB LYS 895 2.980 12.330 4.162 601 1HG LYS 895 1HG LYS 895 0.990 13.323 3.805 602 2HG LYS 895 2HG LYS 895 0.304 12.649 5.283 603 1HD LYS 895 1HD LYS 895 1.197 14.424 6.619 604 2HD LYS 895 2HD LYS 895 2.222 14.990 5.299 605 1HE LYS 895 1HE LYS 895 0.295 15.734 4.029 606 2HE LYS 895 2HE LYS 895 -0.815 14.993 5.199 607 1HZ LYS 895 1HZ LYS 895 0.261 16.388 6.930 608 2HZ LYS 895 2HZ LYS 895 1.108 17.199 5.706 609 3HZ LYS 895 3HZ LYS 895 -0.587 17.288 5.766 610 HA GLU 896 HA GLU 896 -0.584 10.094 2.426 611 1HB GLU 896 1HB GLU 896 1.936 8.705 1.538 612 2HB GLU 896 2HB GLU 896 0.398 8.229 0.837 613 1HG GLU 896 1HG GLU 896 1.467 9.974 -0.531 614 2HG GLU 896 2HG GLU 896 1.505 11.048 0.866 615 HA LEU 897 HA LEU 897 -0.901 5.652 3.852 616 1HB LEU 897 1HB LEU 897 1.382 4.749 3.546 617 2HB LEU 897 2HB LEU 897 1.861 5.444 5.092 618 HG LEU 897 HG LEU 897 0.960 2.875 4.781 619 1HD1 LEU 897 1HD1 LEU 897 1.055 4.809 7.058 620 2HD1 LEU 897 2HD1 LEU 897 0.319 3.231 7.335 621 3HD1 LEU 897 3HD1 LEU 897 1.994 3.339 6.793 622 1HD2 LEU 897 1HD2 LEU 897 -1.364 4.034 4.292 623 2HD2 LEU 897 2HD2 LEU 897 -1.299 2.639 5.359 624 3HD2 LEU 897 3HD2 LEU 897 -1.402 4.253 6.040 625 HA LYS 898 HA LYS 898 -0.121 6.994 8.557 626 1HB LYS 898 1HB LYS 898 1.873 8.375 8.125 627 2HB LYS 898 2HB LYS 898 0.869 9.539 7.264 628 1HG LYS 898 1HG LYS 898 -0.166 10.304 9.204 629 2HG LYS 898 2HG LYS 898 0.194 8.828 10.100 630 1HD LYS 898 1HD LYS 898 2.530 10.393 9.130 631 2HD LYS 898 2HD LYS 898 1.594 11.107 10.444 632 1HE LYS 898 1HE LYS 898 2.452 8.214 10.580 633 2HE LYS 898 2HE LYS 898 3.543 9.515 11.098 634 1HZ LYS 898 3HZ LYS 898 1.763 10.390 12.496 635 2HZ LYS 898 1HZ LYS 898 0.754 9.101 12.040 636 3HZ LYS 898 2HZ LYS 898 2.158 8.798 12.941 637 HA ALA 899 HA ALA 899 -3.397 10.076 7.129 638 1HB ALA 899 2HB ALA 899 -3.743 10.907 4.754 639 2HB ALA 899 3HB ALA 899 -2.146 11.268 5.409 640 3HB ALA 899 1HB ALA 899 -2.352 9.934 4.275 641 HA ARG 900 HA ARG 900 -3.927 5.416 4.566 642 1HB ARG 900 1HB ARG 900 -4.763 6.253 7.106 643 2HB ARG 900 2HB ARG 900 -5.178 4.721 6.350 644 1HG ARG 900 1HG ARG 900 -6.812 7.212 5.848 645 2HG ARG 900 2HG ARG 900 -7.271 5.529 5.593 646 1HD ARG 900 1HD ARG 900 -7.000 5.224 8.131 647 2HD ARG 900 2HD ARG 900 -8.370 6.231 7.622 648 HE ARG 900 HE ARG 900 -5.894 7.745 7.993 649 1HH1 ARG 900 1HH1 ARG 900 -7.535 5.910 10.216 650 2HH1 ARG 900 2HH1 ARG 900 -8.040 7.227 11.222 651 1HH2 ARG 900 1HH2 ARG 900 -7.038 9.673 8.978 652 2HH2 ARG 900 2HH2 ARG 900 -7.759 9.357 10.520 653 HA LYS 901 HA LYS 901 -6.767 8.115 2.317 654 1HB LYS 901 1HB LYS 901 -5.877 10.160 3.405 655 2HB LYS 901 2HB LYS 901 -4.568 10.188 2.223 656 1HG LYS 901 1HG LYS 901 -6.943 9.960 0.717 657 2HG LYS 901 2HG LYS 901 -7.279 11.169 1.956 658 1HD LYS 901 1HD LYS 901 -5.102 12.287 1.336 659 2HD LYS 901 2HD LYS 901 -4.991 11.174 -0.026 660 1HE LYS 901 1HE LYS 901 -7.428 12.022 -0.566 661 2HE LYS 901 2HE LYS 901 -6.050 13.058 -0.984 662 1HZ LYS 901 1HZ LYS 901 -6.271 14.069 1.249 663 2HZ LYS 901 2HZ LYS 901 -7.644 14.329 0.282 664 3HZ LYS 901 3HZ LYS 901 -7.681 13.156 1.506 665 HA ILE 902 HA ILE 902 -2.998 7.796 -1.048 666 HB ILE 902 HB ILE 902 -2.063 5.452 -1.123 667 1HG1 ILE 902 1HG1 ILE 902 -4.126 4.979 0.736 668 2HG1 ILE 902 2HG1 ILE 902 -2.873 3.846 0.241 669 1HG2 ILE 902 1HG2 ILE 902 -1.613 7.154 1.338 670 2HG2 ILE 902 2HG2 ILE 902 -0.563 5.819 0.859 671 3HG2 ILE 902 3HG2 ILE 902 -0.737 7.226 -0.190 672 1HD1 ILE 902 3HD1 ILE 902 -2.545 5.846 2.497 673 2HD1 ILE 902 1HD1 ILE 902 -3.022 4.165 2.730 674 3HD1 ILE 902 2HD1 ILE 902 -1.435 4.547 2.063 675 HA PRO 903 HA PRO 903 -6.811 5.934 -2.863 676 1HB PRO 903 1HB PRO 903 -6.835 8.123 -4.727 677 2HB PRO 903 2HB PRO 903 -7.913 7.882 -3.347 678 1HG PRO 903 1HG PRO 903 -6.038 9.944 -3.587 679 2HG PRO 903 2HG PRO 903 -6.802 9.427 -2.077 680 1HD PRO 903 1HD PRO 903 -4.619 8.977 -1.420 681 2HD PRO 903 2HD PRO 903 -4.053 8.819 -3.104 682 HA ILE 904 HA ILE 904 -4.862 4.840 -6.660 683 HB ILE 904 HB ILE 904 -2.788 5.443 -4.787 684 1HG1 ILE 904 1HG1 ILE 904 -2.235 5.617 -7.675 685 2HG1 ILE 904 2HG1 ILE 904 -3.760 6.352 -7.188 686 1HG2 ILE 904 1HG2 ILE 904 -2.180 3.296 -6.825 687 2HG2 ILE 904 2HG2 ILE 904 -0.941 4.343 -6.139 688 3HG2 ILE 904 3HG2 ILE 904 -1.862 3.266 -5.092 689 1HD1 ILE 904 2HD1 ILE 904 -2.226 7.344 -5.237 690 2HD1 ILE 904 3HD1 ILE 904 -0.969 7.117 -6.453 691 3HD1 ILE 904 1HD1 ILE 904 -2.359 8.144 -6.803 692 HA ILE 905 HA ILE 905 -5.082 0.480 -6.835 693 HB ILE 905 HB ILE 905 -6.171 1.415 -8.867 694 1HG1 ILE 905 1HG1 ILE 905 -4.777 -0.651 -10.280 695 2HG1 ILE 905 2HG1 ILE 905 -4.910 -1.135 -8.589 696 1HG2 ILE 905 1HG2 ILE 905 -3.364 1.286 -10.018 697 2HG2 ILE 905 2HG2 ILE 905 -4.826 1.643 -10.937 698 3HG2 ILE 905 3HG2 ILE 905 -4.275 2.756 -9.690 699 1HD1 ILE 905 1HD1 ILE 905 -7.282 -0.008 -10.050 700 2HD1 ILE 905 2HD1 ILE 905 -6.870 -1.716 -10.187 701 3HD1 ILE 905 3HD1 ILE 905 -7.254 -1.021 -8.609 702 HA ILE 906 HA ILE 906 -0.801 -0.588 -7.928 703 HB ILE 906 HB ILE 906 -1.861 -1.639 -5.334 704 1HG1 ILE 906 1HG1 ILE 906 0.458 0.078 -6.209 705 2HG1 ILE 906 2HG1 ILE 906 0.180 -0.381 -4.531 706 1HG2 ILE 906 1HG2 ILE 906 0.619 -2.644 -6.715 707 2HG2 ILE 906 2HG2 ILE 906 0.570 -2.525 -4.959 708 3HG2 ILE 906 3HG2 ILE 906 -0.583 -3.557 -5.804 709 1HD1 ILE 906 1HD1 ILE 906 -2.298 0.546 -5.311 710 2HD1 ILE 906 2HD1 ILE 906 -1.095 1.493 -4.434 711 3HD1 ILE 906 3HD1 ILE 906 -1.200 1.611 -6.189 712 HA ARG 907 HA ARG 907 -1.438 -4.703 -9.532 713 1HB ARG 907 1HB ARG 907 1.112 -3.557 -10.631 714 2HB ARG 907 2HB ARG 907 0.458 -5.091 -11.195 715 1HG ARG 907 1HG ARG 907 -0.330 -3.275 -12.638 716 2HG ARG 907 2HG ARG 907 -1.671 -3.976 -11.744 717 1HD ARG 907 1HD ARG 907 -2.031 -2.063 -10.511 718 2HD ARG 907 2HD ARG 907 -0.306 -1.648 -10.467 719 HE ARG 907 HE ARG 907 -0.627 -0.427 -12.459 720 1HH1 ARG 907 1HH1 ARG 907 -3.612 -1.609 -11.578 721 2HH1 ARG 907 2HH1 ARG 907 -4.275 -1.656 -13.176 722 1HH2 ARG 907 1HH2 ARG 907 -1.253 -0.993 -14.739 723 2HH2 ARG 907 2HH2 ARG 907 -2.940 -1.306 -14.966 724 HA ARG 908 HA ARG 908 1.437 -6.853 -6.914 725 1HB ARG 908 1HB ARG 908 -0.581 -8.726 -6.037 726 2HB ARG 908 2HB ARG 908 0.338 -7.581 -5.084 727 1HG ARG 908 1HG ARG 908 -1.313 -5.826 -5.561 728 2HG ARG 908 2HG ARG 908 -2.223 -6.939 -6.580 729 1HD ARG 908 1HD ARG 908 -3.166 -6.764 -4.218 730 2HD ARG 908 2HD ARG 908 -2.662 -8.410 -4.648 731 HE ARG 908 HE ARG 908 -0.492 -6.878 -3.466 732 1HH1 ARG 908 1HH1 ARG 908 -3.517 -7.842 -2.331 733 2HH1 ARG 908 2HH1 ARG 908 -2.909 -8.799 -1.020 734 1HH2 ARG 908 1HH2 ARG 908 0.403 -8.525 -2.001 735 2HH2 ARG 908 2HH2 ARG 908 -0.693 -9.186 -0.837 736 HA TYR 909 HA TYR 909 1.220 -10.102 -10.020 737 1HB TYR 909 1HB TYR 909 4.122 -9.466 -10.295 738 2HB TYR 909 2HB TYR 909 2.989 -10.001 -11.516 739 HD1 TYR 909 HD1 TYR 909 4.118 -7.009 -9.576 740 HD2 TYR 909 HD2 TYR 909 1.790 -8.443 -12.871 741 HE1 TYR 909 HE1 TYR 909 3.942 -4.722 -10.430 742 HE2 TYR 909 HE2 TYR 909 1.596 -6.153 -13.726 743 HH TYR 909 HH TYR 909 3.063 -3.975 -13.499 744 HA LEU 910 HA LEU 910 3.914 -12.419 -7.263 745 1HB LEU 910 1HB LEU 910 1.807 -14.206 -8.490 746 2HB LEU 910 2HB LEU 910 2.569 -14.470 -6.918 747 HG LEU 910 HG LEU 910 0.834 -12.118 -7.741 748 1HD1 LEU 910 3HD1 LEU 910 -0.368 -14.223 -7.264 749 2HD1 LEU 910 1HD1 LEU 910 0.416 -14.306 -5.688 750 3HD1 LEU 910 2HD1 LEU 910 -0.704 -12.992 -6.050 751 1HD2 LEU 910 1HD2 LEU 910 2.882 -12.216 -5.784 752 2HD2 LEU 910 2HD2 LEU 910 1.667 -10.959 -6.009 753 3HD2 LEU 910 3HD2 LEU 910 1.354 -12.303 -4.914 754 HA PRO 911 HA PRO 911 6.876 -14.364 -10.053 755 1HB PRO 911 1HB PRO 911 8.556 -14.687 -7.738 756 2HB PRO 911 2HB PRO 911 8.752 -13.527 -9.056 757 1HG PRO 911 1HG PRO 911 7.956 -12.995 -6.353 758 2HG PRO 911 2HG PRO 911 8.142 -11.844 -7.676 759 1HD PRO 911 1HD PRO 911 5.871 -11.605 -7.791 760 2HD PRO 911 2HD PRO 911 5.686 -12.782 -6.472 761 HA ASP 912 HA ASP 912 6.160 -17.980 -6.883 762 1HB ASP 912 1HB ASP 912 3.906 -16.242 -6.024 763 2HB ASP 912 2HB ASP 912 3.597 -17.977 -5.949 764 1HA GLY 913 1HA GLY 913 3.529 -17.866 -11.087 765 2HA GLY 913 2HA GLY 913 2.954 -19.118 -9.987 766 HA SER 914 HA SER 914 -0.354 -15.869 -11.165 767 1HB SER 914 1HB SER 914 0.153 -15.836 -8.197 768 2HB SER 914 2HB SER 914 -1.302 -15.096 -8.857 769 HG SER 914 HG SER 914 -0.985 -17.593 -8.298 770 HA TYR 915 HA TYR 915 0.082 -11.407 -9.576 771 1HB TYR 915 1HB TYR 915 1.504 -11.366 -11.378 772 2HB TYR 915 2HB TYR 915 0.480 -12.441 -12.319 773 HD1 TYR 915 HD1 TYR 915 -0.099 -8.993 -10.877 774 HD2 TYR 915 HD2 TYR 915 0.010 -11.483 -14.380 775 HE1 TYR 915 HE1 TYR 915 -0.844 -7.083 -12.265 776 HE2 TYR 915 HE2 TYR 915 -0.736 -9.571 -15.761 777 HH TYR 915 HH TYR 915 -1.902 -7.465 -15.504 778 HA GLU 916 HA GLU 916 -3.624 -9.418 -11.361 779 1HB GLU 916 1HB GLU 916 -4.706 -10.936 -9.949 780 2HB GLU 916 2HB GLU 916 -4.014 -10.218 -8.508 781 1HG GLU 916 1HG GLU 916 -5.344 -8.172 -8.894 782 2HG GLU 916 2HG GLU 916 -6.374 -9.578 -8.701 783 HA ASP 917 HA ASP 917 -3.064 -5.273 -9.962 784 1HB ASP 917 1HB ASP 917 -2.998 -5.245 -12.380 785 2HB ASP 917 2HB ASP 917 -3.854 -3.842 -11.778 786 HA TRP 918 HA TRP 918 -6.417 -2.543 -8.716 787 1HB TRP 918 1HB TRP 918 -7.889 -3.874 -7.204 788 2HB TRP 918 2HB TRP 918 -7.834 -4.418 -8.856 789 HD1 TRP 918 HD1 TRP 918 -4.804 -5.970 -7.734 790 HE1 TRP 918 HE1 TRP 918 -5.296 -8.404 -6.957 791 HE3 TRP 918 HE3 TRP 918 -9.719 -5.530 -6.884 792 HZ2 TRP 918 HZ2 TRP 918 -7.574 -9.874 -5.913 793 HZ3 TRP 918 HZ3 TRP 918 -11.046 -7.332 -5.916 794 HH2 TRP 918 HH2 TRP 918 -9.996 -9.550 -5.438 795 1HA GLY 919 1HA GLY 919 -4.918 -2.562 -4.419 796 2HA GLY 919 2HA GLY 919 -4.726 -0.964 -5.116 797 HA VAL 920 HA VAL 920 -7.906 -0.028 -2.265 798 HB VAL 920 HB VAL 920 -6.899 2.576 -3.469 799 1HG1 VAL 920 1HG1 VAL 920 -8.570 1.915 -1.065 800 2HG1 VAL 920 2HG1 VAL 920 -7.436 3.264 -0.970 801 3HG1 VAL 920 3HG1 VAL 920 -8.714 3.271 -2.184 802 1HG2 VAL 920 1HG2 VAL 920 -5.827 0.591 -1.533 803 2HG2 VAL 920 2HG2 VAL 920 -4.965 1.666 -2.635 804 3HG2 VAL 920 3HG2 VAL 920 -5.606 2.289 -1.115 805 HA ASP 921 HA ASP 921 -10.817 1.762 -5.423 806 1HB ASP 921 1HB ASP 921 -9.236 2.141 -7.293 807 2HB ASP 921 2HB ASP 921 -9.345 0.431 -7.716 808 HA GLU 922 HA GLU 922 -12.369 -2.501 -5.634 809 1HB GLU 922 1HB GLU 922 -10.579 -2.740 -7.498 810 2HB GLU 922 2HB GLU 922 -9.816 -3.887 -6.399 811 1HG GLU 922 1HG GLU 922 -11.660 -5.369 -6.463 812 2HG GLU 922 2HG GLU 922 -12.751 -4.123 -7.067 813 HA LEU 923 HA LEU 923 -10.593 -4.051 -1.729 814 1HB LEU 923 1HB LEU 923 -8.198 -5.070 -1.610 815 2HB LEU 923 2HB LEU 923 -9.296 -5.596 -2.864 816 HG LEU 923 HG LEU 923 -7.938 -3.323 -3.879 817 1HD1 LEU 923 1HD1 LEU 923 -6.092 -5.414 -2.698 818 2HD1 LEU 923 2HD1 LEU 923 -5.612 -4.164 -3.843 819 3HD1 LEU 923 3HD1 LEU 923 -6.162 -3.719 -2.231 820 1HD2 LEU 923 1HD2 LEU 923 -8.464 -6.107 -4.411 821 2HD2 LEU 923 2HD2 LEU 923 -8.314 -4.743 -5.521 822 3HD2 LEU 923 3HD2 LEU 923 -6.874 -5.609 -4.993 823 HA ILE 924 HA ILE 924 -8.396 -1.827 1.359 824 HB ILE 924 HB ILE 924 -7.065 -4.444 1.306 825 1HG1 ILE 924 1HG1 ILE 924 -7.783 -4.096 3.791 826 2HG1 ILE 924 2HG1 ILE 924 -8.647 -2.708 3.134 827 1HG2 ILE 924 1HG2 ILE 924 -5.062 -3.043 1.701 828 2HG2 ILE 924 2HG2 ILE 924 -5.884 -2.292 3.067 829 3HG2 ILE 924 3HG2 ILE 924 -5.499 -4.009 3.103 830 1HD1 ILE 924 3HD1 ILE 924 -8.832 -5.482 1.963 831 2HD1 ILE 924 1HD1 ILE 924 -9.992 -4.836 3.123 832 3HD1 ILE 924 2HD1 ILE 924 -9.808 -4.076 1.543 833 HA ILE 925 HA ILE 925 -4.773 0.391 0.084 834 HB ILE 925 HB ILE 925 -4.447 2.159 1.830 835 1HG1 ILE 925 1HG1 ILE 925 -6.696 1.130 3.454 836 2HG1 ILE 925 2HG1 ILE 925 -5.205 0.201 3.596 837 1HG2 ILE 925 1HG2 ILE 925 -6.806 1.545 0.349 838 2HG2 ILE 925 2HG2 ILE 925 -7.311 2.197 1.907 839 3HG2 ILE 925 3HG2 ILE 925 -6.231 3.129 0.871 840 1HD1 ILE 925 2HD1 ILE 925 -4.163 2.672 3.769 841 2HD1 ILE 925 3HD1 ILE 925 -5.773 3.010 4.408 842 3HD1 ILE 925 1HD1 ILE 925 -4.751 1.801 5.185 843 HA THR 926 HA THR 926 -1.075 -0.780 2.403 844 HB THR 926 HB THR 926 -1.838 0.817 4.860 845 HG1 THR 926 HG1 THR 926 -1.813 2.298 3.317 846 1HG2 THR 926 1HG2 THR 926 0.832 -0.116 3.777 847 2HG2 THR 926 2HG2 THR 926 0.623 0.944 5.169 848 3HG2 THR 926 3HG2 THR 926 0.028 -0.715 5.225 849 HA ASP 927 HA ASP 927 -3.809 -3.667 4.914 850 1HB ASP 927 1HB ASP 927 -2.018 -2.153 6.451 851 2HB ASP 927 2HB ASP 927 -3.371 -2.458 7.541 No H/Q in entry = 851 Start of MODEL 12 1 HA MET 801 HA MET 801 -0.330 -24.412 42.318 2 1HB MET 801 1HB MET 801 -2.216 -23.029 41.428 3 2HB MET 801 2HB MET 801 -2.542 -23.655 43.044 4 1HG MET 801 1HG MET 801 -2.361 -21.579 44.038 5 2HG MET 801 2HG MET 801 -1.221 -20.982 42.832 6 1HE MET 801 3HE MET 801 -3.182 -18.983 43.654 7 2HE MET 801 1HE MET 801 -4.838 -19.041 43.056 8 3HE MET 801 2HE MET 801 -4.305 -20.205 44.267 9 HA SER 802 HA SER 802 1.272 -20.732 39.985 10 1HB SER 802 1HB SER 802 2.680 -22.983 40.440 11 2HB SER 802 2HB SER 802 2.592 -23.069 38.683 12 HG SER 802 HG SER 802 4.129 -21.512 40.223 13 HA ASP 803 HA ASP 803 -0.895 -21.690 36.059 14 1HB ASP 803 1HB ASP 803 -2.860 -20.011 37.647 15 2HB ASP 803 2HB ASP 803 -3.180 -20.640 36.029 16 HA ASN 804 HA ASN 804 -0.057 -17.494 34.591 17 1HB ASN 804 1HB ASN 804 2.397 -17.109 34.420 18 2HB ASN 804 2HB ASN 804 1.959 -17.868 35.951 19 2HD2 ASN 804 1HD2 ASN 804 2.511 -20.155 36.245 20 1HD2 ASN 804 2HD2 ASN 804 3.629 -20.924 35.228 21 HA GLU 805 HA GLU 805 -0.016 -18.484 30.272 22 1HB GLU 805 1HB GLU 805 -0.661 -15.791 30.894 23 2HB GLU 805 2HB GLU 805 0.405 -15.732 29.489 24 1HG GLU 805 1HG GLU 805 -1.151 -17.720 28.657 25 2HG GLU 805 2HG GLU 805 -1.633 -16.038 28.432 26 HA ASP 806 HA ASP 806 4.445 -18.770 29.764 27 1HB ASP 806 1HB ASP 806 4.836 -20.134 27.744 28 2HB ASP 806 2HB ASP 806 3.562 -20.837 28.738 29 HA ASN 807 HA ASN 807 4.419 -15.411 26.652 30 1HB ASN 807 1HB ASN 807 4.023 -15.705 24.217 31 2HB ASN 807 2HB ASN 807 2.891 -17.011 24.566 32 2HD2 ASN 807 1HD2 ASN 807 3.845 -19.043 24.399 33 1HD2 ASN 807 2HD2 ASN 807 5.481 -19.384 24.696 34 HA PHE 808 HA PHE 808 0.422 -13.314 26.110 35 1HB PHE 808 1HB PHE 808 2.036 -12.074 23.855 36 2HB PHE 808 2HB PHE 808 0.728 -11.266 24.721 37 HD1 PHE 808 HD1 PHE 808 0.940 -11.056 27.284 38 HD2 PHE 808 HD2 PHE 808 4.232 -12.035 24.705 39 HE1 PHE 808 HE1 PHE 808 2.533 -10.376 29.059 40 HE2 PHE 808 HE2 PHE 808 5.825 -11.356 26.479 41 HZ PHE 808 HZ PHE 808 4.975 -10.525 28.656 42 HA ASP 809 HA ASP 809 -1.978 -14.865 22.681 43 1HB ASP 809 1HB ASP 809 0.574 -16.181 21.737 44 2HB ASP 809 2HB ASP 809 -0.909 -16.197 20.780 45 1HA GLY 810 1HA GLY 810 -0.887 -19.654 24.324 46 2HA GLY 810 2HA GLY 810 -2.459 -19.310 23.604 47 HA ASP 811 HA ASP 811 -0.842 -21.600 20.086 48 1HB ASP 811 1HB ASP 811 -0.374 -18.859 18.924 49 2HB ASP 811 2HB ASP 811 -0.147 -20.295 17.926 50 HA ASP 812 HA ASP 812 3.745 -21.363 20.374 51 1HB ASP 812 1HB ASP 812 3.000 -20.864 22.905 52 2HB ASP 812 2HB ASP 812 3.569 -22.520 23.120 53 HA PHE 813 HA PHE 813 3.806 -25.828 19.921 54 1HB PHE 813 1HB PHE 813 1.752 -27.239 20.028 55 2HB PHE 813 2HB PHE 813 1.788 -26.025 21.306 56 HD1 PHE 813 HD1 PHE 813 0.275 -26.955 18.060 57 HD2 PHE 813 HD2 PHE 813 0.229 -24.177 21.336 58 HE1 PHE 813 HE1 PHE 813 -1.886 -26.041 17.255 59 HE2 PHE 813 HE2 PHE 813 -1.932 -23.263 20.531 60 HZ PHE 813 HZ PHE 813 -2.990 -24.195 18.491 61 HA ASP 814 HA ASP 814 3.245 -25.777 15.468 62 1HB ASP 814 1HB ASP 814 0.808 -24.928 16.264 63 2HB ASP 814 2HB ASP 814 1.205 -23.633 15.133 64 HA ASP 815 HA ASP 815 5.167 -21.835 14.188 65 1HB ASP 815 1HB ASP 815 4.312 -20.831 16.452 66 2HB ASP 815 2HB ASP 815 6.000 -20.964 16.950 67 HA VAL 816 HA VAL 816 9.219 -23.682 14.311 68 HB VAL 816 HB VAL 816 9.120 -23.096 16.695 69 1HG1 VAL 816 1HG1 VAL 816 7.228 -24.780 17.135 70 2HG1 VAL 816 2HG1 VAL 816 8.498 -25.997 17.270 71 3HG1 VAL 816 3HG1 VAL 816 8.462 -24.633 18.387 72 1HG2 VAL 816 1HG2 VAL 816 11.080 -24.485 15.543 73 2HG2 VAL 816 2HG2 VAL 816 11.118 -24.117 17.267 74 3HG2 VAL 816 3HG2 VAL 816 10.584 -25.705 16.716 75 HA GLU 817 HA GLU 817 9.384 -28.151 13.853 76 1HB GLU 817 1HB GLU 817 7.395 -27.314 12.574 77 2HB GLU 817 2HB GLU 817 8.461 -26.985 11.207 78 1HG GLU 817 1HG GLU 817 8.742 -29.212 10.710 79 2HG GLU 817 2HG GLU 817 8.599 -29.713 12.397 80 HA GLU 818 HA GLU 818 13.869 -26.415 12.348 81 1HB GLU 818 1HB GLU 818 12.994 -28.925 13.030 82 2HB GLU 818 2HB GLU 818 13.352 -29.137 11.316 83 1HG GLU 818 1HG GLU 818 15.364 -27.652 12.933 84 2HG GLU 818 2HG GLU 818 15.241 -29.389 13.213 85 HA ASP 819 HA ASP 819 13.256 -26.828 7.841 86 1HB ASP 819 1HB ASP 819 13.767 -24.201 9.105 87 2HB ASP 819 2HB ASP 819 14.046 -24.252 7.364 88 HA GLU 820 HA GLU 820 17.473 -25.969 6.112 89 1HB GLU 820 1HB GLU 820 17.064 -28.292 6.945 90 2HB GLU 820 2HB GLU 820 16.362 -28.698 5.378 91 1HG GLU 820 1HG GLU 820 18.546 -27.957 4.324 92 2HG GLU 820 2HG GLU 820 18.658 -29.411 5.317 93 1HA GLY 821 1HA GLY 821 17.599 -25.083 1.802 94 2HA GLY 821 2HA GLY 821 15.841 -25.178 1.923 95 HA LEU 822 HA LEU 822 16.852 -20.658 2.232 96 1HB LEU 822 1HB LEU 822 19.622 -21.441 2.582 97 2HB LEU 822 2HB LEU 822 19.525 -19.953 1.642 98 HG LEU 822 HG LEU 822 19.630 -19.463 4.057 99 1HD1 LEU 822 1HD1 LEU 822 18.104 -18.206 2.309 100 2HD1 LEU 822 2HD1 LEU 822 16.792 -18.879 3.276 101 3HD1 LEU 822 3HD1 LEU 822 17.984 -17.816 4.024 102 1HD2 LEU 822 1HD2 LEU 822 18.365 -21.697 4.567 103 2HD2 LEU 822 2HD2 LEU 822 18.086 -20.305 5.614 104 3HD2 LEU 822 3HD2 LEU 822 16.911 -20.721 4.365 105 HA ASP 823 HA ASP 823 17.934 -20.202 -2.259 106 1HB ASP 823 1HB ASP 823 19.733 -22.577 -2.043 107 2HB ASP 823 2HB ASP 823 19.288 -22.044 -3.664 108 HA ASP 824 HA ASP 824 15.161 -23.663 -3.719 109 1HB ASP 824 1HB ASP 824 15.181 -24.610 -0.881 110 2HB ASP 824 2HB ASP 824 13.853 -25.142 -1.914 111 HA LEU 825 HA LEU 825 11.606 -21.137 -2.739 112 1HB LEU 825 1HB LEU 825 13.376 -20.072 -0.565 113 2HB LEU 825 2HB LEU 825 11.829 -19.275 -0.852 114 HG LEU 825 HG LEU 825 11.190 -21.987 -0.911 115 1HD1 LEU 825 1HD1 LEU 825 13.613 -22.149 0.115 116 2HD1 LEU 825 2HD1 LEU 825 12.812 -21.594 1.585 117 3HD1 LEU 825 3HD1 LEU 825 12.298 -23.095 0.814 118 1HD2 LEU 825 1HD2 LEU 825 10.988 -19.818 1.178 119 2HD2 LEU 825 2HD2 LEU 825 9.721 -20.455 0.130 120 3HD2 LEU 825 3HD2 LEU 825 10.324 -21.425 1.473 121 HA GLU 826 HA GLU 826 13.718 -17.261 -4.642 122 1HB GLU 826 1HB GLU 826 11.285 -17.166 -3.632 123 2HB GLU 826 2HB GLU 826 11.929 -15.810 -2.706 124 1HG GLU 826 1HG GLU 826 12.231 -14.491 -4.580 125 2HG GLU 826 2HG GLU 826 12.467 -15.878 -5.646 126 HA ASN 827 HA ASN 827 16.384 -14.850 -1.911 127 1HB ASN 827 1HB ASN 827 17.618 -17.151 -2.734 128 2HB ASN 827 2HB ASN 827 18.626 -15.931 -3.511 129 2HD2 ASN 827 1HD2 ASN 827 20.426 -16.265 -2.031 130 1HD2 ASN 827 2HD2 ASN 827 20.343 -15.778 -0.406 131 HA ALA 828 HA ALA 828 17.044 -12.479 -5.940 132 1HB ALA 828 1HB ALA 828 14.120 -12.064 -5.280 133 2HB ALA 828 3HB ALA 828 14.813 -12.815 -6.717 134 3HB ALA 828 2HB ALA 828 14.950 -11.074 -6.480 135 HA GLU 829 HA GLU 829 17.015 -8.850 -3.135 136 1HB GLU 829 1HB GLU 829 14.127 -8.248 -3.843 137 2HB GLU 829 2HB GLU 829 15.246 -7.053 -3.184 138 1HG GLU 829 1HG GLU 829 16.805 -7.745 -5.139 139 2HG GLU 829 2HG GLU 829 15.356 -8.457 -5.849 140 HA GLU 830 HA GLU 830 13.478 -11.288 0.029 141 1HB GLU 830 1HB GLU 830 16.110 -11.256 0.209 142 2HB GLU 830 2HB GLU 830 15.829 -9.800 1.165 143 1HG GLU 830 1HG GLU 830 14.419 -11.011 2.714 144 2HG GLU 830 2HG GLU 830 14.467 -12.454 1.700 145 HA GLU 831 HA GLU 831 12.604 -6.860 1.235 146 1HB GLU 831 1HB GLU 831 14.003 -5.814 -0.500 147 2HB GLU 831 2HB GLU 831 12.477 -4.949 -0.331 148 1HG GLU 831 1HG GLU 831 13.343 -6.830 -2.525 149 2HG GLU 831 2HG GLU 831 11.636 -6.499 -2.237 150 1HA GLY 832 1HA GLY 832 8.444 -8.557 0.459 151 2HA GLY 832 2HA GLY 832 8.550 -7.744 -1.103 152 HA GLN 833 HA GLN 833 8.054 -11.900 -2.600 153 1HB GLN 833 1HB GLN 833 7.773 -12.641 -0.249 154 2HB GLN 833 2HB GLN 833 6.705 -13.550 -1.322 155 1HG GLN 833 1HG GLN 833 5.899 -11.087 0.256 156 2HG GLN 833 2HG GLN 833 4.838 -12.072 -0.751 157 2HE2 GLN 833 1HE2 GLN 833 4.193 -11.772 1.973 158 1HE2 GLN 833 2HE2 GLN 833 4.462 -13.238 2.786 159 HA GLU 834 HA GLU 834 4.593 -10.957 -5.171 160 1HB GLU 834 1HB GLU 834 3.472 -10.629 -2.945 161 2HB GLU 834 2HB GLU 834 3.785 -8.899 -3.081 162 1HG GLU 834 1HG GLU 834 2.022 -8.604 -4.455 163 2HG GLU 834 2HG GLU 834 2.525 -9.937 -5.489 164 HA ASN 835 HA ASN 835 6.468 -7.356 -7.155 165 1HB ASN 835 1HB ASN 835 6.399 -7.600 -9.513 166 2HB ASN 835 2HB ASN 835 4.927 -8.561 -9.470 167 2HD2 ASN 835 1HD2 ASN 835 5.641 -10.566 -10.336 168 1HD2 ASN 835 2HD2 ASN 835 6.955 -11.452 -9.730 169 HA VAL 836 HA VAL 836 2.539 -5.414 -7.644 170 HB VAL 836 HB VAL 836 1.971 -4.660 -5.599 171 1HG1 VAL 836 1HG1 VAL 836 4.838 -5.389 -5.013 172 2HG1 VAL 836 2HG1 VAL 836 3.576 -5.188 -3.798 173 3HG1 VAL 836 3HG1 VAL 836 3.455 -6.481 -4.991 174 1HG2 VAL 836 1HG2 VAL 836 4.428 -2.916 -5.781 175 2HG2 VAL 836 2HG2 VAL 836 2.748 -2.419 -5.959 176 3HG2 VAL 836 3HG2 VAL 836 3.360 -2.919 -4.382 177 HA GLU 837 HA GLU 837 3.851 -1.755 -9.745 178 1HB GLU 837 1HB GLU 837 2.389 -3.484 -11.245 179 2HB GLU 837 2HB GLU 837 1.261 -2.137 -11.158 180 1HG GLU 837 1HG GLU 837 3.512 -0.769 -11.708 181 2HG GLU 837 2HG GLU 837 3.922 -2.301 -12.482 182 HA ILE 838 HA ILE 838 0.378 0.642 -8.182 183 HB ILE 838 HB ILE 838 2.975 2.170 -8.440 184 1HG1 ILE 838 1HG1 ILE 838 2.195 -0.018 -6.879 185 2HG1 ILE 838 2HG1 ILE 838 3.634 0.962 -6.656 186 1HG2 ILE 838 1HG2 ILE 838 0.496 2.990 -6.940 187 2HG2 ILE 838 2HG2 ILE 838 2.100 3.582 -6.512 188 3HG2 ILE 838 3HG2 ILE 838 1.431 3.929 -8.105 189 1HD1 ILE 838 1HD1 ILE 838 0.962 1.711 -5.447 190 2HD1 ILE 838 2HD1 ILE 838 2.132 0.696 -4.607 191 3HD1 ILE 838 3HD1 ILE 838 2.555 2.346 -5.049 192 HA LEU 839 HA LEU 839 -0.831 4.198 -10.763 193 1HB LEU 839 1HB LEU 839 -1.742 1.521 -11.325 194 2HB LEU 839 2HB LEU 839 -3.084 2.638 -11.572 195 HG LEU 839 HG LEU 839 -1.074 4.027 -12.763 196 1HD1 LEU 839 1HD1 LEU 839 -0.212 1.225 -12.568 197 2HD1 LEU 839 2HD1 LEU 839 -0.222 1.837 -14.222 198 3HD1 LEU 839 3HD1 LEU 839 0.723 2.661 -12.982 199 1HD2 LEU 839 1HD2 LEU 839 -3.323 3.429 -13.683 200 2HD2 LEU 839 2HD2 LEU 839 -2.035 3.267 -14.877 201 3HD2 LEU 839 3HD2 LEU 839 -2.697 1.832 -14.091 202 HA PRO 840 HA PRO 840 -4.074 6.240 -8.558 203 1HB PRO 840 1HB PRO 840 -4.774 7.775 -10.054 204 2HB PRO 840 2HB PRO 840 -5.879 6.592 -10.762 205 1HG PRO 840 1HG PRO 840 -3.479 7.647 -11.911 206 2HG PRO 840 2HG PRO 840 -4.530 6.397 -12.582 207 1HD PRO 840 1HD PRO 840 -2.870 4.873 -12.222 208 2HD PRO 840 2HD PRO 840 -1.881 6.099 -11.391 209 HA SER 841 HA SER 841 -6.693 2.779 -7.589 210 1HB SER 841 1HB SER 841 -7.317 3.445 -5.528 211 2HB SER 841 2HB SER 841 -7.181 5.141 -5.978 212 HG SER 841 HG SER 841 -9.276 5.145 -5.931 213 1HA GLY 842 1HA GLY 842 -10.530 1.833 -9.657 214 2HA GLY 842 2HA GLY 842 -10.372 3.555 -9.982 215 HA GLU 843 HA GLU 843 -8.701 1.453 -13.662 216 1HB GLU 843 1HB GLU 843 -6.755 0.331 -11.730 217 2HB GLU 843 2HB GLU 843 -6.632 -0.317 -13.366 218 1HG GLU 843 1HG GLU 843 -6.997 2.576 -13.385 219 2HG GLU 843 2HG GLU 843 -5.567 2.107 -12.466 220 HA ARG 844 HA ARG 844 -10.623 -2.737 -13.508 221 1HB ARG 844 1HB ARG 844 -12.631 -0.887 -12.710 222 2HB ARG 844 2HB ARG 844 -13.287 -1.913 -13.987 223 1HG ARG 844 1HG ARG 844 -12.691 -3.920 -12.757 224 2HG ARG 844 2HG ARG 844 -11.859 -2.965 -11.529 225 1HD ARG 844 1HD ARG 844 -14.028 -1.852 -10.967 226 2HD ARG 844 2HD ARG 844 -14.115 -3.610 -10.738 227 HE ARG 844 HE ARG 844 -14.829 -3.063 -13.431 228 1HH1 ARG 844 1HH1 ARG 844 -15.940 -1.151 -10.970 229 2HH1 ARG 844 2HH1 ARG 844 -17.603 -1.626 -11.083 230 1HH2 ARG 844 1HH2 ARG 844 -16.980 -4.242 -13.273 231 2HH2 ARG 844 2HH2 ARG 844 -18.191 -3.377 -12.387 232 HA PRO 845 HA PRO 845 -12.534 -1.769 -17.837 233 1HB PRO 845 1HB PRO 845 -12.065 1.022 -18.366 234 2HB PRO 845 2HB PRO 845 -13.616 0.197 -18.181 235 1HG PRO 845 1HG PRO 845 -12.429 2.055 -16.377 236 2HG PRO 845 2HG PRO 845 -13.916 1.132 -16.140 237 1HD PRO 845 1HD PRO 845 -12.853 -0.063 -14.498 238 2HD PRO 845 2HD PRO 845 -11.306 0.726 -14.879 239 HA GLN 846 HA GLN 846 -8.532 -1.866 -19.721 240 1HB GLN 846 1HB GLN 846 -8.118 0.058 -18.233 241 2HB GLN 846 2HB GLN 846 -7.554 -1.040 -16.973 242 1HG GLN 846 1HG GLN 846 -5.578 -1.530 -18.090 243 2HG GLN 846 2HG GLN 846 -6.265 -1.171 -19.675 244 2HE2 GLN 846 1HE2 GLN 846 -4.801 0.282 -16.798 245 1HE2 GLN 846 2HE2 GLN 846 -4.596 1.829 -17.467 246 HA ALA 847 HA ALA 847 -7.153 -5.768 -17.739 247 1HB ALA 847 1HB ALA 847 -6.205 -4.261 -15.279 248 2HB ALA 847 3HB ALA 847 -5.410 -4.235 -16.852 249 3HB ALA 847 2HB ALA 847 -5.483 -5.734 -15.925 250 HA ASN 848 HA ASN 848 -10.507 -6.266 -14.322 251 1HB ASN 848 1HB ASN 848 -11.876 -5.793 -16.570 252 2HB ASN 848 2HB ASN 848 -11.921 -7.555 -16.625 253 2HD2 ASN 848 1HD2 ASN 848 -14.309 -7.354 -16.202 254 1HD2 ASN 848 2HD2 ASN 848 -14.849 -7.089 -14.615 255 HA GLN 849 HA GLN 849 -9.344 -10.577 -14.496 256 1HB GLN 849 1HB GLN 849 -6.801 -10.788 -14.098 257 2HB GLN 849 2HB GLN 849 -7.315 -9.858 -15.500 258 1HG GLN 849 1HG GLN 849 -7.242 -8.001 -13.400 259 2HG GLN 849 2HG GLN 849 -6.085 -8.150 -14.715 260 2HE2 GLN 849 1HE2 GLN 849 -4.234 -7.636 -13.425 261 1HE2 GLN 849 2HE2 GLN 849 -3.685 -8.626 -12.165 262 HA LYS 850 HA LYS 850 -7.500 -11.058 -9.987 263 1HB LYS 850 1HB LYS 850 -9.347 -12.595 -9.270 264 2HB LYS 850 2HB LYS 850 -9.946 -11.224 -10.196 265 1HG LYS 850 1HG LYS 850 -9.563 -12.903 -12.238 266 2HG LYS 850 2HG LYS 850 -11.051 -12.936 -11.292 267 1HD LYS 850 1HD LYS 850 -8.795 -14.874 -11.358 268 2HD LYS 850 2HD LYS 850 -9.517 -14.568 -9.777 269 1HE LYS 850 1HE LYS 850 -11.749 -14.827 -11.391 270 2HE LYS 850 2HE LYS 850 -10.633 -16.027 -12.074 271 1HZ LYS 850 1HZ LYS 850 -11.086 -15.719 -9.159 272 2HZ LYS 850 2HZ LYS 850 -11.970 -16.811 -10.113 273 3HZ LYS 850 3HZ LYS 850 -10.288 -16.985 -9.957 274 HA ARG 851 HA ARG 851 -6.265 -15.509 -9.997 275 1HB ARG 851 1HB ARG 851 -4.689 -13.406 -10.955 276 2HB ARG 851 2HB ARG 851 -3.618 -14.309 -9.887 277 1HG ARG 851 1HG ARG 851 -4.511 -16.417 -11.089 278 2HG ARG 851 2HG ARG 851 -5.108 -15.298 -12.316 279 1HD ARG 851 1HD ARG 851 -2.885 -14.493 -12.786 280 2HD ARG 851 2HD ARG 851 -2.219 -15.350 -11.382 281 HE ARG 851 HE ARG 851 -3.433 -17.368 -12.809 282 1HH1 ARG 851 1HH1 ARG 851 -2.783 -15.322 -15.079 283 2HH1 ARG 851 2HH1 ARG 851 -1.309 -16.005 -15.679 284 1HH2 ARG 851 1HH2 ARG 851 -0.839 -18.067 -12.930 285 2HH2 ARG 851 2HH2 ARG 851 -0.208 -17.560 -14.461 286 HA ILE 852 HA ILE 852 -4.659 -15.560 -5.739 287 HB ILE 852 HB ILE 852 -2.246 -15.023 -5.322 288 1HG1 ILE 852 1HG1 ILE 852 -2.951 -12.887 -7.232 289 2HG1 ILE 852 2HG1 ILE 852 -1.452 -13.713 -7.608 290 1HG2 ILE 852 1HG2 ILE 852 -3.144 -16.762 -6.996 291 2HG2 ILE 852 2HG2 ILE 852 -2.724 -15.592 -8.247 292 3HG2 ILE 852 3HG2 ILE 852 -1.470 -16.247 -7.195 293 1HD1 ILE 852 1HD1 ILE 852 -1.262 -13.362 -4.877 294 2HD1 ILE 852 2HD1 ILE 852 -0.522 -12.311 -6.084 295 3HD1 ILE 852 3HD1 ILE 852 -2.084 -11.893 -5.389 296 HA THR 853 HA THR 853 -3.599 -11.325 -3.451 297 HB THR 853 HB THR 853 -4.788 -9.220 -4.260 298 HG1 THR 853 HG1 THR 853 -5.838 -10.996 -5.908 299 1HG2 THR 853 1HG2 THR 853 -2.353 -9.844 -4.690 300 2HG2 THR 853 2HG2 THR 853 -2.873 -10.381 -6.280 301 3HG2 THR 853 3HG2 THR 853 -3.069 -8.693 -5.819 302 HA THR 854 HA THR 854 -7.564 -12.131 -1.735 303 HB THR 854 HB THR 854 -5.901 -12.687 0.024 304 HG1 THR 854 HG1 THR 854 -7.897 -12.788 0.829 305 1HG2 THR 854 1HG2 THR 854 -5.952 -9.697 0.476 306 2HG2 THR 854 2HG2 THR 854 -5.356 -10.832 1.684 307 3HG2 THR 854 3HG2 THR 854 -4.556 -10.712 0.119 308 HA PRO 855 HA PRO 855 -9.525 -8.203 -2.232 309 1HB PRO 855 1HB PRO 855 -11.684 -8.905 -2.031 310 2HB PRO 855 2HB PRO 855 -11.544 -8.835 -0.272 311 1HG PRO 855 1HG PRO 855 -11.722 -11.170 -1.918 312 2HG PRO 855 2HG PRO 855 -11.494 -11.105 -0.168 313 1HD PRO 855 1HD PRO 855 -9.358 -11.885 -0.459 314 2HD PRO 855 2HD PRO 855 -9.537 -11.797 -2.229 315 HA TYR 856 HA TYR 856 -8.071 -5.730 1.124 316 1HB TYR 856 1HB TYR 856 -8.579 -7.805 2.349 317 2HB TYR 856 2HB TYR 856 -6.954 -8.386 2.034 318 HD1 TYR 856 HD1 TYR 856 -4.978 -6.933 2.934 319 HD2 TYR 856 HD2 TYR 856 -9.045 -6.474 4.241 320 HE1 TYR 856 HE1 TYR 856 -4.193 -5.808 4.987 321 HE2 TYR 856 HE2 TYR 856 -8.255 -5.350 6.295 322 HH TYR 856 HH TYR 856 -4.842 -4.567 6.775 323 HA MET 857 HA MET 857 -4.144 -5.161 -1.108 324 1HB MET 857 1HB MET 857 -5.011 -2.905 -1.166 325 2HB MET 857 2HB MET 857 -4.930 -2.776 0.585 326 1HG MET 857 1HG MET 857 -2.495 -2.837 0.544 327 2HG MET 857 2HG MET 857 -2.493 -3.131 -1.186 328 1HE MET 857 1HE MET 857 -3.811 -1.725 -2.744 329 2HE MET 857 2HE MET 857 -5.085 -0.909 -1.838 330 3HE MET 857 3HE MET 857 -3.883 0.034 -2.710 331 HA THR 858 HA THR 858 -1.683 -5.530 2.669 332 HB THR 858 HB THR 858 0.166 -7.071 1.958 333 HG1 THR 858 HG1 THR 858 0.744 -6.282 -0.003 334 1HG2 THR 858 1HG2 THR 858 -2.306 -7.647 2.287 335 2HG2 THR 858 2HG2 THR 858 -2.436 -7.621 0.529 336 3HG2 THR 858 3HG2 THR 858 -1.365 -8.780 1.316 337 HA LYS 859 HA LYS 859 0.605 -1.901 3.496 338 1HB LYS 859 1HB LYS 859 2.554 -2.523 4.897 339 2HB LYS 859 2HB LYS 859 1.093 -3.375 5.399 340 1HG LYS 859 1HG LYS 859 1.913 -5.246 3.776 341 2HG LYS 859 2HG LYS 859 3.479 -4.444 3.905 342 1HD LYS 859 1HD LYS 859 3.053 -4.547 6.476 343 2HD LYS 859 2HD LYS 859 1.867 -5.785 6.065 344 1HE LYS 859 1HE LYS 859 3.826 -6.820 4.648 345 2HE LYS 859 2HE LYS 859 4.855 -5.850 5.719 346 1HZ LYS 859 1HZ LYS 859 2.662 -7.570 6.731 347 2HZ LYS 859 2HZ LYS 859 4.255 -8.134 6.565 348 3HZ LYS 859 3HZ LYS 859 3.918 -6.848 7.619 349 HA TYR 860 HA TYR 860 4.501 -2.947 0.854 350 1HB TYR 860 1HB TYR 860 4.475 -5.368 0.642 351 2HB TYR 860 2HB TYR 860 3.160 -5.292 -0.521 352 HD1 TYR 860 HD1 TYR 860 5.452 -2.525 -0.766 353 HD2 TYR 860 HD2 TYR 860 4.867 -6.594 -2.029 354 HE1 TYR 860 HE1 TYR 860 7.046 -2.164 -2.607 355 HE2 TYR 860 HE2 TYR 860 6.478 -6.223 -3.874 356 HH TYR 860 HH TYR 860 7.516 -3.186 -4.855 357 HA GLU 861 HA GLU 861 1.636 -2.126 -3.088 358 1HB GLU 861 1HB GLU 861 -0.680 -2.446 -1.140 359 2HB GLU 861 2HB GLU 861 -0.857 -1.744 -2.748 360 1HG GLU 861 1HG GLU 861 0.279 -3.927 -3.586 361 2HG GLU 861 2HG GLU 861 -0.137 -4.576 -2.002 362 HA ARG 862 HA ARG 862 0.804 1.661 -0.148 363 1HB ARG 862 1HB ARG 862 -0.164 0.750 1.808 364 2HB ARG 862 2HB ARG 862 1.231 -0.267 2.130 365 1HG ARG 862 1HG ARG 862 1.938 2.571 2.078 366 2HG ARG 862 2HG ARG 862 0.729 2.214 3.304 367 1HD ARG 862 1HD ARG 862 2.333 1.320 4.625 368 2HD ARG 862 2HD ARG 862 2.711 0.130 3.366 369 HE ARG 862 HE ARG 862 3.978 2.253 2.339 370 1HH1 ARG 862 1HH1 ARG 862 3.415 2.707 5.555 371 2HH1 ARG 862 2HH1 ARG 862 5.072 2.701 6.058 372 1HH2 ARG 862 1HH2 ARG 862 6.274 1.591 3.001 373 2HH2 ARG 862 2HH2 ARG 862 6.690 2.072 4.612 374 HA ALA 863 HA ALA 863 5.387 1.399 1.248 375 1HB ALA 863 2HB ALA 863 6.292 -1.277 0.447 376 2HB ALA 863 3HB ALA 863 6.566 -0.413 1.958 377 3HB ALA 863 1HB ALA 863 5.066 -1.307 1.715 378 HA ARG 864 HA ARG 864 6.357 0.667 -3.278 379 1HB ARG 864 1HB ARG 864 4.164 -1.159 -3.367 380 2HB ARG 864 2HB ARG 864 3.933 -0.025 -4.699 381 1HG ARG 864 1HG ARG 864 6.724 -0.824 -4.457 382 2HG ARG 864 2HG ARG 864 5.672 -2.220 -4.675 383 1HD ARG 864 1HD ARG 864 4.632 -1.082 -6.651 384 2HD ARG 864 2HD ARG 864 5.808 0.233 -6.465 385 HE ARG 864 HE ARG 864 6.539 -2.606 -7.061 386 1HH1 ARG 864 1HH1 ARG 864 8.888 -1.585 -5.911 387 2HH1 ARG 864 2HH1 ARG 864 9.669 -0.676 -7.162 388 1HH2 ARG 864 1HH2 ARG 864 6.818 -0.415 -9.119 389 2HH2 ARG 864 2HH2 ARG 864 8.497 -0.015 -8.978 390 HA VAL 865 HA VAL 865 2.378 3.680 -3.938 391 HB VAL 865 HB VAL 865 2.009 2.381 -1.343 392 1HG1 VAL 865 1HG1 VAL 865 1.555 5.298 -1.604 393 2HG1 VAL 865 2HG1 VAL 865 0.434 4.320 -0.655 394 3HG1 VAL 865 3HG1 VAL 865 2.143 4.366 -0.227 395 1HG2 VAL 865 1HG2 VAL 865 0.681 2.029 -3.376 396 2HG2 VAL 865 2HG2 VAL 865 -0.267 2.432 -1.945 397 3HG2 VAL 865 3HG2 VAL 865 0.040 3.659 -3.174 398 HA LEU 866 HA LEU 866 4.698 6.318 -0.523 399 1HB LEU 866 1HB LEU 866 5.055 5.161 1.439 400 2HB LEU 866 2HB LEU 866 5.267 3.637 0.589 401 HG LEU 866 HG LEU 866 7.498 5.592 0.318 402 1HD1 LEU 866 1HD1 LEU 866 6.661 5.658 2.763 403 2HD1 LEU 866 2HD1 LEU 866 7.226 3.990 2.862 404 3HD1 LEU 866 3HD1 LEU 866 8.365 5.286 2.499 405 1HD2 LEU 866 1HD2 LEU 866 7.173 2.613 0.741 406 2HD2 LEU 866 2HD2 LEU 866 7.792 3.443 -0.686 407 3HD2 LEU 866 3HD2 LEU 866 8.749 3.401 0.793 408 1HA GLY 867 1HA GLY 867 8.563 4.845 -2.903 409 2HA GLY 867 2HA GLY 867 7.867 3.433 -3.700 410 HA THR 868 HA THR 868 6.428 6.014 -6.864 411 HB THR 868 HB THR 868 4.492 4.163 -6.683 412 HG1 THR 868 HG1 THR 868 4.017 4.798 -8.749 413 1HG2 THR 868 1HG2 THR 868 3.154 6.888 -6.620 414 2HG2 THR 868 2HG2 THR 868 2.338 5.398 -7.074 415 3HG2 THR 868 3HG2 THR 868 2.950 5.599 -5.434 416 HA ARG 869 HA ARG 869 4.017 9.341 -4.580 417 1HB ARG 869 1HB ARG 869 3.965 7.488 -2.296 418 2HB ARG 869 2HB ARG 869 4.297 9.146 -1.795 419 1HG ARG 869 1HG ARG 869 2.281 9.550 -3.590 420 2HG ARG 869 2HG ARG 869 2.030 9.366 -1.855 421 1HD ARG 869 1HD ARG 869 2.248 6.769 -3.177 422 2HD ARG 869 2HD ARG 869 0.931 7.402 -2.170 423 HE ARG 869 HE ARG 869 0.308 8.749 -4.308 424 1HH1 ARG 869 1HH1 ARG 869 0.666 5.439 -3.938 425 2HH1 ARG 869 2HH1 ARG 869 0.586 5.060 -5.626 426 1HH2 ARG 869 1HH2 ARG 869 0.709 8.371 -6.648 427 2HH2 ARG 869 2HH2 ARG 869 0.611 6.719 -7.160 428 HA ALA 870 HA ALA 870 8.180 9.983 -2.021 429 1HB ALA 870 3HB ALA 870 8.662 7.756 -1.290 430 2HB ALA 870 1HB ALA 870 8.814 7.180 -2.950 431 3HB ALA 870 2HB ALA 870 10.043 8.247 -2.270 432 HA LEU 871 HA LEU 871 10.171 10.216 -6.204 433 1HB LEU 871 1HB LEU 871 8.783 9.132 -8.445 434 2HB LEU 871 2HB LEU 871 10.339 8.633 -7.803 435 HG LEU 871 HG LEU 871 7.892 7.607 -6.443 436 1HD1 LEU 871 1HD1 LEU 871 8.766 6.965 -9.227 437 2HD1 LEU 871 2HD1 LEU 871 8.127 5.675 -8.207 438 3HD1 LEU 871 3HD1 LEU 871 7.135 7.089 -8.566 439 1HD2 LEU 871 1HD2 LEU 871 10.690 6.655 -7.083 440 2HD2 LEU 871 2HD2 LEU 871 9.978 6.941 -5.496 441 3HD2 LEU 871 3HD2 LEU 871 9.459 5.557 -6.458 442 HA GLN 872 HA GLN 872 6.152 12.140 -8.263 443 1HB GLN 872 1HB GLN 872 5.014 10.969 -5.810 444 2HB GLN 872 2HB GLN 872 4.465 12.618 -6.102 445 1HG GLN 872 1HG GLN 872 3.273 12.026 -7.968 446 2HG GLN 872 2HG GLN 872 4.474 10.837 -8.473 447 2HE2 GLN 872 1HE2 GLN 872 2.434 11.186 -5.507 448 1HE2 GLN 872 2HE2 GLN 872 1.826 9.603 -5.567 449 HA ILE 873 HA ILE 873 6.951 15.472 -4.830 450 HB ILE 873 HB ILE 873 7.935 14.742 -2.512 451 1HG1 ILE 873 1HG1 ILE 873 6.448 12.325 -2.406 452 2HG1 ILE 873 2HG1 ILE 873 7.474 12.204 -3.823 453 1HG2 ILE 873 1HG2 ILE 873 5.175 14.615 -3.608 454 2HG2 ILE 873 2HG2 ILE 873 5.434 14.159 -1.927 455 3HG2 ILE 873 3HG2 ILE 873 5.883 15.768 -2.480 456 1HD1 ILE 873 1HD1 ILE 873 8.846 13.313 -1.493 457 2HD1 ILE 873 2HD1 ILE 873 8.279 11.661 -1.270 458 3HD1 ILE 873 3HD1 ILE 873 9.351 12.053 -2.612 459 HA ALA 874 HA ALA 874 11.495 13.969 -4.290 460 1HB ALA 874 1HB ALA 874 10.770 11.621 -6.019 461 2HB ALA 874 3HB ALA 874 11.484 11.604 -4.409 462 3HB ALA 874 2HB ALA 874 12.448 12.101 -5.796 463 HA MET 875 HA MET 875 11.453 15.628 -8.611 464 1HB MET 875 1HB MET 875 9.086 14.149 -9.076 465 2HB MET 875 2HB MET 875 8.666 15.815 -9.473 466 1HG MET 875 1HG MET 875 11.190 14.516 -10.505 467 2HG MET 875 2HG MET 875 9.659 14.402 -11.373 468 1HE MET 875 1HE MET 875 10.751 15.058 -13.152 469 2HE MET 875 2HE MET 875 9.851 16.480 -13.671 470 3HE MET 875 3HE MET 875 11.602 16.567 -13.504 471 HA CYS 876 HA CYS 876 8.996 18.951 -6.417 472 1HB CYS 876 1HB CYS 876 7.045 18.267 -8.593 473 2HB CYS 876 2HB CYS 876 6.599 19.560 -7.479 474 HG CYS 876 HG CYS 876 9.381 20.118 -8.356 475 HA ALA 877 HA ALA 877 5.514 16.268 -4.369 476 1HB ALA 877 3HB ALA 877 5.864 18.154 -3.139 477 2HB ALA 877 1HB ALA 877 5.203 19.214 -4.384 478 3HB ALA 877 2HB ALA 877 4.118 18.275 -3.357 479 HA PRO 878 HA PRO 878 1.681 16.415 -7.250 480 1HB PRO 878 1HB PRO 878 2.208 13.669 -7.890 481 2HB PRO 878 2HB PRO 878 2.226 15.051 -8.989 482 1HG PRO 878 1HG PRO 878 4.458 13.539 -8.018 483 2HG PRO 878 2HG PRO 878 4.473 14.892 -9.138 484 1HD PRO 878 1HD PRO 878 5.379 14.858 -6.415 485 2HD PRO 878 2HD PRO 878 5.352 16.229 -7.543 486 HA VAL 879 HA VAL 879 1.537 12.609 -3.978 487 HB VAL 879 HB VAL 879 3.520 14.532 -2.825 488 1HG1 VAL 879 1HG1 VAL 879 1.818 13.984 -0.992 489 2HG1 VAL 879 2HG1 VAL 879 2.445 12.347 -1.072 490 3HG1 VAL 879 3HG1 VAL 879 3.506 13.680 -0.647 491 1HG2 VAL 879 1HG2 VAL 879 3.707 12.128 -4.160 492 2HG2 VAL 879 2HG2 VAL 879 4.986 12.852 -3.209 493 3HG2 VAL 879 3HG2 VAL 879 3.931 11.653 -2.481 494 HA MET 880 HA MET 880 -1.775 14.917 -2.184 495 1HB MET 880 1HB MET 880 -1.717 12.272 -1.454 496 2HB MET 880 2HB MET 880 -1.938 13.067 0.105 497 1HG MET 880 1HG MET 880 -4.134 12.659 -0.820 498 2HG MET 880 2HG MET 880 -3.822 14.392 -0.931 499 1HE MET 880 3HE MET 880 -6.000 13.663 -2.287 500 2HE MET 880 2HE MET 880 -5.967 13.348 -4.027 501 3HE MET 880 1HE MET 880 -5.752 12.024 -2.884 502 HA VAL 881 HA VAL 881 0.048 17.116 1.254 503 HB VAL 881 HB VAL 881 1.954 16.280 2.711 504 1HG1 VAL 881 1HG1 VAL 881 -0.606 15.106 2.248 505 2HG1 VAL 881 2HG1 VAL 881 0.522 13.786 2.540 506 3HG1 VAL 881 3HG1 VAL 881 0.340 15.075 3.730 507 1HG2 VAL 881 1HG2 VAL 881 2.948 15.112 0.526 508 2HG2 VAL 881 2HG2 VAL 881 3.244 14.453 2.135 509 3HG2 VAL 881 3HG2 VAL 881 1.988 13.754 1.113 510 HA GLU 882 HA GLU 882 3.603 19.028 -0.717 511 1HB GLU 882 1HB GLU 882 3.027 21.446 -0.567 512 2HB GLU 882 2HB GLU 882 1.612 20.429 -0.834 513 1HG GLU 882 1HG GLU 882 2.105 20.686 2.002 514 2HG GLU 882 2HG GLU 882 2.013 22.285 1.264 515 HA LEU 883 HA LEU 883 6.103 19.471 3.225 516 1HB LEU 883 1HB LEU 883 6.786 17.189 2.650 517 2HB LEU 883 2HB LEU 883 7.627 17.775 1.217 518 HG LEU 883 HG LEU 883 9.047 19.202 2.764 519 1HD1 LEU 883 1HD1 LEU 883 7.453 17.609 4.763 520 2HD1 LEU 883 2HD1 LEU 883 9.082 18.161 5.155 521 3HD1 LEU 883 3HD1 LEU 883 7.823 19.333 4.767 522 1HD2 LEU 883 1HD2 LEU 883 9.091 16.182 3.049 523 2HD2 LEU 883 2HD2 LEU 883 9.949 17.143 1.843 524 3HD2 LEU 883 3HD2 LEU 883 10.414 17.238 3.542 525 HA GLU 884 HA GLU 884 8.360 22.358 0.351 526 1HB GLU 884 1HB GLU 884 10.175 20.724 1.812 527 2HB GLU 884 2HB GLU 884 11.059 21.382 0.435 528 1HG GLU 884 1HG GLU 884 9.311 23.139 2.159 529 2HG GLU 884 2HG GLU 884 10.990 22.810 2.587 530 1HA GLY 885 1HA GLY 885 8.372 19.791 -3.861 531 2HA GLY 885 2HA GLY 885 9.873 20.696 -3.639 532 HA GLU 886 HA GLU 886 10.863 16.137 -1.804 533 1HB GLU 886 1HB GLU 886 11.458 16.366 -4.117 534 2HB GLU 886 2HB GLU 886 12.625 17.638 -3.758 535 1HG GLU 886 1HG GLU 886 13.949 15.954 -2.441 536 2HG GLU 886 2HG GLU 886 12.829 14.709 -2.997 537 HA THR 887 HA THR 887 14.550 16.796 0.673 538 HB THR 887 HB THR 887 11.971 17.458 2.142 539 HG1 THR 887 HG1 THR 887 14.090 19.020 1.078 540 1HG2 THR 887 1HG2 THR 887 14.834 17.594 3.099 541 2HG2 THR 887 2HG2 THR 887 13.589 18.653 3.762 542 3HG2 THR 887 3HG2 THR 887 13.436 16.903 3.922 543 HA ASP 888 HA ASP 888 13.221 13.359 3.526 544 1HB ASP 888 1HB ASP 888 10.924 14.608 3.876 545 2HB ASP 888 2HB ASP 888 10.298 13.199 3.026 546 HA PRO 889 HA PRO 889 13.295 10.245 0.357 547 1HB PRO 889 1HB PRO 889 13.405 8.134 2.305 548 2HB PRO 889 2HB PRO 889 14.740 8.827 1.380 549 1HG PRO 889 1HG PRO 889 14.262 9.104 4.171 550 2HG PRO 889 2HG PRO 889 15.513 9.903 3.215 551 1HD PRO 889 1HD PRO 889 14.442 11.884 3.568 552 2HD PRO 889 2HD PRO 889 13.073 11.048 4.344 553 HA LEU 890 HA LEU 890 8.823 9.353 1.116 554 1HB LEU 890 1HB LEU 890 8.473 7.258 2.301 555 2HB LEU 890 2HB LEU 890 10.145 7.330 1.772 556 HG LEU 890 HG LEU 890 10.176 6.496 4.015 557 1HD1 LEU 890 1HD1 LEU 890 11.819 8.354 3.459 558 2HD1 LEU 890 2HD1 LEU 890 10.759 9.437 4.362 559 3HD1 LEU 890 3HD1 LEU 890 11.527 8.075 5.174 560 1HD2 LEU 890 1HD2 LEU 890 7.799 7.698 4.376 561 2HD2 LEU 890 2HD2 LEU 890 8.805 7.159 5.719 562 3HD2 LEU 890 3HD2 LEU 890 8.830 8.852 5.227 563 HA LEU 891 HA LEU 891 7.686 11.134 5.640 564 1HB LEU 891 1HB LEU 891 8.906 13.088 5.855 565 2HB LEU 891 2HB LEU 891 8.872 13.389 4.129 566 HG LEU 891 HG LEU 891 7.602 15.047 5.560 567 1HD1 LEU 891 1HD1 LEU 891 7.073 14.212 3.019 568 2HD1 LEU 891 2HD1 LEU 891 5.507 13.960 3.791 569 3HD1 LEU 891 3HD1 LEU 891 6.255 15.556 3.807 570 1HD2 LEU 891 1HD2 LEU 891 6.509 12.740 6.669 571 2HD2 LEU 891 2HD2 LEU 891 5.954 14.390 6.947 572 3HD2 LEU 891 3HD2 LEU 891 5.203 13.407 5.692 573 HA ILE 892 HA ILE 892 4.528 12.907 2.424 574 HB ILE 892 HB ILE 892 6.851 12.490 0.651 575 1HG1 ILE 892 1HG1 ILE 892 4.714 14.437 0.058 576 2HG1 ILE 892 2HG1 ILE 892 5.537 14.630 1.606 577 1HG2 ILE 892 1HG2 ILE 892 4.088 11.771 -0.181 578 2HG2 ILE 892 2HG2 ILE 892 5.070 12.702 -1.297 579 3HG2 ILE 892 3HG2 ILE 892 5.637 11.138 -0.736 580 1HD1 ILE 892 1HD1 ILE 892 7.189 14.049 -0.786 581 2HD1 ILE 892 2HD1 ILE 892 6.524 15.672 -0.629 582 3HD1 ILE 892 3HD1 ILE 892 7.571 15.020 0.632 583 HA ALA 893 HA ALA 893 4.208 8.559 0.534 584 1HB ALA 893 3HB ALA 893 6.049 7.589 -0.334 585 2HB ALA 893 1HB ALA 893 7.087 8.313 0.891 586 3HB ALA 893 2HB ALA 893 6.235 6.815 1.232 587 HA MET 894 HA MET 894 4.385 6.960 5.005 588 1HB MET 894 1HB MET 894 6.501 7.634 5.861 589 2HB MET 894 2HB MET 894 6.153 9.341 5.608 590 1HG MET 894 1HG MET 894 4.508 9.288 7.441 591 2HG MET 894 2HG MET 894 4.824 7.570 7.685 592 1HE MET 894 2HE MET 894 6.337 10.772 6.951 593 2HE MET 894 1HE MET 894 6.881 11.312 8.536 594 3HE MET 894 3HE MET 894 8.035 10.592 7.417 595 HA LYS 895 HA LYS 895 2.006 10.939 6.610 596 1HB LYS 895 1HB LYS 895 3.355 12.791 6.001 597 2HB LYS 895 2HB LYS 895 3.381 12.320 4.304 598 1HG LYS 895 1HG LYS 895 0.906 12.815 4.218 599 2HG LYS 895 2HG LYS 895 1.926 14.224 4.500 600 1HD LYS 895 1HD LYS 895 1.056 12.796 6.942 601 2HD LYS 895 2HD LYS 895 -0.238 13.580 6.036 602 1HE LYS 895 1HE LYS 895 2.241 15.189 6.415 603 2HE LYS 895 2HE LYS 895 0.540 15.687 6.526 604 1HZ LYS 895 1HZ LYS 895 0.414 14.274 8.574 605 2HZ LYS 895 2HZ LYS 895 2.107 14.147 8.520 606 3HZ LYS 895 3HZ LYS 895 1.379 15.664 8.728 607 HA GLU 896 HA GLU 896 -0.304 10.580 2.301 608 1HB GLU 896 1HB GLU 896 2.117 9.041 1.452 609 2HB GLU 896 2HB GLU 896 0.590 8.688 0.666 610 1HG GLU 896 1HG GLU 896 1.242 11.559 0.959 611 2HG GLU 896 2HG GLU 896 2.239 10.647 -0.176 612 HA LEU 897 HA LEU 897 -1.204 6.059 3.508 613 1HB LEU 897 1HB LEU 897 0.240 4.326 3.826 614 2HB LEU 897 2HB LEU 897 0.832 5.048 5.324 615 HG LEU 897 HG LEU 897 2.273 6.538 4.005 616 1HD1 LEU 897 1HD1 LEU 897 2.461 3.618 4.071 617 2HD1 LEU 897 2HD1 LEU 897 3.519 4.403 2.897 618 3HD1 LEU 897 3HD1 LEU 897 3.610 4.848 4.603 619 1HD2 LEU 897 1HD2 LEU 897 0.610 5.408 1.893 620 2HD2 LEU 897 2HD2 LEU 897 1.590 6.873 1.874 621 3HD2 LEU 897 3HD2 LEU 897 2.324 5.316 1.502 622 HA LYS 898 HA LYS 898 -0.314 7.013 8.275 623 1HB LYS 898 1HB LYS 898 1.908 8.067 7.779 624 2HB LYS 898 2HB LYS 898 1.039 9.474 7.172 625 1HG LYS 898 1HG LYS 898 0.148 9.993 9.310 626 2HG LYS 898 2HG LYS 898 0.597 8.419 9.967 627 1HD LYS 898 1HD LYS 898 2.813 9.005 10.230 628 2HD LYS 898 2HD LYS 898 2.783 10.131 8.872 629 1HE LYS 898 1HE LYS 898 1.470 11.736 10.213 630 2HE LYS 898 2HE LYS 898 1.485 10.606 11.581 631 1HZ LYS 898 1HZ LYS 898 3.955 11.524 10.220 632 2HZ LYS 898 2HZ LYS 898 3.317 12.310 11.580 633 3HZ LYS 898 3HZ LYS 898 3.827 10.694 11.697 634 HA ALA 899 HA ALA 899 -3.213 10.389 7.057 635 1HB ALA 899 1HB ALA 899 -1.476 11.748 5.901 636 2HB ALA 899 3HB ALA 899 -3.076 12.027 5.216 637 3HB ALA 899 2HB ALA 899 -1.923 10.993 4.371 638 HA ARG 900 HA ARG 900 -4.135 6.431 3.768 639 1HB ARG 900 1HB ARG 900 -5.978 6.171 5.076 640 2HB ARG 900 2HB ARG 900 -5.615 7.696 5.873 641 1HG ARG 900 1HG ARG 900 -6.795 8.861 3.966 642 2HG ARG 900 2HG ARG 900 -7.314 7.267 3.411 643 1HD ARG 900 1HD ARG 900 -8.953 7.172 4.982 644 2HD ARG 900 2HD ARG 900 -7.827 7.644 6.270 645 HE ARG 900 HE ARG 900 -8.699 9.768 4.391 646 1HH1 ARG 900 1HH1 ARG 900 -7.901 11.366 6.261 647 2HH1 ARG 900 2HH1 ARG 900 -9.017 11.364 7.587 648 1HH2 ARG 900 1HH2 ARG 900 -10.561 8.411 6.627 649 2HH2 ARG 900 2HH2 ARG 900 -10.522 9.690 7.794 650 HA LYS 901 HA LYS 901 -4.999 10.072 1.077 651 1HB LYS 901 1HB LYS 901 -2.131 10.793 1.693 652 2HB LYS 901 2HB LYS 901 -3.180 11.715 0.615 653 1HG LYS 901 1HG LYS 901 -3.224 12.707 2.855 654 2HG LYS 901 2HG LYS 901 -3.698 11.151 3.538 655 1HD LYS 901 1HD LYS 901 -5.397 12.066 1.315 656 2HD LYS 901 2HD LYS 901 -5.851 11.363 2.868 657 1HE LYS 901 1HE LYS 901 -5.862 13.437 3.957 658 2HE LYS 901 2HE LYS 901 -4.745 14.167 2.786 659 1HZ LYS 901 1HZ LYS 901 -6.510 13.804 1.079 660 2HZ LYS 901 2HZ LYS 901 -7.576 13.393 2.337 661 3HZ LYS 901 3HZ LYS 901 -6.910 14.954 2.258 662 HA ILE 902 HA ILE 902 -2.297 7.611 -1.715 663 HB ILE 902 HB ILE 902 -0.968 5.737 -1.194 664 1HG1 ILE 902 1HG1 ILE 902 -2.798 4.314 -0.227 665 2HG1 ILE 902 2HG1 ILE 902 -1.307 4.246 0.696 666 1HG2 ILE 902 1HG2 ILE 902 -1.000 7.978 0.463 667 2HG2 ILE 902 2HG2 ILE 902 -0.834 6.615 1.568 668 3HG2 ILE 902 3HG2 ILE 902 0.325 6.834 0.258 669 1HD1 ILE 902 1HD1 ILE 902 -2.418 6.208 2.067 670 2HD1 ILE 902 2HD1 ILE 902 -3.911 5.550 1.400 671 3HD1 ILE 902 3HD1 ILE 902 -2.864 4.535 2.391 672 HA PRO 903 HA PRO 903 -6.251 4.808 -1.967 673 1HB PRO 903 1HB PRO 903 -8.071 6.163 -2.128 674 2HB PRO 903 2HB PRO 903 -7.486 6.755 -3.685 675 1HG PRO 903 1HG PRO 903 -7.561 8.158 -1.177 676 2HG PRO 903 2HG PRO 903 -6.971 8.746 -2.734 677 1HD PRO 903 1HD PRO 903 -4.838 8.652 -1.947 678 2HD PRO 903 2HD PRO 903 -5.434 8.007 -0.396 679 HA ILE 904 HA ILE 904 -5.113 4.313 -6.193 680 HB ILE 904 HB ILE 904 -2.842 4.865 -4.520 681 1HG1 ILE 904 1HG1 ILE 904 -2.726 5.379 -7.424 682 2HG1 ILE 904 2HG1 ILE 904 -4.163 5.995 -6.612 683 1HG2 ILE 904 1HG2 ILE 904 -2.460 2.814 -6.661 684 2HG2 ILE 904 2HG2 ILE 904 -1.240 4.069 -6.475 685 3HG2 ILE 904 3HG2 ILE 904 -1.624 3.006 -5.124 686 1HD1 ILE 904 1HD1 ILE 904 -1.737 6.507 -5.069 687 2HD1 ILE 904 2HD1 ILE 904 -1.667 7.235 -6.673 688 3HD1 ILE 904 3HD1 ILE 904 -2.994 7.632 -5.582 689 HA ILE 905 HA ILE 905 -5.164 -0.020 -6.666 690 HB ILE 905 HB ILE 905 -6.332 0.983 -8.616 691 1HG1 ILE 905 1HG1 ILE 905 -4.888 -0.976 -10.153 692 2HG1 ILE 905 2HG1 ILE 905 -5.039 -1.546 -8.490 693 1HG2 ILE 905 1HG2 ILE 905 -3.549 1.011 -9.828 694 2HG2 ILE 905 2HG2 ILE 905 -5.039 1.334 -10.712 695 3HG2 ILE 905 3HG2 ILE 905 -4.522 2.423 -9.431 696 1HD1 ILE 905 1HD1 ILE 905 -7.384 -0.405 -10.001 697 2HD1 ILE 905 2HD1 ILE 905 -6.969 -2.117 -10.073 698 3HD1 ILE 905 3HD1 ILE 905 -7.403 -1.376 -8.530 699 HA ILE 906 HA ILE 906 -0.935 -1.003 -7.962 700 HB ILE 906 HB ILE 906 -1.790 -1.899 -5.233 701 1HG1 ILE 906 1HG1 ILE 906 0.305 -0.090 -6.417 702 2HG1 ILE 906 2HG1 ILE 906 0.363 -0.573 -4.722 703 1HG2 ILE 906 1HG2 ILE 906 0.569 -2.980 -6.741 704 2HG2 ILE 906 2HG2 ILE 906 0.739 -2.654 -5.017 705 3HG2 ILE 906 3HG2 ILE 906 -0.479 -3.797 -5.584 706 1HD1 ILE 906 1HD1 ILE 906 -2.264 0.155 -4.996 707 2HD1 ILE 906 2HD1 ILE 906 -0.994 1.223 -4.400 708 3HD1 ILE 906 3HD1 ILE 906 -1.467 1.275 -6.095 709 HA ARG 907 HA ARG 907 -1.803 -5.105 -9.449 710 1HB ARG 907 1HB ARG 907 0.593 -3.984 -10.842 711 2HB ARG 907 2HB ARG 907 0.021 -5.605 -11.210 712 1HG ARG 907 1HG ARG 907 -0.997 -3.956 -12.738 713 2HG ARG 907 2HG ARG 907 -2.211 -4.719 -11.716 714 1HD ARG 907 1HD ARG 907 -2.647 -2.774 -10.538 715 2HD ARG 907 2HD ARG 907 -0.987 -2.172 -10.719 716 HE ARG 907 HE ARG 907 -1.649 -1.170 -12.751 717 1HH1 ARG 907 1HH1 ARG 907 -4.400 -2.425 -11.418 718 2HH1 ARG 907 2HH1 ARG 907 -5.229 -2.726 -12.908 719 1HH2 ARG 907 1HH2 ARG 907 -2.444 -2.118 -14.884 720 2HH2 ARG 907 2HH2 ARG 907 -4.121 -2.553 -14.871 721 HA ARG 908 HA ARG 908 1.171 -7.091 -6.772 722 1HB ARG 908 1HB ARG 908 -1.252 -8.790 -6.217 723 2HB ARG 908 2HB ARG 908 0.057 -8.378 -5.131 724 1HG ARG 908 1HG ARG 908 -0.839 -5.974 -5.176 725 2HG ARG 908 2HG ARG 908 -2.270 -6.626 -5.973 726 1HD ARG 908 1HD ARG 908 -2.114 -8.360 -3.865 727 2HD ARG 908 2HD ARG 908 -3.010 -6.825 -3.736 728 HE ARG 908 HE ARG 908 -1.329 -6.191 -2.203 729 1HH1 ARG 908 1HH1 ARG 908 0.812 -5.722 -4.136 730 2HH1 ARG 908 2HH1 ARG 908 2.034 -6.850 -3.659 731 1HH2 ARG 908 1HH2 ARG 908 -0.124 -8.792 -1.762 732 2HH2 ARG 908 2HH2 ARG 908 1.503 -8.595 -2.321 733 HA TYR 909 HA TYR 909 1.112 -10.398 -9.905 734 1HB TYR 909 1HB TYR 909 3.965 -9.587 -10.246 735 2HB TYR 909 2HB TYR 909 2.874 -10.287 -11.420 736 HD1 TYR 909 HD1 TYR 909 3.893 -7.139 -9.753 737 HD2 TYR 909 HD2 TYR 909 1.432 -8.919 -12.770 738 HE1 TYR 909 HE1 TYR 909 3.550 -4.930 -10.750 739 HE2 TYR 909 HE2 TYR 909 1.068 -6.708 -13.769 740 HH TYR 909 HH TYR 909 1.126 -4.299 -13.004 741 HA LEU 910 HA LEU 910 4.115 -12.603 -7.366 742 1HB LEU 910 1HB LEU 910 2.295 -14.478 -8.877 743 2HB LEU 910 2HB LEU 910 3.148 -14.917 -7.396 744 HG LEU 910 HG LEU 910 1.022 -12.789 -7.750 745 1HD1 LEU 910 1HD1 LEU 910 1.177 -15.537 -6.635 746 2HD1 LEU 910 2HD1 LEU 910 0.193 -14.378 -5.749 747 3HD1 LEU 910 3HD1 LEU 910 -0.157 -14.724 -7.440 748 1HD2 LEU 910 1HD2 LEU 910 3.175 -12.925 -5.835 749 2HD2 LEU 910 2HD2 LEU 910 1.883 -11.733 -5.957 750 3HD2 LEU 910 3HD2 LEU 910 1.642 -13.199 -5.011 751 HA PRO 911 HA PRO 911 7.421 -13.739 -10.220 752 1HB PRO 911 1HB PRO 911 9.021 -14.266 -7.887 753 2HB PRO 911 2HB PRO 911 9.126 -12.876 -8.972 754 1HG PRO 911 1HG PRO 911 8.262 -11.552 -7.354 755 2HG PRO 911 2HG PRO 911 8.129 -12.942 -6.276 756 1HD PRO 911 1HD PRO 911 5.858 -12.913 -6.526 757 2HD PRO 911 2HD PRO 911 5.994 -11.535 -7.641 758 HA ASP 912 HA ASP 912 7.069 -17.927 -7.811 759 1HB ASP 912 1HB ASP 912 4.658 -16.637 -6.637 760 2HB ASP 912 2HB ASP 912 4.573 -18.387 -6.841 761 1HA GLY 913 1HA GLY 913 4.194 -17.446 -11.844 762 2HA GLY 913 2HA GLY 913 3.872 -18.940 -10.967 763 HA SER 914 HA SER 914 0.048 -16.123 -11.411 764 1HB SER 914 1HB SER 914 0.824 -16.250 -8.502 765 2HB SER 914 2HB SER 914 -0.785 -15.723 -8.984 766 HG SER 914 HG SER 914 -1.138 -17.691 -9.920 767 HA TYR 915 HA TYR 915 0.168 -11.820 -9.431 768 1HB TYR 915 1HB TYR 915 1.279 -11.480 -11.415 769 2HB TYR 915 2HB TYR 915 0.201 -12.546 -12.303 770 HD1 TYR 915 HD1 TYR 915 -0.181 -9.235 -10.509 771 HD2 TYR 915 HD2 TYR 915 -0.850 -11.520 -14.087 772 HE1 TYR 915 HE1 TYR 915 -1.256 -7.272 -11.566 773 HE2 TYR 915 HE2 TYR 915 -1.925 -9.554 -15.139 774 HH TYR 915 HH TYR 915 -1.779 -6.988 -14.816 775 HA GLU 916 HA GLU 916 -4.069 -10.214 -10.398 776 1HB GLU 916 1HB GLU 916 -3.481 -11.220 -7.895 777 2HB GLU 916 2HB GLU 916 -4.083 -9.601 -7.548 778 1HG GLU 916 1HG GLU 916 -5.583 -11.272 -9.521 779 2HG GLU 916 2HG GLU 916 -5.759 -11.637 -7.805 780 HA ASP 917 HA ASP 917 -3.410 -5.836 -9.715 781 1HB ASP 917 1HB ASP 917 -3.593 -6.269 -12.130 782 2HB ASP 917 2HB ASP 917 -4.244 -4.721 -11.674 783 HA TRP 918 HA TRP 918 -6.743 -2.986 -8.549 784 1HB TRP 918 1HB TRP 918 -8.075 -4.220 -6.832 785 2HB TRP 918 2HB TRP 918 -8.059 -4.974 -8.409 786 HD1 TRP 918 HD1 TRP 918 -4.840 -6.012 -7.219 787 HE1 TRP 918 HE1 TRP 918 -4.982 -8.344 -6.137 788 HE3 TRP 918 HE3 TRP 918 -9.769 -6.141 -6.295 789 HZ2 TRP 918 HZ2 TRP 918 -7.002 -9.997 -4.867 790 HZ3 TRP 918 HZ3 TRP 918 -10.815 -7.988 -5.082 791 HH2 TRP 918 HH2 TRP 918 -9.449 -9.959 -4.371 792 1HA GLY 919 1HA GLY 919 -4.952 -2.725 -4.313 793 2HA GLY 919 2HA GLY 919 -4.929 -1.145 -5.076 794 HA VAL 920 HA VAL 920 -8.054 -0.373 -2.075 795 HB VAL 920 HB VAL 920 -7.186 2.229 -3.385 796 1HG1 VAL 920 1HG1 VAL 920 -8.560 1.688 -0.733 797 2HG1 VAL 920 2HG1 VAL 920 -7.821 3.229 -1.166 798 3HG1 VAL 920 3HG1 VAL 920 -9.202 2.626 -2.081 799 1HG2 VAL 920 1HG2 VAL 920 -6.104 0.437 -1.240 800 2HG2 VAL 920 2HG2 VAL 920 -5.247 1.256 -2.544 801 3HG2 VAL 920 3HG2 VAL 920 -5.799 2.169 -1.142 802 HA ASP 921 HA ASP 921 -11.184 1.205 -5.161 803 1HB ASP 921 1HB ASP 921 -9.668 1.571 -7.094 804 2HB ASP 921 2HB ASP 921 -9.754 -0.151 -7.465 805 HA GLU 922 HA GLU 922 -12.566 -3.121 -5.223 806 1HB GLU 922 1HB GLU 922 -10.754 -3.380 -7.063 807 2HB GLU 922 2HB GLU 922 -9.957 -4.448 -5.909 808 1HG GLU 922 1HG GLU 922 -11.705 -6.020 -5.953 809 2HG GLU 922 2HG GLU 922 -12.877 -4.837 -6.534 810 HA LEU 923 HA LEU 923 -10.805 -4.397 -1.213 811 1HB LEU 923 1HB LEU 923 -8.366 -5.295 -1.040 812 2HB LEU 923 2HB LEU 923 -9.384 -5.894 -2.333 813 HG LEU 923 HG LEU 923 -8.069 -3.468 -3.170 814 1HD1 LEU 923 1HD1 LEU 923 -6.337 -5.708 -2.107 815 2HD1 LEU 923 2HD1 LEU 923 -5.793 -4.611 -3.376 816 3HD1 LEU 923 3HD1 LEU 923 -6.193 -3.984 -1.782 817 1HD2 LEU 923 1HD2 LEU 923 -9.166 -5.350 -4.393 818 2HD2 LEU 923 2HD2 LEU 923 -7.597 -4.830 -5.015 819 3HD2 LEU 923 3HD2 LEU 923 -7.717 -6.295 -4.040 820 HA ILE 924 HA ILE 924 -8.722 -1.909 1.733 821 HB ILE 924 HB ILE 924 -7.527 -4.486 1.980 822 1HG1 ILE 924 1HG1 ILE 924 -7.844 -3.871 4.400 823 2HG1 ILE 924 2HG1 ILE 924 -8.377 -2.292 3.820 824 1HG2 ILE 924 1HG2 ILE 924 -5.736 -2.247 2.892 825 2HG2 ILE 924 2HG2 ILE 924 -5.718 -3.845 3.621 826 3HG2 ILE 924 3HG2 ILE 924 -5.307 -3.654 1.926 827 1HD1 ILE 924 3HD1 ILE 924 -9.502 -4.905 2.827 828 2HD1 ILE 924 1HD1 ILE 924 -10.250 -3.936 4.096 829 3HD1 ILE 924 2HD1 ILE 924 -10.090 -3.282 2.465 830 HA ILE 925 HA ILE 925 -5.260 0.523 0.498 831 HB ILE 925 HB ILE 925 -6.926 1.685 2.049 832 1HG1 ILE 925 1HG1 ILE 925 -4.042 2.413 1.765 833 2HG1 ILE 925 2HG1 ILE 925 -5.478 3.257 1.198 834 1HG2 ILE 925 1HG2 ILE 925 -6.051 0.100 3.979 835 2HG2 ILE 925 2HG2 ILE 925 -4.905 1.413 4.241 836 3HG2 ILE 925 3HG2 ILE 925 -6.636 1.722 4.340 837 1HD1 ILE 925 1HD1 ILE 925 -5.940 3.584 3.780 838 2HD1 ILE 925 2HD1 ILE 925 -4.202 3.319 3.913 839 3HD1 ILE 925 3HD1 ILE 925 -4.820 4.653 2.941 840 HA THR 926 HA THR 926 -1.485 -0.657 2.676 841 HB THR 926 HB THR 926 -2.126 1.252 4.951 842 HG1 THR 926 HG1 THR 926 -1.306 2.802 3.737 843 1HG2 THR 926 1HG2 THR 926 0.427 -0.074 4.025 844 2HG2 THR 926 2HG2 THR 926 0.407 1.314 5.110 845 3HG2 THR 926 3HG2 THR 926 -0.343 -0.203 5.604 846 HA ASP 927 HA ASP 927 -4.409 -3.167 5.452 847 1HB ASP 927 1HB ASP 927 -2.478 -1.531 6.900 848 2HB ASP 927 2HB ASP 927 -3.693 -2.171 8.005 No H/Q in entry = 848 Start of MODEL 13 1 H1 MET 801 H3 MET 801 25.519 -27.384 31.575 2 H2 MET 801 H1 MET 801 25.127 -27.940 30.018 3 H3 MET 801 H2 MET 801 26.684 -28.192 30.639 4 HA MET 801 HA MET 801 27.150 -25.835 30.595 5 1HB MET 801 1HB MET 801 27.082 -27.590 28.557 6 2HB MET 801 2HB MET 801 25.933 -26.407 27.931 7 1HG MET 801 1HG MET 801 27.525 -24.734 27.775 8 2HG MET 801 2HG MET 801 28.503 -25.400 29.083 9 1HE MET 801 1HE MET 801 29.331 -27.926 28.875 10 2HE MET 801 2HE MET 801 30.570 -28.144 27.642 11 3HE MET 801 3HE MET 801 30.619 -26.735 28.711 12 HA SER 802 HA SER 802 23.640 -23.160 29.431 13 1HB SER 802 1HB SER 802 24.397 -23.396 32.320 14 2HB SER 802 2HB SER 802 23.225 -22.161 31.865 15 HG SER 802 HG SER 802 23.093 -24.966 31.571 16 HA ASP 803 HA ASP 803 26.317 -19.452 29.551 17 1HB ASP 803 1HB ASP 803 26.541 -20.615 26.767 18 2HB ASP 803 2HB ASP 803 27.277 -19.075 27.211 19 HA ASN 804 HA ASN 804 22.832 -16.440 29.271 20 1HB ASN 804 1HB ASN 804 24.690 -16.694 26.945 21 2HB ASN 804 2HB ASN 804 23.181 -15.817 26.685 22 2HD2 ASN 804 1HD2 ASN 804 25.888 -14.621 26.766 23 1HD2 ASN 804 2HD2 ASN 804 25.885 -13.516 28.053 24 HA GLU 805 HA GLU 805 20.035 -18.341 26.077 25 1HB GLU 805 1HB GLU 805 21.288 -17.649 24.068 26 2HB GLU 805 2HB GLU 805 20.510 -19.208 23.800 27 1HG GLU 805 1HG GLU 805 23.222 -19.388 24.955 28 2HG GLU 805 2HG GLU 805 22.499 -20.303 23.632 29 HA ASP 806 HA ASP 806 20.806 -22.836 26.479 30 1HB ASP 806 1HB ASP 806 19.748 -21.565 28.477 31 2HB ASP 806 2HB ASP 806 18.215 -22.227 27.908 32 HA ASN 807 HA ASN 807 17.383 -24.191 23.799 33 1HB ASN 807 1HB ASN 807 17.636 -23.606 21.409 34 2HB ASN 807 2HB ASN 807 19.282 -23.049 21.716 35 2HD2 ASN 807 1HD2 ASN 807 19.535 -20.914 22.503 36 1HD2 ASN 807 2HD2 ASN 807 18.238 -19.899 22.917 37 HA PHE 808 HA PHE 808 19.901 -27.664 22.298 38 1HB PHE 808 1HB PHE 808 17.350 -27.478 21.092 39 2HB PHE 808 2HB PHE 808 18.390 -28.236 19.887 40 HD1 PHE 808 HD1 PHE 808 20.216 -29.910 21.195 41 HD2 PHE 808 HD2 PHE 808 16.182 -29.024 22.375 42 HE1 PHE 808 HE1 PHE 808 20.114 -32.047 22.450 43 HE2 PHE 808 HE2 PHE 808 16.080 -31.160 23.630 44 HZ PHE 808 HZ PHE 808 18.046 -32.671 23.668 45 HA ASP 809 HA ASP 809 22.048 -25.919 18.506 46 1HB ASP 809 1HB ASP 809 20.800 -28.304 18.062 47 2HB ASP 809 2HB ASP 809 20.498 -27.491 16.526 48 1HA GLY 810 1HA GLY 810 21.034 -21.843 16.785 49 2HA GLY 810 2HA GLY 810 20.693 -22.999 15.496 50 HA ASP 811 HA ASP 811 16.571 -21.936 17.106 51 1HB ASP 811 1HB ASP 811 17.825 -21.575 19.495 52 2HB ASP 811 2HB ASP 811 17.015 -20.017 19.326 53 HA ASP 812 HA ASP 812 15.742 -17.758 15.729 54 1HB ASP 812 1HB ASP 812 13.375 -17.119 16.103 55 2HB ASP 812 2HB ASP 812 13.543 -18.860 15.890 56 HA PHE 813 HA PHE 813 16.547 -14.777 18.989 57 1HB PHE 813 1HB PHE 813 15.968 -16.698 20.596 58 2HB PHE 813 2HB PHE 813 17.706 -16.873 20.838 59 HD1 PHE 813 HD1 PHE 813 15.086 -14.183 20.769 60 HD2 PHE 813 HD2 PHE 813 18.704 -15.658 22.556 61 HE1 PHE 813 HE1 PHE 813 15.053 -12.306 22.388 62 HE2 PHE 813 HE2 PHE 813 18.669 -13.780 24.176 63 HZ PHE 813 HZ PHE 813 16.843 -12.104 24.092 64 HA ASP 814 HA ASP 814 21.104 -14.940 18.468 65 1HB ASP 814 1HB ASP 814 20.982 -17.110 17.267 66 2HB ASP 814 2HB ASP 814 22.180 -16.041 16.543 67 HA ASP 815 HA ASP 815 20.793 -11.364 15.765 68 1HB ASP 815 1HB ASP 815 18.191 -12.521 15.299 69 2HB ASP 815 2HB ASP 815 18.058 -10.763 15.264 70 HA VAL 816 HA VAL 816 19.130 -8.580 18.966 71 HB VAL 816 HB VAL 816 19.127 -9.241 21.380 72 1HG1 VAL 816 1HG1 VAL 816 17.275 -9.865 19.805 73 2HG1 VAL 816 2HG1 VAL 816 18.072 -11.418 19.552 74 3HG1 VAL 816 3HG1 VAL 816 17.458 -10.991 21.150 75 1HG2 VAL 816 1HG2 VAL 816 21.210 -10.893 20.656 76 2HG2 VAL 816 2HG2 VAL 816 20.302 -11.026 22.162 77 3HG2 VAL 816 3HG2 VAL 816 19.869 -12.030 20.779 78 HA GLU 817 HA GLU 817 22.999 -6.753 20.078 79 1HB GLU 817 1HB GLU 817 23.630 -9.121 18.882 80 2HB GLU 817 2HB GLU 817 24.463 -7.989 17.814 81 1HG GLU 817 1HG GLU 817 25.799 -7.135 19.559 82 2HG GLU 817 2HG GLU 817 24.727 -7.768 20.809 83 HA GLU 818 HA GLU 818 23.114 -3.802 16.670 84 1HB GLU 818 1HB GLU 818 20.857 -5.304 15.302 85 2HB GLU 818 2HB GLU 818 21.793 -4.014 14.547 86 1HG GLU 818 1HG GLU 818 23.860 -5.466 15.268 87 2HG GLU 818 2HG GLU 818 22.677 -6.773 15.342 88 HA ASP 819 HA ASP 819 19.825 -1.229 18.322 89 1HB ASP 819 1HB ASP 819 22.305 0.405 17.720 90 2HB ASP 819 2HB ASP 819 20.854 1.114 18.429 91 HA GLU 820 HA GLU 820 18.152 0.293 14.519 92 1HB GLU 820 1HB GLU 820 16.678 1.805 16.699 93 2HB GLU 820 2HB GLU 820 16.140 1.729 15.021 94 1HG GLU 820 1HG GLU 820 16.528 -0.913 15.512 95 2HG GLU 820 2HG GLU 820 16.070 -0.361 17.124 96 1HA GLY 821 1HA GLY 821 20.242 3.990 13.396 97 2HA GLY 821 2HA GLY 821 18.920 4.211 12.250 98 HA LEU 822 HA LEU 822 17.575 7.155 15.326 99 1HB LEU 822 1HB LEU 822 16.696 7.586 12.535 100 2HB LEU 822 2HB LEU 822 15.803 8.514 13.741 101 HG LEU 822 HG LEU 822 18.205 9.035 14.690 102 1HD1 LEU 822 1HD1 LEU 822 19.064 7.387 12.789 103 2HD1 LEU 822 2HD1 LEU 822 18.973 8.845 11.803 104 3HD1 LEU 822 3HD1 LEU 822 19.998 8.814 13.237 105 1HD2 LEU 822 1HD2 LEU 822 16.401 10.465 13.300 106 2HD2 LEU 822 2HD2 LEU 822 17.987 11.113 13.716 107 3HD2 LEU 822 3HD2 LEU 822 17.701 10.443 12.109 108 HA ASP 823 HA ASP 823 13.196 5.124 15.307 109 1HB ASP 823 1HB ASP 823 13.564 7.066 16.769 110 2HB ASP 823 2HB ASP 823 12.833 8.129 15.567 111 HA ASP 824 HA ASP 824 10.337 6.700 11.998 112 1HB ASP 824 1HB ASP 824 11.384 9.187 12.346 113 2HB ASP 824 2HB ASP 824 11.702 8.951 10.627 114 HA LEU 825 HA LEU 825 12.443 4.528 8.717 115 1HB LEU 825 1HB LEU 825 13.953 6.770 9.112 116 2HB LEU 825 2HB LEU 825 15.208 5.531 9.084 117 HG LEU 825 HG LEU 825 13.052 5.733 6.970 118 1HD1 LEU 825 1HD1 LEU 825 14.793 7.721 7.299 119 2HD1 LEU 825 2HD1 LEU 825 15.874 6.596 6.475 120 3HD1 LEU 825 3HD1 LEU 825 14.385 7.125 5.689 121 1HD2 LEU 825 1HD2 LEU 825 15.520 4.098 7.429 122 2HD2 LEU 825 2HD2 LEU 825 13.958 3.605 6.777 123 3HD2 LEU 825 3HD2 LEU 825 15.087 4.509 5.770 124 HA GLU 826 HA GLU 826 14.683 1.275 10.963 125 1HB GLU 826 1HB GLU 826 12.239 0.710 11.301 126 2HB GLU 826 2HB GLU 826 12.278 -0.112 9.741 127 1HG GLU 826 1HG GLU 826 14.212 -1.489 10.631 128 2HG GLU 826 2HG GLU 826 13.880 -0.794 12.218 129 HA ASN 827 HA ASN 827 16.445 0.277 6.902 130 1HB ASN 827 1HB ASN 827 18.228 1.476 8.380 131 2HB ASN 827 2HB ASN 827 18.764 -0.157 8.781 132 2HD2 ASN 827 1HD2 ASN 827 20.799 0.201 7.584 133 1HD2 ASN 827 2HD2 ASN 827 20.814 0.191 5.887 134 HA ALA 828 HA ALA 828 16.370 -4.093 8.085 135 1HB ALA 828 2HB ALA 828 13.734 -3.894 6.621 136 2HB ALA 828 3HB ALA 828 14.185 -5.004 7.914 137 3HB ALA 828 1HB ALA 828 13.903 -3.301 8.273 138 HA GLU 829 HA GLU 829 17.029 -5.680 3.942 139 1HB GLU 829 1HB GLU 829 15.922 -7.676 5.442 140 2HB GLU 829 2HB GLU 829 14.969 -7.808 3.964 141 1HG GLU 829 1HG GLU 829 16.752 -8.508 2.719 142 2HG GLU 829 2HG GLU 829 17.887 -7.461 3.572 143 HA GLU 830 HA GLU 830 12.043 -4.124 2.849 144 1HB GLU 830 1HB GLU 830 14.576 -3.193 2.115 145 2HB GLU 830 2HB GLU 830 13.893 -3.802 0.608 146 1HG GLU 830 1HG GLU 830 11.907 -2.428 0.893 147 2HG GLU 830 2HG GLU 830 12.456 -1.904 2.486 148 HA GLU 831 HA GLU 831 12.956 -7.984 -0.025 149 1HB GLU 831 1HB GLU 831 12.712 -10.195 1.089 150 2HB GLU 831 2HB GLU 831 14.025 -9.255 1.796 151 1HG GLU 831 1HG GLU 831 11.901 -8.437 3.322 152 2HG GLU 831 2HG GLU 831 11.468 -10.115 2.997 153 1HA GLY 832 1HA GLY 832 8.485 -9.109 0.626 154 2HA GLY 832 2HA GLY 832 8.672 -8.305 -0.933 155 HA GLN 833 HA GLN 833 7.893 -12.305 -2.631 156 1HB GLN 833 1HB GLN 833 6.446 -13.887 -1.366 157 2HB GLN 833 2HB GLN 833 7.599 -13.079 -0.300 158 1HG GLN 833 1HG GLN 833 5.805 -11.364 0.186 159 2HG GLN 833 2HG GLN 833 4.675 -12.400 -0.686 160 2HE2 GLN 833 1HE2 GLN 833 5.347 -14.952 0.157 161 1HE2 GLN 833 2HE2 GLN 833 5.175 -15.089 1.840 162 HA GLU 834 HA GLU 834 4.484 -11.094 -5.156 163 1HB GLU 834 1HB GLU 834 3.730 -10.370 -2.608 164 2HB GLU 834 2HB GLU 834 3.426 -8.880 -3.502 165 1HG GLU 834 1HG GLU 834 2.233 -10.371 -5.232 166 2HG GLU 834 2HG GLU 834 2.259 -11.620 -3.986 167 HA ASN 835 HA ASN 835 6.501 -7.531 -7.037 168 1HB ASN 835 1HB ASN 835 4.854 -8.473 -9.381 169 2HB ASN 835 2HB ASN 835 6.429 -7.701 -9.383 170 2HD2 ASN 835 1HD2 ASN 835 8.225 -9.129 -8.251 171 1HD2 ASN 835 2HD2 ASN 835 8.187 -10.782 -8.632 172 HA VAL 836 HA VAL 836 2.681 -5.339 -7.316 173 HB VAL 836 HB VAL 836 2.268 -4.573 -5.224 174 1HG1 VAL 836 1HG1 VAL 836 5.072 -5.603 -4.779 175 2HG1 VAL 836 2HG1 VAL 836 3.866 -5.348 -3.517 176 3HG1 VAL 836 3HG1 VAL 836 3.596 -6.567 -4.762 177 1HG2 VAL 836 1HG2 VAL 836 4.879 -3.078 -5.486 178 2HG2 VAL 836 2HG2 VAL 836 3.247 -2.414 -5.508 179 3HG2 VAL 836 3HG2 VAL 836 3.920 -3.057 -4.011 180 HA GLU 837 HA GLU 837 4.179 -1.622 -9.208 181 1HB GLU 837 1HB GLU 837 2.526 -3.286 -10.776 182 2HB GLU 837 2HB GLU 837 1.857 -1.668 -10.941 183 1HG GLU 837 1HG GLU 837 4.228 -0.868 -11.402 184 2HG GLU 837 2HG GLU 837 3.516 -1.884 -12.656 185 HA ILE 838 HA ILE 838 0.578 0.851 -8.031 186 HB ILE 838 HB ILE 838 3.290 1.804 -7.796 187 1HG1 ILE 838 1HG1 ILE 838 0.812 1.705 -6.156 188 2HG1 ILE 838 2HG1 ILE 838 2.102 2.773 -5.619 189 1HG2 ILE 838 1HG2 ILE 838 1.171 3.954 -7.928 190 2HG2 ILE 838 2HG2 ILE 838 2.768 4.181 -7.219 191 3HG2 ILE 838 3HG2 ILE 838 2.611 3.827 -8.938 192 1HD1 ILE 838 1HD1 ILE 838 2.954 0.051 -6.441 193 2HD1 ILE 838 2HD1 ILE 838 3.496 1.036 -5.086 194 3HD1 ILE 838 3HD1 ILE 838 1.989 0.131 -4.970 195 HA LEU 839 HA LEU 839 -0.408 4.327 -10.787 196 1HB LEU 839 1HB LEU 839 -1.242 1.646 -11.328 197 2HB LEU 839 2HB LEU 839 -2.629 2.697 -11.615 198 HG LEU 839 HG LEU 839 -0.592 4.139 -12.769 199 1HD1 LEU 839 1HD1 LEU 839 0.152 1.271 -12.706 200 2HD1 LEU 839 2HD1 LEU 839 0.270 2.046 -14.286 201 3HD1 LEU 839 3HD1 LEU 839 1.171 2.695 -12.917 202 1HD2 LEU 839 1HD2 LEU 839 -2.959 3.261 -13.566 203 2HD2 LEU 839 2HD2 LEU 839 -1.747 3.742 -14.753 204 3HD2 LEU 839 3HD2 LEU 839 -1.994 2.034 -14.387 205 HA PRO 840 HA PRO 840 -3.699 6.420 -8.728 206 1HB PRO 840 1HB PRO 840 -4.096 8.108 -10.183 207 2HB PRO 840 2HB PRO 840 -5.182 7.062 -11.103 208 1HG PRO 840 1HG PRO 840 -2.578 7.996 -11.861 209 2HG PRO 840 2HG PRO 840 -3.640 6.910 -12.762 210 1HD PRO 840 1HD PRO 840 -2.206 5.188 -12.331 211 2HD PRO 840 2HD PRO 840 -1.188 6.261 -11.339 212 HA SER 841 HA SER 841 -6.680 3.182 -8.013 213 1HB SER 841 1HB SER 841 -8.581 4.073 -6.963 214 2HB SER 841 2HB SER 841 -7.391 5.343 -6.694 215 HG SER 841 HG SER 841 -9.639 5.297 -8.309 216 1HA GLY 842 1HA GLY 842 -8.980 3.377 -11.827 217 2HA GLY 842 2HA GLY 842 -7.958 1.955 -12.000 218 HA GLU 843 HA GLU 843 -10.525 -1.710 -11.141 219 1HB GLU 843 1HB GLU 843 -10.776 -0.474 -8.965 220 2HB GLU 843 2HB GLU 843 -11.947 0.587 -9.749 221 1HG GLU 843 1HG GLU 843 -12.840 -1.970 -10.399 222 2HG GLU 843 2HG GLU 843 -12.300 -2.127 -8.727 223 HA ARG 844 HA ARG 844 -12.919 0.448 -14.438 224 1HB ARG 844 1HB ARG 844 -10.652 -0.957 -15.864 225 2HB ARG 844 2HB ARG 844 -11.910 -0.037 -16.692 226 1HG ARG 844 1HG ARG 844 -11.184 2.003 -15.811 227 2HG ARG 844 2HG ARG 844 -10.370 1.236 -14.446 228 1HD ARG 844 1HD ARG 844 -8.857 0.153 -16.319 229 2HD ARG 844 2HD ARG 844 -8.564 1.837 -15.841 230 HE ARG 844 HE ARG 844 -10.465 1.270 -18.073 231 1HH1 ARG 844 1HH1 ARG 844 -7.188 1.394 -17.908 232 2HH1 ARG 844 2HH1 ARG 844 -6.981 2.824 -18.864 233 1HH2 ARG 844 1HH2 ARG 844 -10.354 3.630 -18.866 234 2HH2 ARG 844 2HH2 ARG 844 -8.773 4.090 -19.405 235 HA PRO 845 HA PRO 845 -15.525 -3.113 -14.877 236 1HB PRO 845 1HB PRO 845 -16.913 -1.875 -17.076 237 2HB PRO 845 2HB PRO 845 -17.428 -1.973 -15.389 238 1HG PRO 845 1HG PRO 845 -16.532 0.345 -16.813 239 2HG PRO 845 2HG PRO 845 -17.014 0.236 -15.117 240 1HD PRO 845 1HD PRO 845 -14.840 0.512 -14.482 241 2HD PRO 845 2HD PRO 845 -14.342 0.574 -16.190 242 HA GLN 846 HA GLN 846 -13.772 -5.271 -18.323 243 1HB GLN 846 1HB GLN 846 -13.576 -3.007 -19.274 244 2HB GLN 846 2HB GLN 846 -12.017 -2.802 -18.476 245 1HG GLN 846 1HG GLN 846 -11.630 -5.154 -19.838 246 2HG GLN 846 2HG GLN 846 -11.150 -3.564 -20.432 247 2HE2 GLN 846 1HE2 GLN 846 -13.356 -2.369 -21.379 248 1HE2 GLN 846 2HE2 GLN 846 -14.187 -3.326 -22.507 249 HA ALA 847 HA ALA 847 -9.474 -6.029 -16.657 250 1HB ALA 847 2HB ALA 847 -9.093 -4.040 -14.474 251 2HB ALA 847 1HB ALA 847 -9.179 -3.395 -16.114 252 3HB ALA 847 3HB ALA 847 -7.953 -4.593 -15.700 253 HA ASN 848 HA ASN 848 -11.906 -6.753 -12.437 254 1HB ASN 848 1HB ASN 848 -13.900 -6.926 -14.304 255 2HB ASN 848 2HB ASN 848 -13.596 -8.634 -13.983 256 2HD2 ASN 848 1HD2 ASN 848 -14.060 -9.448 -11.830 257 1HD2 ASN 848 2HD2 ASN 848 -14.927 -8.532 -10.695 258 HA GLN 849 HA GLN 849 -9.498 -10.482 -13.287 259 1HB GLN 849 1HB GLN 849 -7.886 -8.207 -12.727 260 2HB GLN 849 2HB GLN 849 -7.300 -9.502 -11.686 261 1HG GLN 849 1HG GLN 849 -7.012 -10.975 -13.605 262 2HG GLN 849 2HG GLN 849 -7.729 -9.772 -14.675 263 2HE2 GLN 849 1HE2 GLN 849 -5.899 -8.110 -12.369 264 1HE2 GLN 849 2HE2 GLN 849 -4.461 -7.937 -13.241 265 HA LYS 850 HA LYS 850 -8.287 -11.624 -8.731 266 1HB LYS 850 1HB LYS 850 -10.050 -13.339 -8.435 267 2HB LYS 850 2HB LYS 850 -10.694 -11.916 -9.247 268 1HG LYS 850 1HG LYS 850 -9.952 -13.290 -11.420 269 2HG LYS 850 2HG LYS 850 -11.521 -13.556 -10.655 270 1HD LYS 850 1HD LYS 850 -9.118 -15.297 -10.718 271 2HD LYS 850 2HD LYS 850 -9.957 -15.217 -9.169 272 1HE LYS 850 1HE LYS 850 -12.121 -15.673 -10.468 273 2HE LYS 850 2HE LYS 850 -10.970 -17.024 -10.421 274 1HZ LYS 850 1HZ LYS 850 -10.023 -16.116 -12.521 275 2HZ LYS 850 2HZ LYS 850 -11.621 -16.668 -12.688 276 3HZ LYS 850 3HZ LYS 850 -11.307 -15.005 -12.582 277 HA ARG 851 HA ARG 851 -6.677 -15.918 -9.110 278 1HB ARG 851 1HB ARG 851 -5.283 -13.610 -10.156 279 2HB ARG 851 2HB ARG 851 -4.123 -14.758 -9.491 280 1HG ARG 851 1HG ARG 851 -6.333 -15.858 -11.169 281 2HG ARG 851 2HG ARG 851 -5.041 -14.984 -11.994 282 1HD ARG 851 1HD ARG 851 -3.760 -16.678 -10.111 283 2HD ARG 851 2HD ARG 851 -3.791 -16.872 -11.875 284 HE ARG 851 HE ARG 851 -5.950 -17.945 -10.083 285 1HH1 ARG 851 1HH1 ARG 851 -7.170 -18.611 -12.313 286 2HH1 ARG 851 2HH1 ARG 851 -6.316 -19.906 -13.083 287 1HH2 ARG 851 1HH2 ARG 851 -3.396 -19.406 -11.281 288 2HH2 ARG 851 2HH2 ARG 851 -4.179 -20.356 -12.499 289 HA ILE 852 HA ILE 852 -4.453 -15.487 -5.118 290 HB ILE 852 HB ILE 852 -2.042 -14.751 -5.174 291 1HG1 ILE 852 1HG1 ILE 852 -1.791 -13.726 -7.744 292 2HG1 ILE 852 2HG1 ILE 852 -3.214 -12.901 -7.139 293 1HG2 ILE 852 1HG2 ILE 852 -3.108 -16.737 -6.473 294 2HG2 ILE 852 2HG2 ILE 852 -2.890 -15.722 -7.899 295 3HG2 ILE 852 3HG2 ILE 852 -1.493 -16.209 -6.940 296 1HD1 ILE 852 1HD1 ILE 852 -0.786 -13.094 -5.389 297 2HD1 ILE 852 2HD1 ILE 852 -0.840 -11.885 -6.671 298 3HD1 ILE 852 3HD1 ILE 852 -2.055 -11.878 -5.395 299 HA THR 853 HA THR 853 -3.468 -10.970 -3.549 300 HB THR 853 HB THR 853 -4.660 -8.989 -4.561 301 HG1 THR 853 HG1 THR 853 -5.852 -11.003 -5.911 302 1HG2 THR 853 1HG2 THR 853 -2.326 -9.730 -5.124 303 2HG2 THR 853 2HG2 THR 853 -2.997 -10.596 -6.498 304 3HG2 THR 853 3HG2 THR 853 -3.140 -8.846 -6.413 305 HA THR 854 HA THR 854 -7.144 -12.094 -1.345 306 HB THR 854 HB THR 854 -5.324 -12.439 0.293 307 HG1 THR 854 HG1 THR 854 -6.652 -12.226 1.923 308 1HG2 THR 854 1HG2 THR 854 -4.708 -9.782 -0.262 309 2HG2 THR 854 2HG2 THR 854 -5.338 -9.731 1.385 310 3HG2 THR 854 3HG2 THR 854 -3.970 -10.775 0.996 311 HA PRO 855 HA PRO 855 -9.198 -8.231 -2.196 312 1HB PRO 855 1HB PRO 855 -11.337 -8.999 -2.035 313 2HB PRO 855 2HB PRO 855 -11.249 -8.886 -0.273 314 1HG PRO 855 1HG PRO 855 -11.328 -11.262 -1.847 315 2HG PRO 855 2HG PRO 855 -11.084 -11.149 -0.102 316 1HD PRO 855 1HD PRO 855 -8.945 -11.914 -0.431 317 2HD PRO 855 2HD PRO 855 -9.111 -11.762 -2.198 318 HA TYR 856 HA TYR 856 -7.819 -5.608 1.094 319 1HB TYR 856 1HB TYR 856 -8.392 -7.634 2.382 320 2HB TYR 856 2HB TYR 856 -6.785 -8.273 2.098 321 HD1 TYR 856 HD1 TYR 856 -4.791 -6.682 2.893 322 HD2 TYR 856 HD2 TYR 856 -8.830 -6.447 4.333 323 HE1 TYR 856 HE1 TYR 856 -3.996 -5.545 4.935 324 HE2 TYR 856 HE2 TYR 856 -8.033 -5.309 6.377 325 HH TYR 856 HH TYR 856 -4.878 -5.296 7.362 326 HA MET 857 HA MET 857 -3.803 -5.357 -1.029 327 1HB MET 857 1HB MET 857 -4.826 -3.087 -1.301 328 2HB MET 857 2HB MET 857 -4.331 -2.704 0.340 329 1HG MET 857 1HG MET 857 -2.035 -3.720 -1.004 330 2HG MET 857 2HG MET 857 -2.305 -2.083 -0.419 331 1HE MET 857 1HE MET 857 -4.656 -1.048 -1.876 332 2HE MET 857 2HE MET 857 -3.161 -0.128 -1.775 333 3HE MET 857 3HE MET 857 -3.991 -0.284 -3.322 334 HA THR 858 HA THR 858 -1.536 -5.353 2.859 335 HB THR 858 HB THR 858 0.280 -7.012 2.477 336 HG1 THR 858 HG1 THR 858 0.955 -7.406 0.506 337 1HG2 THR 858 1HG2 THR 858 -2.394 -7.398 1.118 338 2HG2 THR 858 2HG2 THR 858 -1.279 -8.721 1.459 339 3HG2 THR 858 3HG2 THR 858 -1.976 -7.791 2.786 340 HA LYS 859 HA LYS 859 0.892 -1.812 3.482 341 1HB LYS 859 1HB LYS 859 1.259 -3.111 5.519 342 2HB LYS 859 2HB LYS 859 2.775 -2.379 4.994 343 1HG LYS 859 1HG LYS 859 2.220 -5.067 3.880 344 2HG LYS 859 2HG LYS 859 2.501 -5.020 5.620 345 1HD LYS 859 1HD LYS 859 4.333 -3.727 3.578 346 2HD LYS 859 2HD LYS 859 4.636 -3.922 5.304 347 1HE LYS 859 1HE LYS 859 4.700 -6.356 5.064 348 2HE LYS 859 2HE LYS 859 4.283 -6.220 3.345 349 1HZ LYS 859 3HZ LYS 859 6.254 -4.852 3.015 350 2HZ LYS 859 1HZ LYS 859 6.670 -5.023 4.654 351 3HZ LYS 859 2HZ LYS 859 6.681 -6.376 3.632 352 HA TYR 860 HA TYR 860 4.830 -3.116 1.098 353 1HB TYR 860 1HB TYR 860 4.867 -5.520 1.082 354 2HB TYR 860 2HB TYR 860 3.547 -5.596 -0.077 355 HD1 TYR 860 HD1 TYR 860 6.051 -2.934 -0.351 356 HD2 TYR 860 HD2 TYR 860 4.993 -6.874 -1.713 357 HE1 TYR 860 HE1 TYR 860 7.637 -2.693 -2.225 358 HE2 TYR 860 HE2 TYR 860 6.594 -6.623 -3.591 359 HH TYR 860 HH TYR 860 8.910 -4.115 -3.736 360 HA GLU 861 HA GLU 861 2.304 -2.687 -3.083 361 1HB GLU 861 1HB GLU 861 -0.150 -3.043 -1.342 362 2HB GLU 861 2HB GLU 861 -0.247 -2.257 -2.918 363 1HG GLU 861 1HG GLU 861 1.169 -4.461 -3.596 364 2HG GLU 861 2HG GLU 861 -0.593 -4.398 -3.647 365 HA ARG 862 HA ARG 862 1.103 1.332 -0.763 366 1HB ARG 862 1HB ARG 862 0.324 -0.330 1.367 367 2HB ARG 862 2HB ARG 862 1.483 0.803 2.062 368 1HG ARG 862 1HG ARG 862 -0.802 1.727 2.160 369 2HG ARG 862 2HG ARG 862 0.216 2.695 1.103 370 1HD ARG 862 1HD ARG 862 -0.799 0.878 -0.683 371 2HD ARG 862 2HD ARG 862 -2.159 1.065 0.440 372 HE ARG 862 HE ARG 862 -0.836 3.564 -0.407 373 1HH1 ARG 862 1HH1 ARG 862 -3.500 3.814 0.665 374 2HH1 ARG 862 2HH1 ARG 862 -4.520 3.839 -0.734 375 1HH2 ARG 862 1HH2 ARG 862 -2.110 2.505 -2.841 376 2HH2 ARG 862 2HH2 ARG 862 -3.736 3.091 -2.719 377 HA ALA 863 HA ALA 863 5.398 1.299 1.333 378 1HB ALA 863 2HB ALA 863 6.423 -1.425 0.836 379 2HB ALA 863 3HB ALA 863 6.541 -0.435 2.290 380 3HB ALA 863 1HB ALA 863 5.072 -1.353 1.966 381 HA ARG 864 HA ARG 864 7.036 0.267 -2.970 382 1HB ARG 864 1HB ARG 864 4.775 -1.476 -3.273 383 2HB ARG 864 2HB ARG 864 4.792 -0.399 -4.669 384 1HG ARG 864 1HG ARG 864 7.474 -1.334 -4.020 385 2HG ARG 864 2HG ARG 864 6.378 -2.682 -4.316 386 1HD ARG 864 1HD ARG 864 5.687 -0.968 -6.353 387 2HD ARG 864 2HD ARG 864 6.877 -2.273 -6.519 388 HE ARG 864 HE ARG 864 7.475 0.574 -6.387 389 1HH1 ARG 864 1HH1 ARG 864 8.808 -2.364 -7.061 390 2HH1 ARG 864 2HH1 ARG 864 10.366 -2.046 -6.376 391 1HH2 ARG 864 1HH2 ARG 864 9.383 0.906 -4.842 392 2HH2 ARG 864 2HH2 ARG 864 10.692 -0.194 -5.120 393 HA VAL 865 HA VAL 865 3.239 3.286 -4.289 394 HB VAL 865 HB VAL 865 2.443 2.029 -1.738 395 1HG1 VAL 865 1HG1 VAL 865 2.063 4.928 -2.156 396 2HG1 VAL 865 2HG1 VAL 865 0.728 4.001 -1.476 397 3HG1 VAL 865 3HG1 VAL 865 2.291 4.015 -0.664 398 1HG2 VAL 865 1HG2 VAL 865 0.960 3.093 -4.093 399 2HG2 VAL 865 2HG2 VAL 865 1.362 1.415 -3.738 400 3HG2 VAL 865 3HG2 VAL 865 0.208 2.270 -2.725 401 HA LEU 866 HA LEU 866 4.821 5.948 -0.402 402 1HB LEU 866 1HB LEU 866 4.944 4.628 1.492 403 2HB LEU 866 2HB LEU 866 5.531 3.235 0.594 404 HG LEU 866 HG LEU 866 7.447 5.488 0.778 405 1HD1 LEU 866 1HD1 LEU 866 6.128 5.201 3.061 406 2HD1 LEU 866 2HD1 LEU 866 7.180 3.796 3.232 407 3HD1 LEU 866 3HD1 LEU 866 7.880 5.405 3.051 408 1HD2 LEU 866 1HD2 LEU 866 7.462 2.481 1.036 409 2HD2 LEU 866 2HD2 LEU 866 8.276 3.484 -0.164 410 3HD2 LEU 866 3HD2 LEU 866 8.872 3.436 1.494 411 1HA GLY 867 1HA GLY 867 9.071 4.906 -2.286 412 2HA GLY 867 2HA GLY 867 8.631 3.472 -3.222 413 HA THR 868 HA THR 868 7.125 5.990 -6.522 414 HB THR 868 HB THR 868 5.012 5.426 -7.457 415 HG1 THR 868 HG1 THR 868 3.536 5.825 -5.941 416 1HG2 THR 868 1HG2 THR 868 6.784 3.600 -6.511 417 2HG2 THR 868 2HG2 THR 868 5.263 3.021 -5.828 418 3HG2 THR 868 3HG2 THR 868 5.422 3.231 -7.570 419 HA ARG 869 HA ARG 869 4.180 8.916 -4.202 420 1HB ARG 869 1HB ARG 869 4.385 6.978 -2.023 421 2HB ARG 869 2HB ARG 869 4.655 8.613 -1.417 422 1HG ARG 869 1HG ARG 869 2.261 8.022 -1.344 423 2HG ARG 869 2HG ARG 869 2.557 9.356 -2.457 424 1HD ARG 869 1HD ARG 869 2.856 7.017 -4.011 425 2HD ARG 869 2HD ARG 869 1.403 6.760 -3.024 426 HE ARG 869 HE ARG 869 0.967 9.293 -3.806 427 1HH1 ARG 869 1HH1 ARG 869 3.097 7.752 -5.815 428 2HH1 ARG 869 2HH1 ARG 869 2.095 7.783 -7.228 429 1HH2 ARG 869 1HH2 ARG 869 -0.728 8.858 -5.526 430 2HH2 ARG 869 2HH2 ARG 869 -0.070 8.410 -7.065 431 HA ALA 870 HA ALA 870 8.299 10.012 -1.794 432 1HB ALA 870 3HB ALA 870 8.967 7.979 -0.797 433 2HB ALA 870 2HB ALA 870 10.271 8.314 -1.936 434 3HB ALA 870 1HB ALA 870 9.019 7.143 -2.349 435 HA LEU 871 HA LEU 871 10.359 10.067 -5.913 436 1HB LEU 871 1HB LEU 871 9.393 8.547 -8.095 437 2HB LEU 871 2HB LEU 871 10.926 8.354 -7.263 438 HG LEU 871 HG LEU 871 8.521 7.098 -6.039 439 1HD1 LEU 871 3HD1 LEU 871 8.324 6.560 -8.436 440 2HD1 LEU 871 1HD1 LEU 871 9.990 5.983 -8.435 441 3HD1 LEU 871 2HD1 LEU 871 8.763 5.137 -7.493 442 1HD2 LEU 871 1HD2 LEU 871 11.445 6.365 -6.386 443 2HD2 LEU 871 2HD2 LEU 871 10.680 6.949 -4.908 444 3HD2 LEU 871 3HD2 LEU 871 10.267 5.358 -5.544 445 HA GLN 872 HA GLN 872 6.247 11.018 -8.435 446 1HB GLN 872 1HB GLN 872 5.088 9.943 -5.991 447 2HB GLN 872 2HB GLN 872 4.444 11.544 -6.322 448 1HG GLN 872 1HG GLN 872 3.909 10.792 -8.661 449 2HG GLN 872 2HG GLN 872 3.026 9.901 -7.427 450 2HE2 GLN 872 1HE2 GLN 872 5.750 9.674 -9.719 451 1HE2 GLN 872 2HE2 GLN 872 5.856 7.981 -9.680 452 HA ILE 873 HA ILE 873 6.432 14.865 -5.456 453 HB ILE 873 HB ILE 873 7.497 14.596 -3.065 454 1HG1 ILE 873 1HG1 ILE 873 6.325 12.050 -2.619 455 2HG1 ILE 873 2HG1 ILE 873 7.381 11.873 -4.013 456 1HG2 ILE 873 1HG2 ILE 873 4.781 14.008 -4.103 457 2HG2 ILE 873 2HG2 ILE 873 5.082 13.752 -2.387 458 3HG2 ILE 873 3HG2 ILE 873 5.337 15.343 -3.097 459 1HD1 ILE 873 1HD1 ILE 873 8.492 13.432 -1.774 460 2HD1 ILE 873 2HD1 ILE 873 8.255 11.713 -1.474 461 3HD1 ILE 873 3HD1 ILE 873 9.258 12.245 -2.821 462 HA ALA 874 HA ALA 874 11.141 14.070 -4.694 463 1HB ALA 874 1HB ALA 874 10.906 11.537 -6.326 464 2HB ALA 874 3HB ALA 874 11.234 11.632 -4.597 465 3HB ALA 874 2HB ALA 874 12.427 12.215 -5.752 466 HA MET 875 HA MET 875 10.964 15.200 -9.185 467 1HB MET 875 1HB MET 875 8.908 13.372 -9.541 468 2HB MET 875 2HB MET 875 8.111 14.900 -9.919 469 1HG MET 875 1HG MET 875 10.300 15.334 -11.334 470 2HG MET 875 2HG MET 875 8.995 14.351 -11.998 471 1HE MET 875 1HE MET 875 10.004 13.430 -13.549 472 2HE MET 875 2HE MET 875 11.755 13.234 -13.573 473 3HE MET 875 3HE MET 875 10.718 11.816 -13.430 474 HA CYS 876 HA CYS 876 8.143 18.438 -7.321 475 1HB CYS 876 1HB CYS 876 6.171 17.339 -9.335 476 2HB CYS 876 2HB CYS 876 5.800 18.821 -8.453 477 HG CYS 876 HG CYS 876 8.532 19.169 -9.555 478 HA ALA 877 HA ALA 877 4.961 15.579 -5.046 479 1HB ALA 877 3HB ALA 877 5.054 17.651 -4.065 480 2HB ALA 877 1HB ALA 877 4.183 18.428 -5.387 481 3HB ALA 877 2HB ALA 877 3.311 17.430 -4.222 482 HA PRO 878 HA PRO 878 1.275 14.917 -8.081 483 1HB PRO 878 1HB PRO 878 2.201 12.214 -8.353 484 2HB PRO 878 2HB PRO 878 2.093 13.446 -9.614 485 1HG PRO 878 1HG PRO 878 4.351 13.536 -9.667 486 2HG PRO 878 2HG PRO 878 4.453 12.408 -8.322 487 1HD PRO 878 1HD PRO 878 5.153 14.111 -7.002 488 2HD PRO 878 2HD PRO 878 4.864 15.273 -8.315 489 HA VAL 879 HA VAL 879 1.438 11.523 -4.387 490 HB VAL 879 HB VAL 879 3.101 13.807 -3.400 491 1HG1 VAL 879 1HG1 VAL 879 1.394 13.257 -1.570 492 2HG1 VAL 879 2HG1 VAL 879 2.223 11.712 -1.436 493 3HG1 VAL 879 3HG1 VAL 879 3.089 13.209 -1.137 494 1HG2 VAL 879 1HG2 VAL 879 3.718 11.407 -4.496 495 2HG2 VAL 879 2HG2 VAL 879 4.792 12.274 -3.421 496 3HG2 VAL 879 3HG2 VAL 879 3.775 10.993 -2.787 497 HA MET 880 HA MET 880 -2.239 13.525 -2.981 498 1HB MET 880 1HB MET 880 -1.562 11.283 -1.113 499 2HB MET 880 2HB MET 880 -3.005 12.241 -0.782 500 1HG MET 880 1HG MET 880 -2.425 10.997 -3.481 501 2HG MET 880 2HG MET 880 -3.399 10.207 -2.242 502 1HE MET 880 2HE MET 880 -4.159 10.791 -5.114 503 2HE MET 880 1HE MET 880 -5.255 12.132 -5.434 504 3HE MET 880 3HE MET 880 -3.522 12.429 -5.313 505 HA VAL 881 HA VAL 881 -0.909 16.485 0.068 506 HB VAL 881 HB VAL 881 0.990 16.076 1.725 507 1HG1 VAL 881 1HG1 VAL 881 -1.471 14.851 1.515 508 2HG1 VAL 881 2HG1 VAL 881 -0.390 13.466 1.654 509 3HG1 VAL 881 3HG1 VAL 881 -0.402 14.710 2.903 510 1HG2 VAL 881 1HG2 VAL 881 2.246 14.729 -0.162 511 2HG2 VAL 881 2HG2 VAL 881 2.407 14.239 1.524 512 3HG2 VAL 881 3HG2 VAL 881 1.302 13.374 0.457 513 HA GLU 882 HA GLU 882 2.552 18.537 -1.929 514 1HB GLU 882 1HB GLU 882 0.288 20.171 -0.935 515 2HB GLU 882 2HB GLU 882 1.695 21.076 -1.492 516 1HG GLU 882 1HG GLU 882 1.395 20.461 -3.668 517 2HG GLU 882 2HG GLU 882 0.873 18.832 -3.238 518 HA LEU 883 HA LEU 883 4.754 19.537 2.097 519 1HB LEU 883 1HB LEU 883 5.628 17.267 1.774 520 2HB LEU 883 2HB LEU 883 6.537 17.796 0.361 521 HG LEU 883 HG LEU 883 7.698 19.472 1.902 522 1HD1 LEU 883 1HD1 LEU 883 5.777 18.892 3.677 523 2HD1 LEU 883 2HD1 LEU 883 6.958 17.680 4.172 524 3HD1 LEU 883 3HD1 LEU 883 7.391 19.389 4.186 525 1HD2 LEU 883 1HD2 LEU 883 8.017 16.492 2.386 526 2HD2 LEU 883 2HD2 LEU 883 8.833 17.447 1.148 527 3HD2 LEU 883 3HD2 LEU 883 9.205 17.711 2.852 528 HA GLU 884 HA GLU 884 7.000 22.322 -0.872 529 1HB GLU 884 1HB GLU 884 8.835 20.935 0.814 530 2HB GLU 884 2HB GLU 884 9.746 21.570 -0.555 531 1HG GLU 884 1HG GLU 884 7.754 23.312 0.883 532 2HG GLU 884 2HG GLU 884 9.387 23.108 1.521 533 1HA GLY 885 1HA GLY 885 7.461 19.438 -4.846 534 2HA GLY 885 2HA GLY 885 8.863 20.485 -4.618 535 HA GLU 886 HA GLU 886 10.173 16.194 -2.382 536 1HB GLU 886 1HB GLU 886 10.793 16.199 -4.679 537 2HB GLU 886 2HB GLU 886 11.761 17.661 -4.498 538 1HG GLU 886 1HG GLU 886 13.321 16.358 -3.014 539 2HG GLU 886 2HG GLU 886 12.395 14.907 -3.397 540 HA THR 887 HA THR 887 13.789 17.360 0.011 541 HB THR 887 HB THR 887 11.169 17.854 1.471 542 HG1 THR 887 HG1 THR 887 13.094 19.518 0.219 543 1HG2 THR 887 1HG2 THR 887 13.983 18.070 2.427 544 2HG2 THR 887 2HG2 THR 887 12.900 19.401 2.834 545 3HG2 THR 887 3HG2 THR 887 12.505 17.758 3.339 546 HA ASP 888 HA ASP 888 12.801 13.988 3.083 547 1HB ASP 888 1HB ASP 888 10.417 15.077 3.393 548 2HB ASP 888 2HB ASP 888 9.895 13.569 2.650 549 HA PRO 889 HA PRO 889 13.039 10.650 0.153 550 1HB PRO 889 1HB PRO 889 13.278 8.694 2.245 551 2HB PRO 889 2HB PRO 889 14.569 9.402 1.269 552 1HG PRO 889 1HG PRO 889 14.080 9.837 4.035 553 2HG PRO 889 2HG PRO 889 15.266 10.663 3.018 554 1HD PRO 889 1HD PRO 889 14.053 12.575 3.272 555 2HD PRO 889 2HD PRO 889 12.736 11.687 4.078 556 HA LEU 890 HA LEU 890 8.632 9.530 1.004 557 1HB LEU 890 1HB LEU 890 10.076 7.644 1.803 558 2HB LEU 890 2HB LEU 890 8.413 7.508 2.343 559 HG LEU 890 HG LEU 890 10.153 6.979 4.101 560 1HD1 LEU 890 1HD1 LEU 890 11.685 8.881 3.390 561 2HD1 LEU 890 2HD1 LEU 890 10.573 9.965 4.226 562 3HD1 LEU 890 3HD1 LEU 890 11.423 8.710 5.124 563 1HD2 LEU 890 1HD2 LEU 890 7.714 8.070 4.389 564 2HD2 LEU 890 2HD2 LEU 890 8.754 7.695 5.760 565 3HD2 LEU 890 3HD2 LEU 890 8.680 9.343 5.139 566 HA LEU 891 HA LEU 891 7.442 11.629 5.396 567 1HB LEU 891 1HB LEU 891 8.510 13.672 5.387 568 2HB LEU 891 2HB LEU 891 8.489 13.754 3.637 569 HG LEU 891 HG LEU 891 7.119 15.512 4.807 570 1HD1 LEU 891 1HD1 LEU 891 6.634 14.278 2.418 571 2HD1 LEU 891 2HD1 LEU 891 5.078 14.090 3.229 572 3HD1 LEU 891 3HD1 LEU 891 5.767 15.695 2.999 573 1HD2 LEU 891 1HD2 LEU 891 6.117 13.287 6.199 574 2HD2 LEU 891 2HD2 LEU 891 5.562 14.956 6.328 575 3HD2 LEU 891 3HD2 LEU 891 4.785 13.853 5.192 576 HA ILE 892 HA ILE 892 4.140 12.802 2.064 577 HB ILE 892 HB ILE 892 6.477 12.384 0.332 578 1HG1 ILE 892 1HG1 ILE 892 4.213 14.037 -0.535 579 2HG1 ILE 892 2HG1 ILE 892 4.873 14.457 1.045 580 1HG2 ILE 892 1HG2 ILE 892 3.799 11.330 -0.432 581 2HG2 ILE 892 2HG2 ILE 892 4.734 12.200 -1.634 582 3HG2 ILE 892 3HG2 ILE 892 5.408 10.764 -0.883 583 1HD1 ILE 892 1HD1 ILE 892 6.743 13.864 -1.183 584 2HD1 ILE 892 2HD1 ILE 892 5.944 15.432 -1.154 585 3HD1 ILE 892 3HD1 ILE 892 6.960 14.930 0.199 586 HA ALA 893 HA ALA 893 4.005 8.256 0.665 587 1HB ALA 893 3HB ALA 893 5.968 7.389 -0.105 588 2HB ALA 893 1HB ALA 893 6.898 8.058 1.232 589 3HB ALA 893 2HB ALA 893 5.965 6.583 1.461 590 HA MET 894 HA MET 894 4.233 7.365 5.352 591 1HB MET 894 1HB MET 894 6.404 8.275 5.898 592 2HB MET 894 2HB MET 894 5.858 9.919 5.586 593 1HG MET 894 1HG MET 894 4.386 9.836 7.537 594 2HG MET 894 2HG MET 894 4.832 8.155 7.832 595 1HE MET 894 3HE MET 894 6.135 11.379 6.810 596 2HE MET 894 2HE MET 894 6.720 12.054 8.336 597 3HE MET 894 1HE MET 894 7.851 11.319 7.205 598 HA LYS 895 HA LYS 895 1.747 11.458 6.269 599 1HB LYS 895 1HB LYS 895 2.943 13.272 5.383 600 2HB LYS 895 2HB LYS 895 3.094 12.518 3.797 601 1HG LYS 895 1HG LYS 895 0.664 12.880 3.421 602 2HG LYS 895 2HG LYS 895 1.535 14.392 3.673 603 1HD LYS 895 1HD LYS 895 -0.676 13.346 5.166 604 2HD LYS 895 2HD LYS 895 0.725 13.412 6.236 605 1HE LYS 895 1HE LYS 895 1.097 15.799 5.445 606 2HE LYS 895 2HE LYS 895 -0.486 15.696 4.647 607 1HZ LYS 895 1HZ LYS 895 -1.403 14.928 6.804 608 2HZ LYS 895 2HZ LYS 895 0.094 15.271 7.529 609 3HZ LYS 895 3HZ LYS 895 -0.824 16.525 6.851 610 HA GLU 896 HA GLU 896 -0.659 10.306 2.128 611 1HB GLU 896 1HB GLU 896 1.817 8.696 1.516 612 2HB GLU 896 2HB GLU 896 0.286 8.251 0.784 613 1HG GLU 896 1HG GLU 896 0.507 11.060 0.487 614 2HG GLU 896 2HG GLU 896 2.074 10.391 0.042 615 HA LEU 897 HA LEU 897 -1.226 6.085 4.041 616 1HB LEU 897 1HB LEU 897 1.007 5.025 3.928 617 2HB LEU 897 2HB LEU 897 1.482 5.881 5.395 618 HG LEU 897 HG LEU 897 0.448 3.354 5.398 619 1HD1 LEU 897 1HD1 LEU 897 0.540 5.591 7.370 620 2HD1 LEU 897 2HD1 LEU 897 -0.352 4.140 7.826 621 3HD1 LEU 897 3HD1 LEU 897 1.356 4.028 7.403 622 1HD2 LEU 897 1HD2 LEU 897 -1.778 4.537 4.587 623 2HD2 LEU 897 2HD2 LEU 897 -1.859 3.304 5.840 624 3HD2 LEU 897 3HD2 LEU 897 -1.917 5.004 6.281 625 HA LYS 898 HA LYS 898 -0.452 8.001 8.556 626 1HB LYS 898 1HB LYS 898 1.552 9.320 7.951 627 2HB LYS 898 2HB LYS 898 0.539 10.365 6.958 628 1HG LYS 898 1HG LYS 898 -0.479 11.368 8.784 629 2HG LYS 898 2HG LYS 898 -0.166 9.994 9.845 630 1HD LYS 898 1HD LYS 898 2.293 11.218 8.821 631 2HD LYS 898 2HD LYS 898 1.314 12.340 9.766 632 1HE LYS 898 1HE LYS 898 1.443 9.703 11.028 633 2HE LYS 898 2HE LYS 898 3.050 10.430 10.825 634 1HZ LYS 898 1HZ LYS 898 2.138 12.516 11.718 635 2HZ LYS 898 2HZ LYS 898 0.660 11.734 12.020 636 3HZ LYS 898 3HZ LYS 898 2.063 11.253 12.848 637 HA ALA 899 HA ALA 899 -3.740 10.796 6.686 638 1HB ALA 899 2HB ALA 899 -4.001 11.423 4.256 639 2HB ALA 899 3HB ALA 899 -2.403 11.820 4.885 640 3HB ALA 899 1HB ALA 899 -2.623 10.390 3.877 641 HA ARG 900 HA ARG 900 -3.930 5.996 4.280 642 1HB ARG 900 1HB ARG 900 -4.569 6.734 6.902 643 2HB ARG 900 2HB ARG 900 -4.910 5.169 6.177 644 1HG ARG 900 1HG ARG 900 -6.832 7.481 5.884 645 2HG ARG 900 2HG ARG 900 -7.144 5.760 5.667 646 1HD ARG 900 1HD ARG 900 -6.782 5.383 8.087 647 2HD ARG 900 2HD ARG 900 -6.486 7.119 8.306 648 HE ARG 900 HE ARG 900 -9.065 6.095 7.175 649 1HH1 ARG 900 1HH1 ARG 900 -10.165 8.304 7.087 650 2HH1 ARG 900 2HH1 ARG 900 -10.227 9.109 8.619 651 1HH2 ARG 900 1HH2 ARG 900 -7.859 7.048 10.096 652 2HH2 ARG 900 2HH2 ARG 900 -8.920 8.398 10.324 653 HA LYS 901 HA LYS 901 -7.262 8.321 2.364 654 1HB LYS 901 1HB LYS 901 -6.442 10.479 3.368 655 2HB LYS 901 2HB LYS 901 -7.142 10.674 1.761 656 1HG LYS 901 1HG LYS 901 -4.173 10.360 2.313 657 2HG LYS 901 2HG LYS 901 -4.922 10.706 0.754 658 1HD LYS 901 1HD LYS 901 -5.263 12.502 3.163 659 2HD LYS 901 2HD LYS 901 -3.969 12.722 1.985 660 1HE LYS 901 1HE LYS 901 -6.793 12.466 0.988 661 2HE LYS 901 2HE LYS 901 -6.246 14.018 1.654 662 1HZ LYS 901 1HZ LYS 901 -4.252 13.808 0.218 663 2HZ LYS 901 2HZ LYS 901 -4.962 12.452 -0.519 664 3HZ LYS 901 3HZ LYS 901 -5.697 13.973 -0.660 665 HA ILE 902 HA ILE 902 -3.895 8.511 -1.360 666 HB ILE 902 HB ILE 902 -3.025 5.860 -0.230 667 1HG1 ILE 902 1HG1 ILE 902 -0.916 7.350 0.393 668 2HG1 ILE 902 2HG1 ILE 902 -2.236 7.132 1.531 669 1HG2 ILE 902 1HG2 ILE 902 -1.984 7.801 -2.287 670 2HG2 ILE 902 2HG2 ILE 902 -0.959 6.544 -1.595 671 3HG2 ILE 902 3HG2 ILE 902 -2.409 6.102 -2.497 672 1HD1 ILE 902 3HD1 ILE 902 -2.888 9.358 -0.158 673 2HD1 ILE 902 1HD1 ILE 902 -2.581 9.356 1.572 674 3HD1 ILE 902 2HD1 ILE 902 -1.259 9.583 0.442 675 HA PRO 903 HA PRO 903 -7.303 5.750 -2.736 676 1HB PRO 903 1HB PRO 903 -7.771 7.641 -4.851 677 2HB PRO 903 2HB PRO 903 -8.765 7.380 -3.414 678 1HG PRO 903 1HG PRO 903 -7.300 9.702 -3.980 679 2HG PRO 903 2HG PRO 903 -7.969 9.267 -2.402 680 1HD PRO 903 1HD PRO 903 -5.763 9.281 -1.703 681 2HD PRO 903 2HD PRO 903 -5.150 9.087 -3.365 682 HA ILE 904 HA ILE 904 -5.253 4.683 -6.521 683 HB ILE 904 HB ILE 904 -3.325 5.240 -4.464 684 1HG1 ILE 904 1HG1 ILE 904 -2.605 5.485 -7.319 685 2HG1 ILE 904 2HG1 ILE 904 -4.124 6.256 -6.865 686 1HG2 ILE 904 1HG2 ILE 904 -2.546 3.202 -6.566 687 2HG2 ILE 904 2HG2 ILE 904 -1.387 4.154 -5.639 688 3HG2 ILE 904 3HG2 ILE 904 -2.450 3.014 -4.815 689 1HD1 ILE 904 1HD1 ILE 904 -1.479 6.693 -5.452 690 2HD1 ILE 904 2HD1 ILE 904 -2.189 7.799 -6.628 691 3HD1 ILE 904 3HD1 ILE 904 -3.001 7.506 -5.090 692 HA ILE 905 HA ILE 905 -5.288 0.309 -6.629 693 HB ILE 905 HB ILE 905 -6.348 1.248 -8.686 694 1HG1 ILE 905 1HG1 ILE 905 -4.929 -0.867 -10.022 695 2HG1 ILE 905 2HG1 ILE 905 -5.169 -1.312 -8.332 696 1HG2 ILE 905 1HG2 ILE 905 -3.515 1.110 -9.761 697 2HG2 ILE 905 2HG2 ILE 905 -4.949 1.397 -10.745 698 3HG2 ILE 905 3HG2 ILE 905 -4.469 2.571 -9.523 699 1HD1 ILE 905 1HD1 ILE 905 -7.423 -0.154 -9.950 700 2HD1 ILE 905 2HD1 ILE 905 -7.057 -1.876 -10.019 701 3HD1 ILE 905 3HD1 ILE 905 -7.508 -1.128 -8.484 702 HA ILE 906 HA ILE 906 -0.980 -0.684 -7.768 703 HB ILE 906 HB ILE 906 -2.049 -1.577 -5.140 704 1HG1 ILE 906 1HG1 ILE 906 0.340 -0.048 -6.157 705 2HG1 ILE 906 2HG1 ILE 906 0.163 -0.474 -4.456 706 1HG2 ILE 906 1HG2 ILE 906 0.288 -2.906 -6.480 707 2HG2 ILE 906 2HG2 ILE 906 0.356 -2.599 -4.747 708 3HG2 ILE 906 3HG2 ILE 906 -0.929 -3.606 -5.412 709 1HD1 ILE 906 1HD1 ILE 906 -2.323 0.589 -5.162 710 2HD1 ILE 906 2HD1 ILE 906 -1.065 1.405 -4.235 711 3HD1 ILE 906 3HD1 ILE 906 -1.155 1.626 -5.980 712 HA ARG 907 HA ARG 907 -1.699 -4.738 -9.458 713 1HB ARG 907 1HB ARG 907 0.802 -3.568 -10.599 714 2HB ARG 907 2HB ARG 907 0.282 -5.185 -11.059 715 1HG ARG 907 1HG ARG 907 -0.661 -3.575 -12.617 716 2HG ARG 907 2HG ARG 907 -1.943 -4.278 -11.632 717 1HD ARG 907 1HD ARG 907 -2.419 -2.286 -10.593 718 2HD ARG 907 2HD ARG 907 -0.716 -1.787 -10.556 719 HE ARG 907 HE ARG 907 -1.026 -0.777 -12.672 720 1HH1 ARG 907 1HH1 ARG 907 -4.018 -1.650 -11.612 721 2HH1 ARG 907 2HH1 ARG 907 -4.726 -1.903 -13.172 722 1HH2 ARG 907 1HH2 ARG 907 -1.706 -1.712 -14.866 723 2HH2 ARG 907 2HH2 ARG 907 -3.417 -1.938 -15.015 724 HA ARG 908 HA ARG 908 0.925 -6.969 -6.656 725 1HB ARG 908 1HB ARG 908 -1.984 -7.718 -6.585 726 2HB ARG 908 2HB ARG 908 -0.834 -8.825 -5.849 727 1HG ARG 908 1HG ARG 908 0.006 -6.892 -4.458 728 2HG ARG 908 2HG ARG 908 -1.316 -5.922 -5.108 729 1HD ARG 908 1HD ARG 908 -2.465 -8.393 -4.194 730 2HD ARG 908 2HD ARG 908 -2.696 -6.788 -3.479 731 HE ARG 908 HE ARG 908 -0.122 -7.776 -2.707 732 1HH1 ARG 908 1HH1 ARG 908 -3.260 -7.322 -1.635 733 2HH1 ARG 908 2HH1 ARG 908 -3.181 -8.476 -0.347 734 1HH2 ARG 908 1HH2 ARG 908 -0.101 -9.742 -1.310 735 2HH2 ARG 908 2HH2 ARG 908 -1.394 -9.846 -0.163 736 HA TYR 909 HA TYR 909 1.038 -10.150 -9.925 737 1HB TYR 909 1HB TYR 909 3.920 -9.411 -10.142 738 2HB TYR 909 2HB TYR 909 2.841 -10.011 -11.378 739 HD1 TYR 909 HD1 TYR 909 3.943 -6.981 -9.550 740 HD2 TYR 909 HD2 TYR 909 1.463 -8.525 -12.679 741 HE1 TYR 909 HE1 TYR 909 3.718 -4.723 -10.465 742 HE2 TYR 909 HE2 TYR 909 1.218 -6.261 -13.597 743 HH TYR 909 HH TYR 909 2.451 -4.129 -13.577 744 HA LEU 910 HA LEU 910 3.891 -12.566 -7.386 745 1HB LEU 910 1HB LEU 910 2.182 -14.300 -9.161 746 2HB LEU 910 2HB LEU 910 2.938 -14.866 -7.673 747 HG LEU 910 HG LEU 910 0.842 -12.699 -7.971 748 1HD1 LEU 910 1HD1 LEU 910 0.901 -15.553 -7.194 749 2HD1 LEU 910 2HD1 LEU 910 -0.086 -14.510 -6.179 750 3HD1 LEU 910 3HD1 LEU 910 -0.398 -14.605 -7.909 751 1HD2 LEU 910 1HD2 LEU 910 2.692 -12.334 -6.176 752 2HD2 LEU 910 2HD2 LEU 910 1.012 -12.248 -5.663 753 3HD2 LEU 910 3HD2 LEU 910 1.954 -13.705 -5.355 754 HA PRO 911 HA PRO 911 7.399 -13.515 -10.039 755 1HB PRO 911 1HB PRO 911 8.799 -14.242 -7.631 756 2HB PRO 911 2HB PRO 911 8.996 -12.768 -8.584 757 1HG PRO 911 1HG PRO 911 7.990 -11.571 -6.943 758 2HG PRO 911 2HG PRO 911 7.786 -13.044 -5.993 759 1HD PRO 911 1HD PRO 911 5.751 -11.536 -7.386 760 2HD PRO 911 2HD PRO 911 5.545 -13.015 -6.425 761 HA ASP 912 HA ASP 912 6.823 -17.878 -8.027 762 1HB ASP 912 1HB ASP 912 4.349 -16.652 -6.918 763 2HB ASP 912 2HB ASP 912 4.268 -18.381 -7.256 764 1HA GLY 913 1HA GLY 913 4.191 -17.069 -12.174 765 2HA GLY 913 2HA GLY 913 3.816 -18.624 -11.436 766 HA SER 914 HA SER 914 0.031 -15.758 -11.912 767 1HB SER 914 1HB SER 914 0.632 -16.168 -8.996 768 2HB SER 914 2HB SER 914 -0.931 -15.519 -9.486 769 HG SER 914 HG SER 914 -0.767 -17.874 -9.309 770 HA TYR 915 HA TYR 915 0.073 -11.615 -9.624 771 1HB TYR 915 1HB TYR 915 1.161 -11.005 -11.547 772 2HB TYR 915 2HB TYR 915 0.256 -12.172 -12.499 773 HD1 TYR 915 HD1 TYR 915 -0.150 -8.803 -10.884 774 HD2 TYR 915 HD2 TYR 915 -1.266 -11.424 -14.098 775 HE1 TYR 915 HE1 TYR 915 -1.433 -6.964 -11.938 776 HE2 TYR 915 HE2 TYR 915 -2.548 -9.585 -15.153 777 HH TYR 915 HH TYR 915 -3.383 -7.507 -14.850 778 HA GLU 916 HA GLU 916 -4.134 -9.891 -10.677 779 1HB GLU 916 1HB GLU 916 -3.589 -11.017 -8.209 780 2HB GLU 916 2HB GLU 916 -4.223 -9.421 -7.804 781 1HG GLU 916 1HG GLU 916 -5.604 -11.182 -9.823 782 2HG GLU 916 2HG GLU 916 -5.942 -11.321 -8.097 783 HA ASP 917 HA ASP 917 -3.433 -5.539 -9.882 784 1HB ASP 917 1HB ASP 917 -3.760 -5.896 -12.303 785 2HB ASP 917 2HB ASP 917 -4.371 -4.353 -11.760 786 HA TRP 918 HA TRP 918 -6.691 -2.729 -8.426 787 1HB TRP 918 1HB TRP 918 -8.029 -4.026 -6.786 788 2HB TRP 918 2HB TRP 918 -8.045 -4.715 -8.389 789 HD1 TRP 918 HD1 TRP 918 -4.842 -5.892 -7.272 790 HE1 TRP 918 HE1 TRP 918 -5.054 -8.273 -6.283 791 HE3 TRP 918 HE3 TRP 918 -9.762 -5.874 -6.308 792 HZ2 TRP 918 HZ2 TRP 918 -7.141 -9.893 -5.063 793 HZ3 TRP 918 HZ3 TRP 918 -10.865 -7.719 -5.157 794 HH2 TRP 918 HH2 TRP 918 -9.579 -9.774 -4.538 795 1HA GLY 919 1HA GLY 919 -4.918 -2.823 -4.175 796 2HA GLY 919 2HA GLY 919 -4.691 -1.248 -4.919 797 HA VAL 920 HA VAL 920 -7.782 -0.129 -2.016 798 HB VAL 920 HB VAL 920 -6.701 2.374 -3.356 799 1HG1 VAL 920 1HG1 VAL 920 -8.225 1.911 -0.788 800 2HG1 VAL 920 2HG1 VAL 920 -7.170 3.309 -0.989 801 3HG1 VAL 920 3HG1 VAL 920 -8.555 3.090 -2.058 802 1HG2 VAL 920 1HG2 VAL 920 -5.679 0.426 -1.355 803 2HG2 VAL 920 2HG2 VAL 920 -4.792 1.408 -2.521 804 3HG2 VAL 920 3HG2 VAL 920 -5.367 2.127 -1.019 805 HA ASP 921 HA ASP 921 -10.738 1.618 -5.147 806 1HB ASP 921 1HB ASP 921 -8.993 1.702 -7.049 807 2HB ASP 921 2HB ASP 921 -9.627 0.127 -7.528 808 HA GLU 922 HA GLU 922 -12.422 -2.595 -5.115 809 1HB GLU 922 1HB GLU 922 -10.784 -3.047 -7.029 810 2HB GLU 922 2HB GLU 922 -9.885 -4.039 -5.882 811 1HG GLU 922 1HG GLU 922 -11.463 -5.425 -7.203 812 2HG GLU 922 2HG GLU 922 -11.894 -5.430 -5.494 813 HA LEU 923 HA LEU 923 -10.575 -3.989 -1.182 814 1HB LEU 923 1HB LEU 923 -8.262 -5.141 -1.076 815 2HB LEU 923 2HB LEU 923 -9.365 -5.623 -2.347 816 HG LEU 923 HG LEU 923 -7.898 -3.418 -3.358 817 1HD1 LEU 923 1HD1 LEU 923 -6.153 -5.557 -2.114 818 2HD1 LEU 923 2HD1 LEU 923 -5.608 -4.366 -3.294 819 3HD1 LEU 923 3HD1 LEU 923 -6.155 -3.846 -1.704 820 1HD2 LEU 923 1HD2 LEU 923 -8.396 -6.249 -3.841 821 2HD2 LEU 923 2HD2 LEU 923 -8.416 -4.878 -4.950 822 3HD2 LEU 923 3HD2 LEU 923 -6.885 -5.640 -4.518 823 HA ILE 924 HA ILE 924 -8.203 -1.704 1.713 824 HB ILE 924 HB ILE 924 -6.947 -4.340 1.803 825 1HG1 ILE 924 1HG1 ILE 924 -7.516 -3.893 4.246 826 2HG1 ILE 924 2HG1 ILE 924 -8.219 -2.383 3.672 827 1HG2 ILE 924 1HG2 ILE 924 -4.880 -2.945 1.948 828 2HG2 ILE 924 2HG2 ILE 924 -5.583 -2.135 3.344 829 3HG2 ILE 924 3HG2 ILE 924 -5.224 -3.856 3.409 830 1HD1 ILE 924 3HD1 ILE 924 -8.912 -5.123 2.601 831 2HD1 ILE 924 1HD1 ILE 924 -9.902 -4.201 3.730 832 3HD1 ILE 924 2HD1 ILE 924 -9.628 -3.595 2.096 833 HA ILE 925 HA ILE 925 -4.595 0.397 0.249 834 HB ILE 925 HB ILE 925 -4.298 2.286 1.872 835 1HG1 ILE 925 1HG1 ILE 925 -6.547 1.313 3.543 836 2HG1 ILE 925 2HG1 ILE 925 -5.022 0.458 3.770 837 1HG2 ILE 925 1HG2 ILE 925 -6.799 1.443 0.605 838 2HG2 ILE 925 2HG2 ILE 925 -7.062 2.538 1.964 839 3HG2 ILE 925 3HG2 ILE 925 -6.028 3.029 0.623 840 1HD1 ILE 925 1HD1 ILE 925 -4.892 3.431 3.646 841 2HD1 ILE 925 2HD1 ILE 925 -5.602 2.721 5.097 842 3HD1 ILE 925 3HD1 ILE 925 -3.954 2.304 4.627 843 HA THR 926 HA THR 926 -0.921 -0.507 2.771 844 HB THR 926 HB THR 926 -1.421 0.686 5.413 845 HG1 THR 926 HG1 THR 926 -1.068 2.749 3.755 846 1HG2 THR 926 1HG2 THR 926 0.761 0.059 3.936 847 2HG2 THR 926 2HG2 THR 926 0.619 1.777 3.567 848 3HG2 THR 926 3HG2 THR 926 0.780 1.244 5.240 849 HA ASP 927 HA ASP 927 -3.823 -3.357 5.247 850 1HB ASP 927 1HB ASP 927 -1.813 -1.970 6.745 851 2HB ASP 927 2HB ASP 927 -3.046 -2.510 7.885 No H/Q in entry = 851 Start of MODEL 14 1 H1 MET 801 H1 MET 801 44.714 5.475 25.836 2 H2 MET 801 H2 MET 801 46.106 5.071 26.716 3 H3 MET 801 H3 MET 801 45.129 6.365 27.223 4 HA MET 801 HA MET 801 45.746 7.690 25.356 5 1HB MET 801 1HB MET 801 47.247 7.242 27.433 6 2HB MET 801 2HB MET 801 48.254 6.314 26.320 7 1HG MET 801 1HG MET 801 47.405 9.063 25.499 8 2HG MET 801 2HG MET 801 48.684 8.909 26.704 9 1HE MET 801 1HE MET 801 48.794 10.342 24.311 10 2HE MET 801 2HE MET 801 50.537 10.112 24.437 11 3HE MET 801 3HE MET 801 49.697 9.731 22.927 12 HA SER 802 HA SER 802 47.592 4.869 22.224 13 1HB SER 802 1HB SER 802 49.598 4.055 24.280 14 2HB SER 802 2HB SER 802 49.650 3.220 22.730 15 HG SER 802 HG SER 802 50.758 4.944 22.195 16 HA ASP 803 HA ASP 803 45.807 0.763 22.946 17 1HB ASP 803 1HB ASP 803 43.951 2.609 24.353 18 2HB ASP 803 2HB ASP 803 43.266 1.071 23.827 19 HA ASN 804 HA ASN 804 43.050 1.282 19.379 20 1HB ASN 804 1HB ASN 804 45.816 1.581 18.677 21 2HB ASN 804 2HB ASN 804 45.040 0.583 17.448 22 2HD2 ASN 804 1HD2 ASN 804 45.138 3.807 18.861 23 1HD2 ASN 804 2HD2 ASN 804 44.085 4.531 17.743 24 HA GLU 805 HA GLU 805 42.424 -2.989 18.391 25 1HB GLU 805 1HB GLU 805 41.001 -1.230 16.629 26 2HB GLU 805 2HB GLU 805 41.424 -2.683 15.724 27 1HG GLU 805 1HG GLU 805 40.219 -4.085 17.149 28 2HG GLU 805 2HG GLU 805 40.294 -2.947 18.495 29 HA ASP 806 HA ASP 806 46.164 -4.245 16.306 30 1HB ASP 806 1HB ASP 806 46.101 -6.778 16.174 31 2HB ASP 806 2HB ASP 806 45.849 -6.116 17.787 32 HA ASN 807 HA ASN 807 43.784 -4.737 12.376 33 1HB ASN 807 1HB ASN 807 44.661 -7.168 13.097 34 2HB ASN 807 2HB ASN 807 43.015 -7.616 12.645 35 2HD2 ASN 807 1HD2 ASN 807 46.127 -7.084 11.383 36 1HD2 ASN 807 2HD2 ASN 807 45.703 -6.924 9.747 37 HA PHE 808 HA PHE 808 39.239 -5.701 12.656 38 1HB PHE 808 1HB PHE 808 40.188 -5.232 9.829 39 2HB PHE 808 2HB PHE 808 38.469 -5.186 10.222 40 HD1 PHE 808 HD1 PHE 808 38.099 -3.877 12.647 41 HD2 PHE 808 HD2 PHE 808 41.182 -3.132 9.751 42 HE1 PHE 808 HE1 PHE 808 38.357 -1.568 13.516 43 HE2 PHE 808 HE2 PHE 808 41.440 -0.824 10.620 44 HZ PHE 808 HZ PHE 808 40.028 -0.041 12.503 45 HA ASP 809 HA ASP 809 38.214 -9.868 11.444 46 1HB ASP 809 1HB ASP 809 40.561 -9.376 9.850 47 2HB ASP 809 2HB ASP 809 40.480 -11.097 10.226 48 1HA GLY 810 1HA GLY 810 40.593 -11.952 14.763 49 2HA GLY 810 2HA GLY 810 39.218 -11.438 15.742 50 HA ASP 811 HA ASP 811 37.672 -15.298 13.701 51 1HB ASP 811 1HB ASP 811 35.458 -15.567 14.818 52 2HB ASP 811 2HB ASP 811 36.616 -14.724 15.845 53 HA ASP 812 HA ASP 812 34.924 -14.706 10.224 54 1HB ASP 812 1HB ASP 812 34.946 -17.395 11.232 55 2HB ASP 812 2HB ASP 812 33.397 -17.113 10.439 56 HA PHE 813 HA PHE 813 30.822 -13.576 11.626 57 1HB PHE 813 1HB PHE 813 31.231 -15.024 13.627 58 2HB PHE 813 2HB PHE 813 31.786 -13.598 14.504 59 HD1 PHE 813 HD1 PHE 813 28.892 -14.481 12.270 60 HD2 PHE 813 HD2 PHE 813 30.212 -12.655 15.928 61 HE1 PHE 813 HE1 PHE 813 26.545 -13.911 12.833 62 HE2 PHE 813 HE2 PHE 813 27.865 -12.086 16.489 63 HZ PHE 813 HZ PHE 813 26.032 -12.713 14.942 64 HA ASP 814 HA ASP 814 31.727 -9.244 12.587 65 1HB ASP 814 1HB ASP 814 34.516 -9.819 11.542 66 2HB ASP 814 2HB ASP 814 34.023 -8.251 12.181 67 HA ASP 815 HA ASP 815 31.169 -7.970 8.319 68 1HB ASP 815 1HB ASP 815 32.406 -10.256 7.803 69 2HB ASP 815 2HB ASP 815 30.830 -10.718 7.157 70 HA VAL 816 HA VAL 816 26.746 -8.906 8.145 71 HB VAL 816 HB VAL 816 25.536 -10.428 9.736 72 1HG1 VAL 816 1HG1 VAL 816 28.145 -11.206 8.455 73 2HG1 VAL 816 2HG1 VAL 816 27.202 -12.407 9.338 74 3HG1 VAL 816 3HG1 VAL 816 26.501 -11.586 7.942 75 1HG2 VAL 816 1HG2 VAL 816 27.444 -9.617 11.545 76 2HG2 VAL 816 2HG2 VAL 816 26.414 -11.035 11.747 77 3HG2 VAL 816 3HG2 VAL 816 28.040 -11.212 11.087 78 HA GLU 817 HA GLU 817 25.127 -5.864 10.945 79 1HB GLU 817 1HB GLU 817 28.031 -5.412 10.847 80 2HB GLU 817 2HB GLU 817 27.112 -3.951 11.213 81 1HG GLU 817 1HG GLU 817 26.115 -4.919 13.130 82 2HG GLU 817 2HG GLU 817 26.564 -6.553 12.640 83 HA GLU 818 HA GLU 818 25.250 -2.784 7.363 84 1HB GLU 818 1HB GLU 818 25.131 -5.344 5.823 85 2HB GLU 818 2HB GLU 818 24.472 -3.899 5.055 86 1HG GLU 818 1HG GLU 818 26.625 -3.529 4.420 87 2HG GLU 818 2HG GLU 818 26.822 -2.930 6.067 88 HA ASP 819 HA ASP 819 20.765 -3.073 7.534 89 1HB ASP 819 1HB ASP 819 21.695 -1.436 9.912 90 2HB ASP 819 2HB ASP 819 20.008 -1.867 9.627 91 HA GLU 820 HA GLU 820 20.068 1.124 6.086 92 1HB GLU 820 1HB GLU 820 19.549 0.888 3.657 93 2HB GLU 820 2HB GLU 820 20.926 -0.102 4.139 94 1HG GLU 820 1HG GLU 820 18.394 -1.524 4.461 95 2HG GLU 820 2HG GLU 820 18.652 -1.001 2.797 96 1HA GLY 821 1HA GLY 821 15.546 0.357 6.680 97 2HA GLY 821 2HA GLY 821 15.887 0.789 8.358 98 HA LEU 822 HA LEU 822 15.640 5.098 7.283 99 1HB LEU 822 1HB LEU 822 13.972 4.077 5.803 100 2HB LEU 822 2HB LEU 822 12.832 3.955 7.141 101 HG LEU 822 HG LEU 822 13.043 6.491 7.374 102 1HD1 LEU 822 1HD1 LEU 822 14.562 5.996 4.820 103 2HD1 LEU 822 2HD1 LEU 822 13.704 7.517 5.071 104 3HD1 LEU 822 3HD1 LEU 822 14.992 7.039 6.176 105 1HD2 LEU 822 1HD2 LEU 822 11.805 5.065 5.033 106 2HD2 LEU 822 2HD2 LEU 822 11.017 5.782 6.439 107 3HD2 LEU 822 3HD2 LEU 822 11.661 6.817 5.164 108 HA ASP 823 HA ASP 823 13.521 6.218 11.194 109 1HB ASP 823 1HB ASP 823 11.792 7.000 9.292 110 2HB ASP 823 2HB ASP 823 10.652 6.199 10.375 111 HA ASP 824 HA ASP 824 11.783 2.367 12.986 112 1HB ASP 824 1HB ASP 824 9.305 2.102 12.959 113 2HB ASP 824 2HB ASP 824 9.786 3.794 12.845 114 HA LEU 825 HA LEU 825 11.460 -1.071 9.999 115 1HB LEU 825 1HB LEU 825 12.681 0.901 8.111 116 2HB LEU 825 2HB LEU 825 12.774 -0.807 7.683 117 HG LEU 825 HG LEU 825 10.167 -0.612 8.485 118 1HD1 LEU 825 1HD1 LEU 825 10.673 1.942 8.622 119 2HD1 LEU 825 2HD1 LEU 825 10.612 1.886 6.861 120 3HD1 LEU 825 3HD1 LEU 825 9.198 1.421 7.806 121 1HD2 LEU 825 1HD2 LEU 825 11.319 -1.498 6.323 122 2HD2 LEU 825 2HD2 LEU 825 9.648 -0.942 6.210 123 3HD2 LEU 825 3HD2 LEU 825 10.963 0.100 5.665 124 HA GLU 826 HA GLU 826 15.882 -1.852 11.117 125 1HB GLU 826 1HB GLU 826 15.234 -0.857 13.310 126 2HB GLU 826 2HB GLU 826 14.430 -2.369 13.732 127 1HG GLU 826 1HG GLU 826 16.416 -3.512 14.006 128 2HG GLU 826 2HG GLU 826 17.272 -2.517 12.828 129 HA ASN 827 HA ASN 827 14.786 -5.799 8.884 130 1HB ASN 827 1HB ASN 827 17.135 -5.699 9.696 131 2HB ASN 827 2HB ASN 827 16.412 -7.286 9.952 132 2HD2 ASN 827 1HD2 ASN 827 15.889 -7.909 12.172 133 1HD2 ASN 827 2HD2 ASN 827 16.511 -7.053 13.499 134 HA ALA 828 HA ALA 828 12.087 -6.631 12.742 135 1HB ALA 828 1HB ALA 828 10.534 -4.669 11.046 136 2HB ALA 828 2HB ALA 828 9.743 -5.617 12.305 137 3HB ALA 828 3HB ALA 828 11.040 -4.498 12.727 138 HA GLU 829 HA GLU 829 9.935 -9.284 9.678 139 1HB GLU 829 1HB GLU 829 7.877 -7.159 9.842 140 2HB GLU 829 2HB GLU 829 7.556 -8.415 8.646 141 1HG GLU 829 1HG GLU 829 8.445 -9.211 11.400 142 2HG GLU 829 2HG GLU 829 6.763 -8.748 11.137 143 HA GLU 830 HA GLU 830 8.780 -6.451 5.228 144 1HB GLU 830 1HB GLU 830 11.140 -6.111 6.537 145 2HB GLU 830 2HB GLU 830 11.604 -7.355 5.377 146 1HG GLU 830 1HG GLU 830 10.680 -5.964 3.540 147 2HG GLU 830 2HG GLU 830 10.283 -4.707 4.712 148 HA GLU 831 HA GLU 831 9.679 -11.016 4.244 149 1HB GLU 831 1HB GLU 831 9.424 -11.747 6.621 150 2HB GLU 831 2HB GLU 831 7.672 -11.713 6.413 151 1HG GLU 831 1HG GLU 831 8.261 -13.247 4.310 152 2HG GLU 831 2HG GLU 831 9.677 -13.624 5.294 153 1HA GLY 832 1HA GLY 832 5.861 -11.925 2.048 154 2HA GLY 832 2HA GLY 832 6.226 -10.282 1.521 155 HA GLN 833 HA GLN 833 7.599 -11.752 -2.366 156 1HB GLN 833 1HB GLN 833 7.721 -13.910 -1.152 157 2HB GLN 833 2HB GLN 833 6.036 -14.232 -1.568 158 1HG GLN 833 1HG GLN 833 6.594 -14.163 -3.957 159 2HG GLN 833 2HG GLN 833 8.276 -13.803 -3.565 160 2HE2 GLN 833 1HE2 GLN 833 5.782 -16.346 -3.360 161 1HE2 GLN 833 2HE2 GLN 833 6.870 -17.624 -3.104 162 HA GLU 834 HA GLU 834 4.235 -11.366 -5.212 163 1HB GLU 834 1HB GLU 834 3.459 -10.345 -2.727 164 2HB GLU 834 2HB GLU 834 3.164 -9.004 -3.834 165 1HG GLU 834 1HG GLU 834 1.769 -10.376 -5.240 166 2HG GLU 834 2HG GLU 834 2.207 -11.829 -4.340 167 HA ASN 835 HA ASN 835 6.612 -8.109 -7.243 168 1HB ASN 835 1HB ASN 835 4.755 -8.878 -9.493 169 2HB ASN 835 2HB ASN 835 6.391 -8.255 -9.586 170 2HD2 ASN 835 1HD2 ASN 835 5.214 -10.841 -10.715 171 1HD2 ASN 835 2HD2 ASN 835 6.230 -12.061 -10.116 172 HA VAL 836 HA VAL 836 3.057 -5.516 -7.141 173 HB VAL 836 HB VAL 836 4.638 -5.657 -4.924 174 1HG1 VAL 836 3HG1 VAL 836 5.939 -3.673 -5.590 175 2HG1 VAL 836 1HG1 VAL 836 4.455 -2.721 -5.632 176 3HG1 VAL 836 2HG1 VAL 836 5.032 -3.382 -4.104 177 1HG2 VAL 836 1HG2 VAL 836 2.052 -5.249 -5.353 178 2HG2 VAL 836 2HG2 VAL 836 2.784 -4.972 -3.773 179 3HG2 VAL 836 3HG2 VAL 836 2.483 -3.613 -4.856 180 HA GLU 837 HA GLU 837 4.655 -2.031 -9.440 181 1HB GLU 837 1HB GLU 837 2.628 -3.507 -10.785 182 2HB GLU 837 2HB GLU 837 2.195 -1.810 -10.918 183 1HG GLU 837 1HG GLU 837 4.921 -1.779 -11.391 184 2HG GLU 837 2HG GLU 837 4.409 -3.275 -12.174 185 HA ILE 838 HA ILE 838 1.463 0.746 -7.822 186 HB ILE 838 HB ILE 838 4.016 2.247 -8.514 187 1HG1 ILE 838 1HG1 ILE 838 4.322 0.056 -7.300 188 2HG1 ILE 838 2HG1 ILE 838 4.921 1.461 -6.428 189 1HG2 ILE 838 1HG2 ILE 838 1.689 2.971 -6.866 190 2HG2 ILE 838 2HG2 ILE 838 3.246 3.198 -6.079 191 3HG2 ILE 838 3HG2 ILE 838 2.911 3.999 -7.612 192 1HD1 ILE 838 1HD1 ILE 838 2.256 1.257 -5.625 193 2HD1 ILE 838 2HD1 ILE 838 2.822 -0.410 -5.672 194 3HD1 ILE 838 3HD1 ILE 838 3.667 0.779 -4.688 195 HA LEU 839 HA LEU 839 0.411 4.167 -10.653 196 1HB LEU 839 1HB LEU 839 -0.936 1.552 -10.898 197 2HB LEU 839 2HB LEU 839 -1.850 2.899 -11.574 198 HG LEU 839 HG LEU 839 0.823 3.308 -12.388 199 1HD1 LEU 839 1HD1 LEU 839 0.714 0.678 -11.739 200 2HD1 LEU 839 2HD1 LEU 839 0.119 0.606 -13.398 201 3HD1 LEU 839 3HD1 LEU 839 1.703 1.304 -13.059 202 1HD2 LEU 839 1HD2 LEU 839 -1.697 2.341 -13.749 203 2HD2 LEU 839 2HD2 LEU 839 -0.989 3.957 -13.785 204 3HD2 LEU 839 3HD2 LEU 839 -0.210 2.633 -14.652 205 HA PRO 840 HA PRO 840 -2.626 6.576 -8.554 206 1HB PRO 840 1HB PRO 840 -2.877 8.261 -10.044 207 2HB PRO 840 2HB PRO 840 -4.066 7.301 -10.930 208 1HG PRO 840 1HG PRO 840 -1.400 7.971 -11.736 209 2HG PRO 840 2HG PRO 840 -2.565 6.962 -12.598 210 1HD PRO 840 1HD PRO 840 -1.279 5.134 -12.139 211 2HD PRO 840 2HD PRO 840 -0.167 6.136 -11.174 212 HA SER 841 HA SER 841 -5.934 3.708 -7.706 213 1HB SER 841 1HB SER 841 -7.773 4.853 -6.776 214 2HB SER 841 2HB SER 841 -6.442 5.976 -6.508 215 HG SER 841 HG SER 841 -7.723 7.295 -7.547 216 1HA GLY 842 1HA GLY 842 -8.617 3.826 -11.319 217 2HA GLY 842 2HA GLY 842 -7.224 2.855 -11.783 218 HA GLU 843 HA GLU 843 -10.324 -0.266 -10.034 219 1HB GLU 843 1HB GLU 843 -12.586 0.114 -9.045 220 2HB GLU 843 2HB GLU 843 -11.348 1.033 -8.194 221 1HG GLU 843 1HG GLU 843 -12.323 2.995 -8.734 222 2HG GLU 843 2HG GLU 843 -12.411 2.548 -10.437 223 HA ARG 844 HA ARG 844 -11.889 1.178 -14.301 224 1HB ARG 844 1HB ARG 844 -9.350 0.368 -14.483 225 2HB ARG 844 2HB ARG 844 -10.133 -1.121 -15.014 226 1HG ARG 844 1HG ARG 844 -11.529 0.441 -16.564 227 2HG ARG 844 2HG ARG 844 -10.245 1.613 -16.268 228 1HD ARG 844 1HD ARG 844 -8.569 0.119 -17.173 229 2HD ARG 844 2HD ARG 844 -9.743 -1.208 -17.277 230 HE ARG 844 HE ARG 844 -10.667 -0.180 -19.203 231 1HH1 ARG 844 1HH1 ARG 844 -11.513 2.381 -18.784 232 2HH1 ARG 844 2HH1 ARG 844 -10.288 3.441 -19.396 233 1HH2 ARG 844 1HH2 ARG 844 -7.821 1.004 -19.427 234 2HH2 ARG 844 2HH2 ARG 844 -8.198 2.661 -19.761 235 HA PRO 845 HA PRO 845 -14.788 -2.225 -13.495 236 1HB PRO 845 1HB PRO 845 -16.610 -0.897 -15.285 237 2HB PRO 845 2HB PRO 845 -16.689 -0.978 -13.524 238 1HG PRO 845 1HG PRO 845 -16.096 1.306 -15.118 239 2HG PRO 845 2HG PRO 845 -16.055 1.189 -13.356 240 1HD PRO 845 1HD PRO 845 -13.788 1.420 -13.441 241 2HD PRO 845 2HD PRO 845 -13.814 1.343 -15.219 242 HA GLN 846 HA GLN 846 -14.135 -4.391 -17.305 243 1HB GLN 846 1HB GLN 846 -13.888 -2.138 -18.257 244 2HB GLN 846 2HB GLN 846 -12.176 -2.137 -17.830 245 1HG GLN 846 1HG GLN 846 -11.604 -3.545 -19.548 246 2HG GLN 846 2HG GLN 846 -13.127 -4.429 -19.468 247 2HE2 GLN 846 1HE2 GLN 846 -11.835 -3.244 -21.895 248 1HE2 GLN 846 2HE2 GLN 846 -12.966 -2.149 -22.529 249 HA ALA 847 HA ALA 847 -9.683 -5.708 -16.692 250 1HB ALA 847 1HB ALA 847 -8.966 -3.151 -16.229 251 2HB ALA 847 2HB ALA 847 -8.618 -3.824 -14.637 252 3HB ALA 847 3HB ALA 847 -7.825 -4.486 -16.067 253 HA ASN 848 HA ASN 848 -11.317 -6.349 -12.097 254 1HB ASN 848 1HB ASN 848 -13.574 -6.470 -13.552 255 2HB ASN 848 2HB ASN 848 -13.223 -8.196 -13.465 256 2HD2 ASN 848 1HD2 ASN 848 -14.008 -5.337 -11.512 257 1HD2 ASN 848 2HD2 ASN 848 -14.375 -6.193 -10.093 258 HA GLN 849 HA GLN 849 -8.988 -10.068 -13.214 259 1HB GLN 849 1HB GLN 849 -7.338 -7.852 -12.397 260 2HB GLN 849 2HB GLN 849 -6.758 -9.311 -11.598 261 1HG GLN 849 1HG GLN 849 -6.317 -10.402 -13.629 262 2HG GLN 849 2HG GLN 849 -7.388 -9.336 -14.541 263 2HE2 GLN 849 1HE2 GLN 849 -4.988 -8.190 -12.153 264 1HE2 GLN 849 2HE2 GLN 849 -4.023 -7.373 -13.270 265 HA LYS 850 HA LYS 850 -8.105 -11.381 -8.684 266 1HB LYS 850 1HB LYS 850 -9.767 -13.210 -8.625 267 2HB LYS 850 2HB LYS 850 -10.388 -11.833 -9.529 268 1HG LYS 850 1HG LYS 850 -9.266 -13.138 -11.572 269 2HG LYS 850 2HG LYS 850 -10.898 -13.525 -11.023 270 1HD LYS 850 1HD LYS 850 -8.392 -15.088 -10.774 271 2HD LYS 850 2HD LYS 850 -9.416 -15.076 -9.339 272 1HE LYS 850 1HE LYS 850 -10.863 -15.489 -11.896 273 2HE LYS 850 2HE LYS 850 -9.787 -16.814 -11.405 274 1HZ LYS 850 1HZ LYS 850 -11.689 -15.484 -9.554 275 2HZ LYS 850 2HZ LYS 850 -12.067 -16.901 -10.406 276 3HZ LYS 850 3HZ LYS 850 -10.797 -16.904 -9.277 277 HA ARG 851 HA ARG 851 -6.142 -15.522 -8.887 278 1HB ARG 851 1HB ARG 851 -4.814 -13.255 -9.742 279 2HB ARG 851 2HB ARG 851 -3.775 -13.827 -8.439 280 1HG ARG 851 1HG ARG 851 -3.885 -16.129 -9.496 281 2HG ARG 851 2HG ARG 851 -3.028 -14.918 -10.447 282 1HD ARG 851 1HD ARG 851 -5.912 -15.796 -10.853 283 2HD ARG 851 2HD ARG 851 -5.083 -14.541 -11.795 284 HE ARG 851 HE ARG 851 -3.961 -17.309 -11.644 285 1HH1 ARG 851 1HH1 ARG 851 -2.206 -16.489 -13.362 286 2HH1 ARG 851 2HH1 ARG 851 -2.945 -16.215 -14.905 287 1HH2 ARG 851 1HH2 ARG 851 -6.172 -16.119 -13.642 288 2HH2 ARG 851 2HH2 ARG 851 -5.189 -16.004 -15.063 289 HA ILE 852 HA ILE 852 -5.096 -15.007 -4.406 290 HB ILE 852 HB ILE 852 -2.935 -15.701 -4.072 291 1HG1 ILE 852 1HG1 ILE 852 -2.052 -13.442 -3.639 292 2HG1 ILE 852 2HG1 ILE 852 -0.925 -14.377 -4.613 293 1HG2 ILE 852 1HG2 ILE 852 -3.474 -16.396 -6.375 294 2HG2 ILE 852 2HG2 ILE 852 -2.742 -14.915 -6.991 295 3HG2 ILE 852 3HG2 ILE 852 -1.746 -16.118 -6.174 296 1HD1 ILE 852 1HD1 ILE 852 -2.662 -13.096 -6.444 297 2HD1 ILE 852 2HD1 ILE 852 -2.215 -11.877 -5.253 298 3HD1 ILE 852 3HD1 ILE 852 -0.965 -12.730 -6.148 299 HA THR 853 HA THR 853 -3.409 -10.546 -3.299 300 HB THR 853 HB THR 853 -4.496 -8.584 -4.469 301 HG1 THR 853 HG1 THR 853 -5.839 -10.630 -5.619 302 1HG2 THR 853 1HG2 THR 853 -2.232 -9.675 -4.965 303 2HG2 THR 853 2HG2 THR 853 -3.022 -10.398 -6.360 304 3HG2 THR 853 3HG2 THR 853 -2.915 -8.645 -6.224 305 HA THR 854 HA THR 854 -7.016 -11.653 -0.879 306 HB THR 854 HB THR 854 -4.771 -10.284 0.581 307 HG1 THR 854 HG1 THR 854 -4.464 -12.255 1.180 308 1HG2 THR 854 1HG2 THR 854 -7.604 -10.190 1.347 309 2HG2 THR 854 2HG2 THR 854 -6.569 -10.907 2.581 310 3HG2 THR 854 3HG2 THR 854 -6.231 -9.285 1.983 311 HA PRO 855 HA PRO 855 -9.233 -7.944 -2.027 312 1HB PRO 855 1HB PRO 855 -11.334 -8.814 -1.834 313 2HB PRO 855 2HB PRO 855 -11.268 -8.581 -0.085 314 1HG PRO 855 1HG PRO 855 -11.198 -11.054 -1.516 315 2HG PRO 855 2HG PRO 855 -11.026 -10.819 0.227 316 1HD PRO 855 1HD PRO 855 -8.834 -11.459 0.042 317 2HD PRO 855 2HD PRO 855 -8.962 -11.510 -1.734 318 HA TYR 856 HA TYR 856 -7.909 -5.100 1.110 319 1HB TYR 856 1HB TYR 856 -8.594 -6.881 2.603 320 2HB TYR 856 2HB TYR 856 -7.124 -7.776 2.283 321 HD1 TYR 856 HD1 TYR 856 -4.864 -6.508 2.934 322 HD2 TYR 856 HD2 TYR 856 -8.747 -5.557 4.500 323 HE1 TYR 856 HE1 TYR 856 -3.810 -5.419 4.879 324 HE2 TYR 856 HE2 TYR 856 -7.689 -4.481 6.458 325 HH TYR 856 HH TYR 856 -5.375 -4.747 7.680 326 HA MET 857 HA MET 857 -3.857 -5.006 -0.887 327 1HB MET 857 1HB MET 857 -4.876 -2.668 -1.049 328 2HB MET 857 2HB MET 857 -4.123 -2.328 0.501 329 1HG MET 857 1HG MET 857 -1.965 -3.289 -0.718 330 2HG MET 857 2HG MET 857 -2.843 -2.803 -2.163 331 1HE MET 857 1HE MET 857 -3.196 -0.681 -2.996 332 2HE MET 857 2HE MET 857 -4.373 -0.359 -1.730 333 3HE MET 857 3HE MET 857 -3.160 0.855 -2.120 334 HA THR 858 HA THR 858 -1.578 -5.142 2.977 335 HB THR 858 HB THR 858 0.167 -6.868 2.546 336 HG1 THR 858 HG1 THR 858 0.799 -6.041 0.491 337 1HG2 THR 858 1HG2 THR 858 -2.479 -7.200 1.111 338 2HG2 THR 858 2HG2 THR 858 -1.447 -8.520 1.660 339 3HG2 THR 858 3HG2 THR 858 -2.205 -7.443 2.834 340 HA LYS 859 HA LYS 859 1.012 -1.710 3.641 341 1HB LYS 859 1HB LYS 859 1.341 -3.072 5.648 342 2HB LYS 859 2HB LYS 859 2.880 -2.391 5.121 343 1HG LYS 859 1HG LYS 859 1.923 -5.170 4.376 344 2HG LYS 859 2HG LYS 859 3.524 -4.487 4.095 345 1HD LYS 859 1HD LYS 859 2.530 -4.490 6.904 346 2HD LYS 859 2HD LYS 859 2.997 -6.045 6.216 347 1HE LYS 859 1HE LYS 859 5.080 -4.433 5.404 348 2HE LYS 859 2HE LYS 859 5.106 -5.428 6.873 349 1HZ LYS 859 1HZ LYS 859 3.944 -3.516 7.985 350 2HZ LYS 859 2HZ LYS 859 5.552 -3.200 7.535 351 3HZ LYS 859 3HZ LYS 859 4.275 -2.585 6.601 352 HA TYR 860 HA TYR 860 4.858 -3.151 1.173 353 1HB TYR 860 1HB TYR 860 4.825 -5.530 1.093 354 2HB TYR 860 2HB TYR 860 3.415 -5.561 0.045 355 HD1 TYR 860 HD1 TYR 860 6.159 -3.106 -0.288 356 HD2 TYR 860 HD2 TYR 860 4.494 -6.755 -1.841 357 HE1 TYR 860 HE1 TYR 860 7.597 -2.899 -2.279 358 HE2 TYR 860 HE2 TYR 860 5.942 -6.537 -3.833 359 HH TYR 860 HH TYR 860 8.552 -4.338 -3.999 360 HA GLU 861 HA GLU 861 2.284 -2.546 -2.967 361 1HB GLU 861 1HB GLU 861 -0.199 -2.651 -1.209 362 2HB GLU 861 2HB GLU 861 -0.210 -2.128 -2.893 363 1HG GLU 861 1HG GLU 861 0.668 -4.329 -3.583 364 2HG GLU 861 2HG GLU 861 0.667 -4.856 -1.899 365 HA ARG 862 HA ARG 862 1.222 1.477 -0.577 366 1HB ARG 862 1HB ARG 862 0.411 -0.190 1.532 367 2HB ARG 862 2HB ARG 862 1.623 0.880 2.234 368 1HG ARG 862 1HG ARG 862 -0.335 2.188 0.433 369 2HG ARG 862 2HG ARG 862 -0.990 1.577 1.948 370 1HD ARG 862 1HD ARG 862 1.412 2.817 2.688 371 2HD ARG 862 2HD ARG 862 -0.217 3.485 2.905 372 HE ARG 862 HE ARG 862 0.359 4.023 0.252 373 1HH1 ARG 862 1HH1 ARG 862 2.852 4.030 2.485 374 2HH1 ARG 862 2HH1 ARG 862 3.250 5.705 2.302 375 1HH2 ARG 862 1HH2 ARG 862 0.506 6.419 0.312 376 2HH2 ARG 862 2HH2 ARG 862 1.929 7.056 1.067 377 HA ALA 863 HA ALA 863 5.509 1.304 1.520 378 1HB ALA 863 2HB ALA 863 6.104 -1.609 1.022 379 2HB ALA 863 3HB ALA 863 6.830 -0.533 2.216 380 3HB ALA 863 1HB ALA 863 5.176 -1.105 2.435 381 HA ARG 864 HA ARG 864 7.276 0.258 -2.687 382 1HB ARG 864 1HB ARG 864 5.228 -1.654 -3.042 383 2HB ARG 864 2HB ARG 864 5.097 -0.574 -4.435 384 1HG ARG 864 1HG ARG 864 7.847 -1.382 -3.649 385 2HG ARG 864 2HG ARG 864 6.841 -2.636 -4.353 386 1HD ARG 864 1HD ARG 864 6.329 -1.069 -6.267 387 2HD ARG 864 2HD ARG 864 7.543 0.037 -5.597 388 HE ARG 864 HE ARG 864 8.527 -2.698 -5.870 389 1HH1 ARG 864 1HH1 ARG 864 10.333 -0.393 -6.168 390 2HH1 ARG 864 2HH1 ARG 864 10.562 -0.292 -7.882 391 1HH2 ARG 864 1HH2 ARG 864 7.810 -2.263 -8.634 392 2HH2 ARG 864 2HH2 ARG 864 9.133 -1.351 -9.278 393 HA VAL 865 HA VAL 865 3.537 3.161 -4.237 394 HB VAL 865 HB VAL 865 2.638 2.032 -1.673 395 1HG1 VAL 865 1HG1 VAL 865 2.275 4.914 -2.242 396 2HG1 VAL 865 2HG1 VAL 865 0.927 4.010 -1.558 397 3HG1 VAL 865 3HG1 VAL 865 2.466 4.075 -0.701 398 1HG2 VAL 865 1HG2 VAL 865 1.711 1.414 -3.805 399 2HG2 VAL 865 2HG2 VAL 865 0.492 2.124 -2.753 400 3HG2 VAL 865 3HG2 VAL 865 1.188 3.077 -4.064 401 HA LEU 866 HA LEU 866 4.904 6.116 -0.635 402 1HB LEU 866 1HB LEU 866 4.844 5.113 1.436 403 2HB LEU 866 2HB LEU 866 5.454 3.588 0.810 404 HG LEU 866 HG LEU 866 7.355 5.898 0.966 405 1HD1 LEU 866 1HD1 LEU 866 5.920 5.571 3.161 406 2HD1 LEU 866 2HD1 LEU 866 6.966 4.168 3.383 407 3HD1 LEU 866 3HD1 LEU 866 7.668 5.782 3.265 408 1HD2 LEU 866 1HD2 LEU 866 7.496 3.166 0.359 409 2HD2 LEU 866 2HD2 LEU 866 8.861 4.242 0.648 410 3HD2 LEU 866 3HD2 LEU 866 8.189 3.293 1.975 411 1HA GLY 867 1HA GLY 867 9.333 5.155 -1.799 412 2HA GLY 867 2HA GLY 867 9.220 3.506 -2.417 413 HA THR 868 HA THR 868 8.256 5.151 -6.296 414 HB THR 868 HB THR 868 6.562 2.974 -6.030 415 HG1 THR 868 HG1 THR 868 7.767 2.722 -7.702 416 1HG2 THR 868 1HG2 THR 868 5.304 5.322 -7.456 417 2HG2 THR 868 2HG2 THR 868 4.830 3.655 -7.733 418 3HG2 THR 868 3HG2 THR 868 4.611 4.375 -6.140 419 HA ARG 869 HA ARG 869 4.813 8.165 -5.498 420 1HB ARG 869 1HB ARG 869 3.893 6.714 -3.367 421 2HB ARG 869 2HB ARG 869 4.642 8.061 -2.511 422 1HG ARG 869 1HG ARG 869 3.277 9.327 -4.554 423 2HG ARG 869 2HG ARG 869 2.704 9.162 -2.894 424 1HD ARG 869 1HD ARG 869 2.225 6.886 -4.794 425 2HD ARG 869 2HD ARG 869 1.189 8.324 -4.906 426 HE ARG 869 HE ARG 869 1.623 6.839 -2.331 427 1HH1 ARG 869 1HH1 ARG 869 0.043 9.479 -3.553 428 2HH1 ARG 869 2HH1 ARG 869 -1.550 8.995 -3.075 429 1HH2 ARG 869 1HH2 ARG 869 -0.593 5.789 -2.165 430 2HH2 ARG 869 2HH2 ARG 869 -1.910 6.907 -2.290 431 HA ALA 870 HA ALA 870 7.863 10.066 -2.017 432 1HB ALA 870 3HB ALA 870 8.693 8.260 -0.807 433 2HB ALA 870 2HB ALA 870 10.094 8.687 -1.790 434 3HB ALA 870 1HB ALA 870 9.065 7.339 -2.264 435 HA LEU 871 HA LEU 871 10.690 10.426 -5.635 436 1HB LEU 871 1HB LEU 871 10.522 8.663 -7.841 437 2HB LEU 871 2HB LEU 871 11.815 8.756 -6.656 438 HG LEU 871 HG LEU 871 9.396 7.187 -5.891 439 1HD1 LEU 871 1HD1 LEU 871 11.336 6.441 -8.066 440 2HD1 LEU 871 2HD1 LEU 871 10.560 5.203 -7.076 441 3HD1 LEU 871 3HD1 LEU 871 9.577 6.291 -8.058 442 1HD2 LEU 871 1HD2 LEU 871 12.388 7.083 -5.499 443 2HD2 LEU 871 2HD2 LEU 871 11.129 7.248 -4.274 444 3HD2 LEU 871 3HD2 LEU 871 11.369 5.703 -5.090 445 HA GLN 872 HA GLN 872 7.401 10.829 -9.098 446 1HB GLN 872 1HB GLN 872 6.042 8.743 -8.009 447 2HB GLN 872 2HB GLN 872 5.004 10.073 -7.499 448 1HG GLN 872 1HG GLN 872 5.108 10.868 -9.947 449 2HG GLN 872 2HG GLN 872 4.153 9.421 -9.624 450 2HE2 GLN 872 1HE2 GLN 872 5.754 10.304 -12.106 451 1HE2 GLN 872 2HE2 GLN 872 6.755 8.975 -12.444 452 HA ILE 873 HA ILE 873 5.413 13.707 -5.828 453 HB ILE 873 HB ILE 873 5.211 13.259 -3.434 454 1HG1 ILE 873 1HG1 ILE 873 7.438 11.408 -4.087 455 2HG1 ILE 873 2HG1 ILE 873 6.274 10.820 -2.908 456 1HG2 ILE 873 1HG2 ILE 873 4.826 10.844 -5.224 457 2HG2 ILE 873 2HG2 ILE 873 4.203 10.934 -3.582 458 3HG2 ILE 873 3HG2 ILE 873 3.629 12.059 -4.810 459 1HD1 ILE 873 1HD1 ILE 873 7.019 13.566 -2.370 460 2HD1 ILE 873 2HD1 ILE 873 7.105 12.154 -1.316 461 3HD1 ILE 873 3HD1 ILE 873 8.432 12.515 -2.420 462 HA ALA 874 HA ALA 874 9.740 14.562 -3.921 463 1HB ALA 874 3HB ALA 874 10.960 12.578 -3.705 464 2HB ALA 874 2HB ALA 874 11.846 13.388 -4.998 465 3HB ALA 874 1HB ALA 874 10.685 12.122 -5.385 466 HA MET 875 HA MET 875 10.320 15.910 -8.404 467 1HB MET 875 1HB MET 875 9.463 13.825 -9.548 468 2HB MET 875 2HB MET 875 7.820 14.427 -9.330 469 1HG MET 875 1HG MET 875 8.752 16.579 -10.518 470 2HG MET 875 2HG MET 875 9.999 15.480 -11.108 471 1HE MET 875 1HE MET 875 8.901 16.817 -13.010 472 2HE MET 875 2HE MET 875 9.228 15.335 -13.904 473 3HE MET 875 3HE MET 875 7.657 16.135 -14.052 474 HA CYS 876 HA CYS 876 6.445 18.183 -7.008 475 1HB CYS 876 1HB CYS 876 4.935 16.558 -9.109 476 2HB CYS 876 2HB CYS 876 4.314 18.049 -8.402 477 HG CYS 876 HG CYS 876 6.554 17.858 -10.489 478 HA ALA 877 HA ALA 877 4.077 14.155 -5.398 479 1HB ALA 877 3HB ALA 877 3.804 15.436 -3.636 480 2HB ALA 877 1HB ALA 877 3.624 16.856 -4.658 481 3HB ALA 877 2HB ALA 877 2.212 15.897 -4.226 482 HA PRO 878 HA PRO 878 0.325 13.204 -7.981 483 1HB PRO 878 1HB PRO 878 0.901 10.503 -7.192 484 2HB PRO 878 2HB PRO 878 1.050 11.203 -8.807 485 1HG PRO 878 1HG PRO 878 3.294 10.969 -8.610 486 2HG PRO 878 2HG PRO 878 3.149 10.517 -6.910 487 1HD PRO 878 1HD PRO 878 4.075 12.543 -6.429 488 2HD PRO 878 2HD PRO 878 3.841 13.130 -8.086 489 HA VAL 879 HA VAL 879 0.018 11.517 -3.199 490 HB VAL 879 HB VAL 879 0.894 14.316 -2.488 491 1HG1 VAL 879 1HG1 VAL 879 1.349 11.625 -1.187 492 2HG1 VAL 879 2HG1 VAL 879 1.924 13.160 -0.553 493 3HG1 VAL 879 3HG1 VAL 879 0.199 12.852 -0.667 494 1HG2 VAL 879 1HG2 VAL 879 2.625 13.528 -4.059 495 2HG2 VAL 879 2HG2 VAL 879 3.234 13.664 -2.424 496 3HG2 VAL 879 3HG2 VAL 879 2.825 12.088 -3.076 497 HA MET 880 HA MET 880 -3.382 14.478 -2.897 498 1HB MET 880 1HB MET 880 -3.503 12.003 -1.382 499 2HB MET 880 2HB MET 880 -4.486 13.243 -0.602 500 1HG MET 880 1HG MET 880 -5.228 13.668 -3.153 501 2HG MET 880 2HG MET 880 -4.821 11.956 -3.268 502 1HE MET 880 1HE MET 880 -7.004 12.048 -4.155 503 2HE MET 880 2HE MET 880 -7.529 10.626 -3.258 504 3HE MET 880 3HE MET 880 -8.537 12.079 -3.288 505 HA VAL 881 HA VAL 881 -2.179 16.713 0.880 506 HB VAL 881 HB VAL 881 0.006 16.324 2.185 507 1HG1 VAL 881 1HG1 VAL 881 -2.389 14.690 1.881 508 2HG1 VAL 881 2HG1 VAL 881 -1.020 13.706 2.395 509 3HG1 VAL 881 3HG1 VAL 881 -1.507 15.104 3.352 510 1HG2 VAL 881 1HG2 VAL 881 0.632 14.856 -0.169 511 2HG2 VAL 881 2HG2 VAL 881 1.578 14.962 1.312 512 3HG2 VAL 881 3HG2 VAL 881 0.394 13.673 1.113 513 HA GLU 882 HA GLU 882 1.055 19.438 -0.877 514 1HB GLU 882 1HB GLU 882 3.310 17.487 -0.321 515 2HB GLU 882 2HB GLU 882 3.524 19.207 -0.650 516 1HG GLU 882 1HG GLU 882 1.582 18.490 1.487 517 2HG GLU 882 2HG GLU 882 3.290 18.245 1.853 518 HA LEU 883 HA LEU 883 0.775 16.954 -4.937 519 1HB LEU 883 1HB LEU 883 -0.109 18.984 -6.449 520 2HB LEU 883 2HB LEU 883 -1.172 17.957 -5.508 521 HG LEU 883 HG LEU 883 -1.476 20.539 -5.403 522 1HD1 LEU 883 1HD1 LEU 883 -1.943 18.440 -3.552 523 2HD1 LEU 883 3HD1 LEU 883 -2.834 19.950 -3.740 524 3HD1 LEU 883 2HD1 LEU 883 -1.472 19.864 -2.623 525 1HD2 LEU 883 1HD2 LEU 883 0.856 20.202 -3.486 526 2HD2 LEU 883 2HD2 LEU 883 0.816 21.205 -4.934 527 3HD2 LEU 883 3HD2 LEU 883 -0.190 21.613 -3.549 528 HA GLU 884 HA GLU 884 4.430 19.402 -6.285 529 1HB GLU 884 1HB GLU 884 2.224 20.884 -7.214 530 2HB GLU 884 2HB GLU 884 3.516 22.066 -7.009 531 1HG GLU 884 1HG GLU 884 4.943 20.136 -8.194 532 2HG GLU 884 2HG GLU 884 3.360 19.733 -8.860 533 1HA GLY 885 1HA GLY 885 5.430 22.928 -3.369 534 2HA GLY 885 2HA GLY 885 4.125 22.665 -2.212 535 HA GLU 886 HA GLU 886 7.496 19.806 -0.892 536 1HB GLU 886 1HB GLU 886 5.195 19.430 0.201 537 2HB GLU 886 2HB GLU 886 5.223 17.844 -0.573 538 1HG GLU 886 1HG GLU 886 7.434 17.410 0.522 539 2HG GLU 886 2HG GLU 886 6.118 17.623 1.676 540 HA THR 887 HA THR 887 8.284 15.839 -3.011 541 HB THR 887 HB THR 887 10.594 16.482 -3.949 542 HG1 THR 887 HG1 THR 887 11.170 18.628 -3.568 543 1HG2 THR 887 1HG2 THR 887 8.132 17.077 -4.799 544 2HG2 THR 887 2HG2 THR 887 8.686 18.713 -4.456 545 3HG2 THR 887 3HG2 THR 887 9.563 17.710 -5.609 546 HA ASP 888 HA ASP 888 11.484 15.364 0.746 547 1HB ASP 888 1HB ASP 888 9.690 16.051 2.246 548 2HB ASP 888 2HB ASP 888 8.713 14.684 1.749 549 HA PRO 889 HA PRO 889 12.068 11.331 -0.956 550 1HB PRO 889 1HB PRO 889 13.969 10.740 0.102 551 2HB PRO 889 2HB PRO 889 13.043 10.220 1.514 552 1HG PRO 889 1HG PRO 889 14.738 12.497 1.306 553 2HG PRO 889 2HG PRO 889 13.698 12.061 2.665 554 1HD PRO 889 1HD PRO 889 12.445 13.906 2.189 555 2HD PRO 889 2HD PRO 889 13.330 14.180 0.674 556 HA LEU 890 HA LEU 890 8.174 9.771 0.911 557 1HB LEU 890 1HB LEU 890 10.161 8.497 1.866 558 2HB LEU 890 2HB LEU 890 8.604 8.084 2.560 559 HG LEU 890 HG LEU 890 10.531 8.378 4.209 560 1HD1 LEU 890 1HD1 LEU 890 11.330 10.512 3.007 561 2HD1 LEU 890 2HD1 LEU 890 10.020 11.322 3.865 562 3HD1 LEU 890 3HD1 LEU 890 11.307 10.531 4.770 563 1HD2 LEU 890 1HD2 LEU 890 7.860 8.814 4.478 564 2HD2 LEU 890 2HD2 LEU 890 9.003 8.879 5.818 565 3HD2 LEU 890 3HD2 LEU 890 8.498 10.367 5.019 566 HA LEU 891 HA LEU 891 6.958 12.277 4.967 567 1HB LEU 891 1HB LEU 891 7.890 14.367 4.921 568 2HB LEU 891 2HB LEU 891 7.888 14.407 3.173 569 HG LEU 891 HG LEU 891 6.429 16.127 4.252 570 1HD1 LEU 891 1HD1 LEU 891 5.990 14.767 1.940 571 2HD1 LEU 891 2HD1 LEU 891 4.452 14.536 2.774 572 3HD1 LEU 891 3HD1 LEU 891 5.053 16.163 2.467 573 1HD2 LEU 891 1HD2 LEU 891 5.361 13.745 5.542 574 2HD2 LEU 891 2HD2 LEU 891 5.176 15.438 5.993 575 3HD2 LEU 891 3HD2 LEU 891 4.096 14.723 4.799 576 HA ILE 892 HA ILE 892 3.508 13.072 1.683 577 HB ILE 892 HB ILE 892 5.808 12.902 -0.089 578 1HG1 ILE 892 1HG1 ILE 892 3.190 14.116 -0.795 579 2HG1 ILE 892 2HG1 ILE 892 4.116 14.790 0.547 580 1HG2 ILE 892 1HG2 ILE 892 3.231 11.608 -0.973 581 2HG2 ILE 892 2HG2 ILE 892 4.440 12.221 -2.088 582 3HG2 ILE 892 3HG2 ILE 892 4.848 10.913 -0.996 583 1HD1 ILE 892 2HD1 ILE 892 6.123 14.651 -1.048 584 2HD1 ILE 892 3HD1 ILE 892 4.915 14.502 -2.321 585 3HD1 ILE 892 1HD1 ILE 892 4.950 15.940 -1.305 586 HA ALA 893 HA ALA 893 3.704 8.503 0.303 587 1HB ALA 893 3HB ALA 893 5.729 7.813 -0.515 588 2HB ALA 893 1HB ALA 893 6.619 8.549 0.817 589 3HB ALA 893 2HB ALA 893 5.811 7.005 1.047 590 HA MET 894 HA MET 894 4.136 7.673 4.981 591 1HB MET 894 1HB MET 894 6.220 8.706 5.561 592 2HB MET 894 2HB MET 894 5.625 10.311 5.146 593 1HG MET 894 1HG MET 894 4.096 10.259 7.072 594 2HG MET 894 2HG MET 894 4.647 8.634 7.479 595 1HE MET 894 1HE MET 894 5.679 11.905 6.331 596 2HE MET 894 2HE MET 894 6.096 12.672 7.870 597 3HE MET 894 3HE MET 894 7.369 12.088 6.802 598 HA LYS 895 HA LYS 895 1.450 11.668 6.088 599 1HB LYS 895 1HB LYS 895 2.666 13.426 4.997 600 2HB LYS 895 2HB LYS 895 2.420 12.699 3.411 601 1HG LYS 895 1HG LYS 895 0.781 14.298 3.317 602 2HG LYS 895 2HG LYS 895 -0.151 13.025 4.102 603 1HD LYS 895 1HD LYS 895 1.383 15.167 5.600 604 2HD LYS 895 2HD LYS 895 -0.341 15.260 5.240 605 1HE LYS 895 1HE LYS 895 -0.451 12.897 6.376 606 2HE LYS 895 2HE LYS 895 1.097 13.379 7.101 607 1HZ LYS 895 3HZ LYS 895 0.070 15.459 7.805 608 2HZ LYS 895 1HZ LYS 895 -1.418 14.966 7.150 609 3HZ LYS 895 2HZ LYS 895 -0.749 14.130 8.469 610 HA GLU 896 HA GLU 896 -1.187 10.327 2.210 611 1HB GLU 896 1HB GLU 896 1.332 9.163 1.174 612 2HB GLU 896 2HB GLU 896 -0.095 8.168 0.897 613 1HG GLU 896 1HG GLU 896 -0.084 11.118 0.272 614 2HG GLU 896 2HG GLU 896 0.457 9.919 -0.903 615 HA LEU 897 HA LEU 897 -1.160 6.022 4.142 616 1HB LEU 897 1HB LEU 897 1.170 5.249 3.825 617 2HB LEU 897 2HB LEU 897 1.661 6.158 5.250 618 HG LEU 897 HG LEU 897 0.990 3.532 5.334 619 1HD1 LEU 897 1HD1 LEU 897 0.803 5.761 7.325 620 2HD1 LEU 897 2HD1 LEU 897 0.276 4.149 7.806 621 3HD1 LEU 897 3HD1 LEU 897 1.933 4.409 7.261 622 1HD2 LEU 897 1HD2 LEU 897 -1.422 4.376 4.660 623 2HD2 LEU 897 2HD2 LEU 897 -1.251 3.147 5.908 624 3HD2 LEU 897 3HD2 LEU 897 -1.529 4.821 6.361 625 HA LYS 898 HA LYS 898 -0.259 7.991 8.610 626 1HB LYS 898 1HB LYS 898 1.590 9.460 7.900 627 2HB LYS 898 2HB LYS 898 0.452 10.418 6.954 628 1HG LYS 898 1HG LYS 898 -0.590 11.312 8.851 629 2HG LYS 898 2HG LYS 898 0.013 10.032 9.904 630 1HD LYS 898 1HD LYS 898 2.372 10.978 9.243 631 2HD LYS 898 2HD LYS 898 1.462 12.429 8.823 632 1HE LYS 898 1HE LYS 898 0.943 11.134 11.484 633 2HE LYS 898 2HE LYS 898 2.386 12.147 11.283 634 1HZ LYS 898 3HZ LYS 898 0.978 13.883 10.335 635 2HZ LYS 898 1HZ LYS 898 -0.401 12.926 10.599 636 3HZ LYS 898 2HZ LYS 898 0.494 13.505 11.919 637 HA ALA 899 HA ALA 899 -3.866 10.576 7.001 638 1HB ALA 899 2HB ALA 899 -4.345 10.854 4.409 639 2HB ALA 899 3HB ALA 899 -3.063 11.802 5.163 640 3HB ALA 899 1HB ALA 899 -2.663 10.349 4.249 641 HA ARG 900 HA ARG 900 -3.894 5.671 4.943 642 1HB ARG 900 1HB ARG 900 -5.074 5.026 6.796 643 2HB ARG 900 2HB ARG 900 -4.850 6.674 7.369 644 1HG ARG 900 1HG ARG 900 -6.994 7.219 6.006 645 2HG ARG 900 2HG ARG 900 -7.248 5.473 5.988 646 1HD ARG 900 1HD ARG 900 -6.681 6.916 8.583 647 2HD ARG 900 2HD ARG 900 -8.330 6.800 7.937 648 HE ARG 900 HE ARG 900 -6.898 4.249 7.933 649 1HH1 ARG 900 1HH1 ARG 900 -9.799 4.253 8.218 650 2HH1 ARG 900 2HH1 ARG 900 -10.044 4.014 9.916 651 1HH2 ARG 900 1HH2 ARG 900 -6.800 4.888 10.776 652 2HH2 ARG 900 2HH2 ARG 900 -8.346 4.375 11.364 653 HA LYS 901 HA LYS 901 -7.116 7.702 2.440 654 1HB LYS 901 1HB LYS 901 -5.000 9.734 2.301 655 2HB LYS 901 2HB LYS 901 -5.820 9.486 0.760 656 1HG LYS 901 1HG LYS 901 -8.013 9.682 2.062 657 2HG LYS 901 2HG LYS 901 -7.080 11.167 1.882 658 1HD LYS 901 1HD LYS 901 -6.718 9.377 4.285 659 2HD LYS 901 2HD LYS 901 -6.303 11.083 4.114 660 1HE LYS 901 1HE LYS 901 -9.158 10.051 4.014 661 2HE LYS 901 2HE LYS 901 -8.391 10.692 5.481 662 1HZ LYS 901 1HZ LYS 901 -7.813 12.700 4.194 663 2HZ LYS 901 2HZ LYS 901 -8.709 12.103 2.884 664 3HZ LYS 901 3HZ LYS 901 -9.492 12.482 4.344 665 HA ILE 902 HA ILE 902 -2.739 6.339 -0.360 666 HB ILE 902 HB ILE 902 -4.528 4.171 0.772 667 1HG1 ILE 902 1HG1 ILE 902 -2.540 3.802 2.318 668 2HG1 ILE 902 2HG1 ILE 902 -3.473 5.263 2.642 669 1HG2 ILE 902 1HG2 ILE 902 -1.834 4.168 -0.613 670 2HG2 ILE 902 2HG2 ILE 902 -2.487 2.771 0.240 671 3HG2 ILE 902 3HG2 ILE 902 -3.322 3.410 -1.176 672 1HD1 ILE 902 1HD1 ILE 902 -1.221 5.519 0.710 673 2HD1 ILE 902 2HD1 ILE 902 -1.786 6.654 1.935 674 3HD1 ILE 902 3HD1 ILE 902 -0.786 5.280 2.401 675 HA PRO 903 HA PRO 903 -6.713 6.380 -2.979 676 1HB PRO 903 1HB PRO 903 -5.752 8.693 -4.388 677 2HB PRO 903 2HB PRO 903 -7.167 8.574 -3.341 678 1HG PRO 903 1HG PRO 903 -4.773 9.996 -2.803 679 2HG PRO 903 2HG PRO 903 -6.110 9.709 -1.685 680 1HD PRO 903 1HD PRO 903 -4.683 8.430 -0.452 681 2HD PRO 903 2HD PRO 903 -3.449 8.466 -1.729 682 HA ILE 904 HA ILE 904 -4.318 5.000 -6.374 683 HB ILE 904 HB ILE 904 -2.400 5.481 -4.298 684 1HG1 ILE 904 1HG1 ILE 904 -1.662 5.581 -7.168 685 2HG1 ILE 904 2HG1 ILE 904 -3.079 6.518 -6.698 686 1HG2 ILE 904 1HG2 ILE 904 -1.717 3.338 -6.321 687 2HG2 ILE 904 2HG2 ILE 904 -0.512 4.253 -5.415 688 3HG2 ILE 904 3HG2 ILE 904 -1.649 3.210 -4.562 689 1HD1 ILE 904 2HD1 ILE 904 -1.690 7.514 -4.833 690 2HD1 ILE 904 3HD1 ILE 904 -0.284 6.734 -5.556 691 3HD1 ILE 904 1HD1 ILE 904 -1.169 7.965 -6.457 692 HA ILE 905 HA ILE 905 -4.698 0.632 -6.449 693 HB ILE 905 HB ILE 905 -5.726 1.602 -8.498 694 1HG1 ILE 905 1HG1 ILE 905 -4.440 -0.574 -9.858 695 2HG1 ILE 905 2HG1 ILE 905 -4.635 -1.012 -8.161 696 1HG2 ILE 905 1HG2 ILE 905 -3.726 2.812 -9.314 697 2HG2 ILE 905 2HG2 ILE 905 -2.941 1.272 -9.656 698 3HG2 ILE 905 3HG2 ILE 905 -4.379 1.748 -10.557 699 1HD1 ILE 905 1HD1 ILE 905 -6.895 0.219 -9.722 700 2HD1 ILE 905 2HD1 ILE 905 -6.602 -1.519 -9.752 701 3HD1 ILE 905 3HD1 ILE 905 -6.972 -0.711 -8.226 702 HA ILE 906 HA ILE 906 -0.475 -0.686 -7.525 703 HB ILE 906 HB ILE 906 -1.560 -1.568 -4.869 704 1HG1 ILE 906 1HG1 ILE 906 0.796 0.049 -5.854 705 2HG1 ILE 906 2HG1 ILE 906 0.548 -0.344 -4.153 706 1HG2 ILE 906 1HG2 ILE 906 0.799 -2.781 -6.270 707 2HG2 ILE 906 2HG2 ILE 906 0.912 -2.474 -4.538 708 3HG2 ILE 906 3HG2 ILE 906 -0.351 -3.532 -5.165 709 1HD1 ILE 906 1HD1 ILE 906 -1.930 0.614 -5.004 710 2HD1 ILE 906 2HD1 ILE 906 -0.748 1.503 -4.052 711 3HD1 ILE 906 3HD1 ILE 906 -0.762 1.664 -5.804 712 HA ARG 907 HA ARG 907 -1.464 -4.748 -9.033 713 1HB ARG 907 1HB ARG 907 1.021 -3.714 -10.341 714 2HB ARG 907 2HB ARG 907 0.372 -5.290 -10.772 715 1HG ARG 907 1HG ARG 907 -0.532 -3.592 -12.281 716 2HG ARG 907 2HG ARG 907 -1.814 -4.231 -11.254 717 1HD ARG 907 1HD ARG 907 -2.097 -2.238 -10.134 718 2HD ARG 907 2HD ARG 907 -0.374 -1.823 -10.233 719 HE ARG 907 HE ARG 907 -0.777 -0.832 -12.349 720 1HH1 ARG 907 1HH1 ARG 907 -2.112 -3.156 -13.646 721 2HH1 ARG 907 2HH1 ARG 907 -3.711 -2.556 -13.933 722 1HH2 ARG 907 1HH2 ARG 907 -3.398 0.096 -11.721 723 2HH2 ARG 907 2HH2 ARG 907 -4.439 -0.715 -12.842 724 HA ARG 908 HA ARG 908 1.404 -7.106 -6.578 725 1HB ARG 908 1HB ARG 908 -0.872 -8.825 -5.829 726 2HB ARG 908 2HB ARG 908 0.295 -8.030 -4.798 727 1HG ARG 908 1HG ARG 908 -1.001 -5.877 -5.124 728 2HG ARG 908 2HG ARG 908 -2.236 -6.819 -5.957 729 1HD ARG 908 1HD ARG 908 -2.794 -6.511 -3.490 730 2HD ARG 908 2HD ARG 908 -2.557 -8.224 -3.908 731 HE ARG 908 HE ARG 908 -0.078 -6.885 -3.132 732 1HH1 ARG 908 1HH1 ARG 908 -2.967 -7.653 -1.554 733 2HH1 ARG 908 2HH1 ARG 908 -2.231 -8.629 -0.328 734 1HH2 ARG 908 1HH2 ARG 908 0.919 -8.546 -1.775 735 2HH2 ARG 908 2HH2 ARG 908 -0.034 -9.135 -0.453 736 HA TYR 909 HA TYR 909 0.911 -10.178 -9.893 737 1HB TYR 909 1HB TYR 909 3.843 -9.659 -10.157 738 2HB TYR 909 2HB TYR 909 2.722 -10.206 -11.375 739 HD1 TYR 909 HD1 TYR 909 3.949 -7.203 -9.533 740 HD2 TYR 909 HD2 TYR 909 1.453 -8.681 -12.681 741 HE1 TYR 909 HE1 TYR 909 3.805 -4.944 -10.474 742 HE2 TYR 909 HE2 TYR 909 1.288 -6.424 -13.619 743 HH TYR 909 HH TYR 909 2.924 -4.264 -13.487 744 HA LEU 910 HA LEU 910 3.569 -12.953 -7.538 745 1HB LEU 910 1HB LEU 910 1.726 -14.467 -9.395 746 2HB LEU 910 2HB LEU 910 2.394 -15.136 -7.903 747 HG LEU 910 HG LEU 910 0.549 -12.745 -8.176 748 1HD1 LEU 910 1HD1 LEU 910 0.141 -15.584 -7.794 749 2HD1 LEU 910 2HD1 LEU 910 -0.457 -14.686 -6.405 750 3HD1 LEU 910 3HD1 LEU 910 -1.057 -14.310 -8.017 751 1HD2 LEU 910 1HD2 LEU 910 2.450 -13.395 -6.122 752 2HD2 LEU 910 2HD2 LEU 910 1.301 -12.061 -6.175 753 3HD2 LEU 910 3HD2 LEU 910 0.824 -13.606 -5.478 754 HA PRO 911 HA PRO 911 6.988 -14.033 -10.272 755 1HB PRO 911 1HB PRO 911 8.340 -14.991 -7.919 756 2HB PRO 911 2HB PRO 911 8.649 -13.491 -8.800 757 1HG PRO 911 1HG PRO 911 7.767 -12.309 -7.083 758 2HG PRO 911 2HG PRO 911 7.427 -13.807 -6.216 759 1HD PRO 911 1HD PRO 911 5.197 -13.532 -6.622 760 2HD PRO 911 2HD PRO 911 5.541 -12.043 -7.531 761 HA ASP 912 HA ASP 912 6.095 -18.437 -8.459 762 1HB ASP 912 1HB ASP 912 3.718 -17.080 -7.295 763 2HB ASP 912 2HB ASP 912 3.497 -18.775 -7.733 764 1HA GLY 913 1HA GLY 913 3.591 -17.182 -12.578 765 2HA GLY 913 2HA GLY 913 3.091 -18.745 -11.934 766 HA SER 914 HA SER 914 -0.462 -15.585 -12.233 767 1HB SER 914 1HB SER 914 0.145 -16.335 -9.419 768 2HB SER 914 2HB SER 914 -1.262 -15.310 -9.680 769 HG SER 914 HG SER 914 -0.695 -17.856 -10.797 770 HA TYR 915 HA TYR 915 -0.145 -11.584 -9.732 771 1HB TYR 915 1HB TYR 915 0.995 -11.044 -11.643 772 2HB TYR 915 2HB TYR 915 -0.110 -11.953 -12.662 773 HD1 TYR 915 HD1 TYR 915 -0.178 -8.807 -10.572 774 HD2 TYR 915 HD2 TYR 915 -1.289 -10.743 -14.242 775 HE1 TYR 915 HE1 TYR 915 -1.153 -6.688 -11.396 776 HE2 TYR 915 HE2 TYR 915 -2.264 -8.620 -15.064 777 HH TYR 915 HH TYR 915 -1.695 -5.948 -14.368 778 HA GLU 916 HA GLU 916 -4.255 -9.605 -10.516 779 1HB GLU 916 1HB GLU 916 -3.649 -10.845 -8.099 780 2HB GLU 916 2HB GLU 916 -4.195 -9.235 -7.626 781 1HG GLU 916 1HG GLU 916 -5.776 -10.689 -9.700 782 2HG GLU 916 2HG GLU 916 -5.938 -11.206 -8.021 783 HA ASP 917 HA ASP 917 -3.215 -5.373 -9.477 784 1HB ASP 917 1HB ASP 917 -3.301 -5.570 -11.891 785 2HB ASP 917 2HB ASP 917 -4.000 -4.043 -11.386 786 HA TRP 918 HA TRP 918 -6.322 -2.343 -8.225 787 1HB TRP 918 1HB TRP 918 -7.709 -3.559 -6.518 788 2HB TRP 918 2HB TRP 918 -7.803 -4.184 -8.145 789 HD1 TRP 918 HD1 TRP 918 -4.659 -5.623 -7.058 790 HE1 TRP 918 HE1 TRP 918 -5.049 -8.026 -6.169 791 HE3 TRP 918 HE3 TRP 918 -9.583 -5.318 -6.178 792 HZ2 TRP 918 HZ2 TRP 918 -7.263 -9.551 -5.050 793 HZ3 TRP 918 HZ3 TRP 918 -10.830 -7.123 -5.126 794 HH2 TRP 918 HH2 TRP 918 -9.699 -9.287 -4.567 795 1HA GLY 919 1HA GLY 919 -4.617 -2.316 -3.941 796 2HA GLY 919 2HA GLY 919 -4.394 -0.749 -4.706 797 HA VAL 920 HA VAL 920 -7.569 0.377 -1.883 798 HB VAL 920 HB VAL 920 -6.430 2.919 -3.103 799 1HG1 VAL 920 1HG1 VAL 920 -7.823 2.381 -0.460 800 2HG1 VAL 920 2HG1 VAL 920 -7.004 3.889 -0.867 801 3HG1 VAL 920 3HG1 VAL 920 -8.428 3.384 -1.778 802 1HG2 VAL 920 1HG2 VAL 920 -5.462 0.927 -1.098 803 2HG2 VAL 920 2HG2 VAL 920 -4.555 1.849 -2.295 804 3HG2 VAL 920 3HG2 VAL 920 -5.094 2.627 -0.812 805 HA ASP 921 HA ASP 921 -10.306 2.246 -5.134 806 1HB ASP 921 1HB ASP 921 -8.247 1.948 -6.959 807 2HB ASP 921 2HB ASP 921 -9.512 0.930 -7.645 808 HA GLU 922 HA GLU 922 -12.010 -1.955 -5.345 809 1HB GLU 922 1HB GLU 922 -10.003 -2.350 -7.021 810 2HB GLU 922 2HB GLU 922 -9.534 -3.560 -5.830 811 1HG GLU 922 1HG GLU 922 -11.877 -4.502 -5.982 812 2HG GLU 922 2HG GLU 922 -10.944 -4.657 -7.472 813 HA LEU 923 HA LEU 923 -10.464 -3.355 -1.259 814 1HB LEU 923 1HB LEU 923 -8.195 -4.594 -1.018 815 2HB LEU 923 2HB LEU 923 -9.283 -5.069 -2.304 816 HG LEU 923 HG LEU 923 -7.714 -2.985 -3.375 817 1HD1 LEU 923 3HD1 LEU 923 -6.087 -3.400 -1.559 818 2HD1 LEU 923 1HD1 LEU 923 -6.021 -5.096 -2.026 819 3HD1 LEU 923 2HD1 LEU 923 -5.450 -3.851 -3.137 820 1HD2 LEU 923 1HD2 LEU 923 -8.287 -5.812 -3.699 821 2HD2 LEU 923 2HD2 LEU 923 -8.166 -4.520 -4.892 822 3HD2 LEU 923 3HD2 LEU 923 -6.706 -5.327 -4.316 823 HA ILE 924 HA ILE 924 -8.139 -1.160 1.737 824 HB ILE 924 HB ILE 924 -7.065 -3.851 1.914 825 1HG1 ILE 924 1HG1 ILE 924 -7.582 -3.196 4.373 826 2HG1 ILE 924 2HG1 ILE 924 -8.271 -1.748 3.643 827 1HG2 ILE 924 1HG2 ILE 924 -4.885 -2.664 2.049 828 2HG2 ILE 924 2HG2 ILE 924 -5.519 -1.731 3.402 829 3HG2 ILE 924 3HG2 ILE 924 -5.330 -3.474 3.543 830 1HD1 ILE 924 3HD1 ILE 924 -8.933 -4.533 2.696 831 2HD1 ILE 924 1HD1 ILE 924 -9.900 -3.667 3.893 832 3HD1 ILE 924 2HD1 ILE 924 -9.734 -3.026 2.257 833 HA ILE 925 HA ILE 925 -4.420 0.877 0.515 834 HB ILE 925 HB ILE 925 -4.132 2.666 2.202 835 1HG1 ILE 925 1HG1 ILE 925 -6.258 1.686 3.985 836 2HG1 ILE 925 2HG1 ILE 925 -4.811 0.681 4.019 837 1HG2 ILE 925 1HG2 ILE 925 -6.989 1.832 1.638 838 2HG2 ILE 925 2HG2 ILE 925 -6.558 3.391 2.341 839 3HG2 ILE 925 3HG2 ILE 925 -6.009 2.972 0.721 840 1HD1 ILE 925 1HD1 ILE 925 -3.697 3.170 4.081 841 2HD1 ILE 925 2HD1 ILE 925 -5.201 3.459 4.957 842 3HD1 ILE 925 3HD1 ILE 925 -4.072 2.227 5.523 843 HA THR 926 HA THR 926 -0.847 -0.487 2.912 844 HB THR 926 HB THR 926 -1.350 1.940 4.314 845 HG1 THR 926 HG1 THR 926 0.975 1.690 4.693 846 1HG2 THR 926 1HG2 THR 926 -0.419 -0.295 6.138 847 2HG2 THR 926 2HG2 THR 926 -0.302 1.422 6.517 848 3HG2 THR 926 3HG2 THR 926 -1.884 0.671 6.322 849 HA ASP 927 HA ASP 927 -3.878 -2.911 5.608 850 1HB ASP 927 1HB ASP 927 -1.717 -1.722 6.975 851 2HB ASP 927 2HB ASP 927 -2.986 -1.891 8.188 No H/Q in entry = 851 Start of MODEL 15 1 HA MET 801 HA MET 801 15.391 -15.210 17.211 2 1HB MET 801 1HB MET 801 18.224 -14.241 17.209 3 2HB MET 801 2HB MET 801 17.625 -15.040 18.663 4 1HG MET 801 1HG MET 801 16.706 -16.800 16.889 5 2HG MET 801 2HG MET 801 18.028 -16.153 15.918 6 1HE MET 801 2HE MET 801 20.211 -15.746 16.652 7 2HE MET 801 1HE MET 801 21.181 -16.828 17.649 8 3HE MET 801 3HE MET 801 20.493 -17.415 16.137 9 HA SER 802 HA SER 802 12.764 -12.264 19.578 10 1HB SER 802 1HB SER 802 13.519 -12.707 21.788 11 2HB SER 802 2HB SER 802 13.905 -14.171 20.889 12 HG SER 802 HG SER 802 15.690 -13.505 22.098 13 HA ASP 803 HA ASP 803 15.963 -8.972 18.907 14 1HB ASP 803 1HB ASP 803 14.216 -9.117 16.473 15 2HB ASP 803 2HB ASP 803 15.125 -7.636 16.782 16 HA ASN 804 HA ASN 804 12.608 -6.756 21.200 17 1HB ASN 804 1HB ASN 804 15.334 -5.705 22.013 18 2HB ASN 804 2HB ASN 804 13.816 -5.173 22.737 19 2HD2 ASN 804 1HD2 ASN 804 13.436 -6.244 24.674 20 1HD2 ASN 804 2HD2 ASN 804 13.838 -7.862 24.995 21 HA GLU 805 HA GLU 805 13.777 -2.546 19.304 22 1HB GLU 805 1HB GLU 805 16.411 -3.041 19.863 23 2HB GLU 805 2HB GLU 805 16.450 -2.958 18.101 24 1HG GLU 805 1HG GLU 805 15.499 -0.758 18.094 25 2HG GLU 805 2HG GLU 805 15.103 -0.855 19.810 26 HA ASP 806 HA ASP 806 12.848 -4.911 15.497 27 1HB ASP 806 1HB ASP 806 10.602 -3.639 16.740 28 2HB ASP 806 2HB ASP 806 10.581 -3.222 15.027 29 HA ASN 807 HA ASN 807 13.805 -1.499 12.757 30 1HB ASN 807 1HB ASN 807 15.787 -2.013 14.499 31 2HB ASN 807 2HB ASN 807 16.579 -2.580 13.028 32 2HD2 ASN 807 1HD2 ASN 807 14.355 0.195 13.674 33 1HD2 ASN 807 2HD2 ASN 807 15.382 1.362 12.993 34 HA PHE 808 HA PHE 808 15.042 -4.105 9.238 35 1HB PHE 808 1HB PHE 808 15.434 -1.361 8.884 36 2HB PHE 808 2HB PHE 808 16.773 -2.097 8.002 37 HD1 PHE 808 HD1 PHE 808 16.331 -3.741 6.186 38 HD2 PHE 808 HD2 PHE 808 13.157 -1.608 8.142 39 HE1 PHE 808 HE1 PHE 808 14.785 -4.352 4.345 40 HE2 PHE 808 HE2 PHE 808 11.612 -2.219 6.302 41 HZ PHE 808 HZ PHE 808 12.426 -3.590 4.403 42 HA ASP 809 HA ASP 809 19.608 -4.927 9.933 43 1HB ASP 809 1HB ASP 809 20.905 -4.620 7.843 44 2HB ASP 809 2HB ASP 809 19.185 -4.806 7.505 45 1HA GLY 810 1HA GLY 810 20.932 -1.214 12.705 46 2HA GLY 810 2HA GLY 810 22.170 -1.609 11.511 47 HA ASP 811 HA ASP 811 20.403 2.516 10.315 48 1HB ASP 811 1HB ASP 811 19.742 2.711 13.204 49 2HB ASP 811 2HB ASP 811 20.012 4.246 12.378 50 HA ASP 812 HA ASP 812 24.235 4.669 11.136 51 1HB ASP 812 1HB ASP 812 23.109 5.751 9.182 52 2HB ASP 812 2HB ASP 812 22.506 7.007 10.263 53 HA PHE 813 HA PHE 813 24.180 6.651 15.123 54 1HB PHE 813 1HB PHE 813 21.830 7.448 13.907 55 2HB PHE 813 2HB PHE 813 21.284 7.018 15.528 56 HD1 PHE 813 HD1 PHE 813 23.127 7.794 17.422 57 HD2 PHE 813 HD2 PHE 813 22.407 9.681 13.631 58 HE1 PHE 813 HE1 PHE 813 24.063 9.916 18.301 59 HE2 PHE 813 HE2 PHE 813 23.343 11.803 14.510 60 HZ PHE 813 HZ PHE 813 24.171 11.920 16.844 61 HA ASP 814 HA ASP 814 22.727 3.538 18.021 62 1HB ASP 814 1HB ASP 814 21.575 2.538 15.868 63 2HB ASP 814 2HB ASP 814 22.810 1.288 16.027 64 HA ASP 815 HA ASP 815 27.469 3.350 18.731 65 1HB ASP 815 1HB ASP 815 25.490 1.975 20.050 66 2HB ASP 815 2HB ASP 815 26.428 0.656 19.350 67 HA VAL 816 HA VAL 816 28.240 0.786 15.069 68 HB VAL 816 HB VAL 816 29.741 2.065 13.550 69 1HG1 VAL 816 1HG1 VAL 816 27.148 2.520 14.019 70 2HG1 VAL 816 2HG1 VAL 816 27.774 4.094 14.511 71 3HG1 VAL 816 3HG1 VAL 816 28.068 3.500 12.877 72 1HG2 VAL 816 1HG2 VAL 816 30.548 3.308 15.939 73 2HG2 VAL 816 2HG2 VAL 816 31.048 3.748 14.305 74 3HG2 VAL 816 3HG2 VAL 816 29.672 4.557 15.054 75 HA GLU 817 HA GLU 817 32.171 -0.445 16.941 76 1HB GLU 817 1HB GLU 817 30.030 -1.058 18.923 77 2HB GLU 817 2HB GLU 817 31.526 -1.983 19.061 78 1HG GLU 817 1HG GLU 817 31.558 1.022 18.781 79 2HG GLU 817 2HG GLU 817 31.397 0.247 20.357 80 HA GLU 818 HA GLU 818 31.567 -4.520 15.152 81 1HB GLU 818 1HB GLU 818 28.623 -3.879 15.217 82 2HB GLU 818 2HB GLU 818 29.181 -5.416 14.555 83 1HG GLU 818 1HG GLU 818 30.266 -5.997 16.634 84 2HG GLU 818 2HG GLU 818 29.955 -4.393 17.299 85 HA ASP 819 HA ASP 819 31.779 -3.584 10.813 86 1HB ASP 819 1HB ASP 819 33.656 -5.134 11.217 87 2HB ASP 819 2HB ASP 819 32.886 -5.491 9.671 88 HA GLU 820 HA GLU 820 27.972 -5.148 9.201 89 1HB GLU 820 1HB GLU 820 29.656 -4.002 7.035 90 2HB GLU 820 2HB GLU 820 28.256 -4.939 6.510 91 1HG GLU 820 1HG GLU 820 28.024 -2.800 8.630 92 2HG GLU 820 2HG GLU 820 27.889 -2.421 6.912 93 1HA GLY 821 1HA GLY 821 29.046 -9.275 7.917 94 2HA GLY 821 2HA GLY 821 27.460 -9.553 8.639 95 HA LEU 822 HA LEU 822 26.389 -8.320 4.132 96 1HB LEU 822 1HB LEU 822 27.937 -7.754 2.274 97 2HB LEU 822 2HB LEU 822 28.180 -6.693 3.661 98 HG LEU 822 HG LEU 822 29.909 -8.698 4.279 99 1HD1 LEU 822 1HD1 LEU 822 29.209 -9.574 1.871 100 2HD1 LEU 822 2HD1 LEU 822 30.397 -8.381 1.342 101 3HD1 LEU 822 3HD1 LEU 822 30.881 -9.688 2.422 102 1HD2 LEU 822 1HD2 LEU 822 30.152 -6.098 3.911 103 2HD2 LEU 822 2HD2 LEU 822 31.581 -7.129 3.843 104 3HD2 LEU 822 3HD2 LEU 822 30.815 -6.580 2.351 105 HA ASP 823 HA ASP 823 28.850 -12.290 2.718 106 1HB ASP 823 1HB ASP 823 30.074 -13.773 4.307 107 2HB ASP 823 2HB ASP 823 30.763 -12.151 4.259 108 HA ASP 824 HA ASP 824 25.499 -14.389 5.122 109 1HB ASP 824 1HB ASP 824 26.773 -14.161 7.304 110 2HB ASP 824 2HB ASP 824 25.697 -12.823 7.711 111 HA LEU 825 HA LEU 825 22.322 -11.191 4.818 112 1HB LEU 825 1HB LEU 825 24.474 -9.534 5.227 113 2HB LEU 825 2HB LEU 825 23.838 -8.912 3.703 114 HG LEU 825 HG LEU 825 21.518 -9.109 4.969 115 1HD1 LEU 825 1HD1 LEU 825 23.573 -8.889 7.187 116 2HD1 LEU 825 2HD1 LEU 825 21.868 -8.487 7.389 117 3HD1 LEU 825 3HD1 LEU 825 22.344 -10.140 6.996 118 1HD2 LEU 825 1HD2 LEU 825 23.636 -6.976 5.153 119 2HD2 LEU 825 2HD2 LEU 825 22.149 -6.981 4.204 120 3HD2 LEU 825 3HD2 LEU 825 22.080 -6.745 5.951 121 HA GLU 826 HA GLU 826 24.200 -10.160 -0.167 122 1HB GLU 826 1HB GLU 826 24.065 -12.616 0.425 123 2HB GLU 826 2HB GLU 826 22.310 -12.442 0.480 124 1HG GLU 826 1HG GLU 826 22.123 -12.186 -1.801 125 2HG GLU 826 2HG GLU 826 23.710 -11.428 -1.951 126 HA ASN 827 HA ASN 827 20.120 -8.118 0.082 127 1HB ASN 827 1HB ASN 827 22.259 -6.032 -0.417 128 2HB ASN 827 2HB ASN 827 20.541 -5.639 -0.367 129 2HD2 ASN 827 1HD2 ASN 827 19.378 -6.219 1.721 130 1HD2 ASN 827 2HD2 ASN 827 20.262 -6.200 3.170 131 HA ALA 828 HA ALA 828 21.011 -8.466 -4.575 132 1HB ALA 828 3HB ALA 828 21.440 -10.792 -4.402 133 2HB ALA 828 2HB ALA 828 19.924 -10.709 -5.299 134 3HB ALA 828 1HB ALA 828 19.910 -11.097 -3.579 135 HA GLU 829 HA GLU 829 16.379 -8.457 -5.260 136 1HB GLU 829 1HB GLU 829 16.255 -10.988 -4.204 137 2HB GLU 829 2HB GLU 829 15.121 -10.121 -3.167 138 1HG GLU 829 1HG GLU 829 14.049 -9.208 -5.274 139 2HG GLU 829 2HG GLU 829 13.861 -10.946 -5.043 140 HA GLU 830 HA GLU 830 16.008 -7.510 0.074 141 1HB GLU 830 1HB GLU 830 17.527 -6.150 -1.690 142 2HB GLU 830 2HB GLU 830 16.056 -5.181 -1.788 143 1HG GLU 830 1HG GLU 830 16.189 -5.389 0.872 144 2HG GLU 830 2HG GLU 830 17.906 -5.591 0.520 145 HA GLU 831 HA GLU 831 11.850 -6.283 -1.583 146 1HB GLU 831 1HB GLU 831 12.679 -7.468 -3.921 147 2HB GLU 831 2HB GLU 831 11.278 -8.455 -3.504 148 1HG GLU 831 1HG GLU 831 9.881 -6.456 -3.322 149 2HG GLU 831 2HG GLU 831 11.277 -5.425 -3.639 150 1HA GLY 832 1HA GLY 832 9.707 -9.760 0.302 151 2HA GLY 832 2HA GLY 832 8.254 -8.949 -0.284 152 HA GLN 833 HA GLN 833 7.974 -12.471 -3.003 153 1HB GLN 833 1HB GLN 833 6.538 -14.165 -1.877 154 2HB GLN 833 2HB GLN 833 7.720 -13.482 -0.759 155 1HG GLN 833 1HG GLN 833 5.994 -11.855 0.012 156 2HG GLN 833 2HG GLN 833 4.818 -12.655 -1.030 157 2HE2 GLN 833 1HE2 GLN 833 4.456 -15.057 -0.563 158 1HE2 GLN 833 2HE2 GLN 833 4.617 -15.594 1.039 159 HA GLU 834 HA GLU 834 4.494 -11.009 -5.283 160 1HB GLU 834 1HB GLU 834 3.362 -10.834 -3.114 161 2HB GLU 834 2HB GLU 834 4.010 -9.213 -2.876 162 1HG GLU 834 1HG GLU 834 2.461 -8.256 -4.241 163 2HG GLU 834 2HG GLU 834 2.533 -9.578 -5.405 164 HA ASN 835 HA ASN 835 6.600 -7.390 -6.970 165 1HB ASN 835 1HB ASN 835 5.066 -8.296 -9.409 166 2HB ASN 835 2HB ASN 835 6.616 -7.479 -9.326 167 2HD2 ASN 835 1HD2 ASN 835 8.379 -8.897 -8.084 168 1HD2 ASN 835 2HD2 ASN 835 8.424 -10.531 -8.539 169 HA VAL 836 HA VAL 836 2.780 -5.213 -7.325 170 HB VAL 836 HB VAL 836 2.314 -4.526 -5.224 171 1HG1 VAL 836 3HG1 VAL 836 3.749 -6.468 -4.791 172 2HG1 VAL 836 1HG1 VAL 836 5.156 -5.410 -4.716 173 3HG1 VAL 836 2HG1 VAL 836 3.887 -5.274 -3.500 174 1HG2 VAL 836 1HG2 VAL 836 4.862 -2.914 -5.419 175 2HG2 VAL 836 2HG2 VAL 836 3.204 -2.321 -5.469 176 3HG2 VAL 836 3HG2 VAL 836 3.873 -2.954 -3.965 177 HA GLU 837 HA GLU 837 4.377 -1.552 -9.236 178 1HB GLU 837 1HB GLU 837 2.720 -3.145 -10.807 179 2HB GLU 837 2HB GLU 837 1.963 -1.562 -10.886 180 1HG GLU 837 1HG GLU 837 4.432 -0.730 -11.282 181 2HG GLU 837 2HG GLU 837 3.507 -1.406 -12.623 182 HA ILE 838 HA ILE 838 0.979 1.097 -7.905 183 HB ILE 838 HB ILE 838 3.450 2.814 -8.319 184 1HG1 ILE 838 1HG1 ILE 838 3.986 0.585 -7.316 185 2HG1 ILE 838 2HG1 ILE 838 4.301 1.917 -6.220 186 1HG2 ILE 838 1HG2 ILE 838 0.977 3.189 -6.825 187 2HG2 ILE 838 2HG2 ILE 838 2.414 3.373 -5.822 188 3HG2 ILE 838 3HG2 ILE 838 2.219 4.361 -7.266 189 1HD1 ILE 838 1HD1 ILE 838 1.580 1.039 -5.891 190 2HD1 ILE 838 2HD1 ILE 838 2.680 -0.331 -5.735 191 3HD1 ILE 838 3HD1 ILE 838 2.884 1.083 -4.707 192 HA LEU 839 HA LEU 839 -0.109 4.263 -10.937 193 1HB LEU 839 1HB LEU 839 -1.695 1.719 -11.039 194 2HB LEU 839 2HB LEU 839 -2.333 3.105 -11.913 195 HG LEU 839 HG LEU 839 -1.028 1.994 -13.523 196 1HD1 LEU 839 1HD1 LEU 839 -0.397 4.476 -13.072 197 2HD1 LEU 839 2HD1 LEU 839 1.105 3.813 -12.430 198 3HD1 LEU 839 3HD1 LEU 839 0.657 3.515 -14.108 199 1HD2 LEU 839 1HD2 LEU 839 0.289 0.918 -11.276 200 2HD2 LEU 839 2HD2 LEU 839 0.537 0.484 -12.965 201 3HD2 LEU 839 3HD2 LEU 839 1.539 1.727 -12.221 202 HA PRO 840 HA PRO 840 -3.204 6.688 -8.915 203 1HB PRO 840 1HB PRO 840 -3.721 8.190 -10.518 204 2HB PRO 840 2HB PRO 840 -4.929 7.079 -11.173 205 1HG PRO 840 1HG PRO 840 -3.590 6.701 -12.971 206 2HG PRO 840 2HG PRO 840 -2.381 7.802 -12.304 207 1HD PRO 840 1HD PRO 840 -1.028 6.032 -11.809 208 2HD PRO 840 2HD PRO 840 -2.249 4.923 -12.480 209 HA SER 841 HA SER 841 -6.153 3.554 -7.731 210 1HB SER 841 1HB SER 841 -8.092 4.938 -6.574 211 2HB SER 841 2HB SER 841 -6.522 4.786 -5.803 212 HG SER 841 HG SER 841 -7.540 6.935 -7.343 213 1HA GLY 842 1HA GLY 842 -9.725 2.372 -10.082 214 2HA GLY 842 2HA GLY 842 -9.864 4.127 -10.182 215 HA GLU 843 HA GLU 843 -7.432 3.017 -13.887 216 1HB GLU 843 1HB GLU 843 -5.585 1.609 -12.061 217 2HB GLU 843 2HB GLU 843 -5.331 1.246 -13.768 218 1HG GLU 843 1HG GLU 843 -5.751 4.107 -13.065 219 2HG GLU 843 2HG GLU 843 -4.219 3.386 -12.568 220 HA ARG 844 HA ARG 844 -9.298 -1.158 -14.646 221 1HB ARG 844 1HB ARG 844 -11.377 0.624 -13.968 222 2HB ARG 844 2HB ARG 844 -11.785 -0.070 -15.537 223 1HG ARG 844 1HG ARG 844 -12.050 -2.176 -14.688 224 2HG ARG 844 2HG ARG 844 -10.744 -1.979 -13.518 225 1HD ARG 844 1HD ARG 844 -12.285 -0.410 -12.226 226 2HD ARG 844 2HD ARG 844 -13.593 -0.963 -13.292 227 HE ARG 844 HE ARG 844 -12.002 -3.119 -12.081 228 1HH1 ARG 844 1HH1 ARG 844 -14.431 -4.203 -12.629 229 2HH1 ARG 844 2HH1 ARG 844 -15.472 -3.877 -11.282 230 1HH2 ARG 844 1HH2 ARG 844 -13.480 -1.334 -10.020 231 2HH2 ARG 844 2HH2 ARG 844 -14.932 -2.253 -9.805 232 HA PRO 845 HA PRO 845 -10.256 0.501 -19.091 233 1HB PRO 845 1HB PRO 845 -9.461 3.269 -19.117 234 2HB PRO 845 2HB PRO 845 -11.077 2.600 -19.360 235 1HG PRO 845 1HG PRO 845 -10.146 4.079 -17.110 236 2HG PRO 845 2HG PRO 845 -11.722 3.307 -17.308 237 1HD PRO 845 1HD PRO 845 -11.138 1.798 -15.683 238 2HD PRO 845 2HD PRO 845 -9.488 2.463 -15.619 239 HA GLN 846 HA GLN 846 -5.987 0.227 -20.197 240 1HB GLN 846 1HB GLN 846 -5.692 1.750 -18.282 241 2HB GLN 846 2HB GLN 846 -5.549 0.364 -17.200 242 1HG GLN 846 1HG GLN 846 -3.439 -0.198 -17.970 243 2HG GLN 846 2HG GLN 846 -3.718 0.507 -19.562 244 2HE2 GLN 846 1HE2 GLN 846 -2.115 1.042 -16.634 245 1HE2 GLN 846 2HE2 GLN 846 -1.875 2.716 -16.777 246 HA ALA 847 HA ALA 847 -5.683 -4.191 -18.900 247 1HB ALA 847 1HB ALA 847 -4.626 -3.050 -16.299 248 2HB ALA 847 3HB ALA 847 -3.727 -3.334 -17.789 249 3HB ALA 847 2HB ALA 847 -4.288 -4.700 -16.825 250 HA ASN 848 HA ASN 848 -9.436 -4.546 -15.915 251 1HB ASN 848 1HB ASN 848 -10.335 -4.014 -18.437 252 2HB ASN 848 2HB ASN 848 -10.655 -5.746 -18.338 253 2HD2 ASN 848 1HD2 ASN 848 -12.626 -3.464 -18.281 254 1HD2 ASN 848 2HD2 ASN 848 -13.486 -3.654 -16.829 255 HA GLN 849 HA GLN 849 -8.600 -8.934 -16.020 256 1HB GLN 849 1HB GLN 849 -6.206 -9.366 -15.223 257 2HB GLN 849 2HB GLN 849 -6.373 -8.300 -16.614 258 1HG GLN 849 1HG GLN 849 -6.547 -6.627 -14.347 259 2HG GLN 849 2HG GLN 849 -5.214 -6.739 -15.490 260 2HE2 GLN 849 1HE2 GLN 849 -3.597 -6.452 -13.840 261 1HE2 GLN 849 2HE2 GLN 849 -3.289 -7.617 -12.650 262 HA LYS 850 HA LYS 850 -7.737 -9.547 -11.244 263 1HB LYS 850 1HB LYS 850 -9.950 -10.513 -12.923 264 2HB LYS 850 2HB LYS 850 -9.697 -11.514 -11.494 265 1HG LYS 850 1HG LYS 850 -9.509 -8.690 -10.830 266 2HG LYS 850 2HG LYS 850 -11.054 -9.058 -11.595 267 1HD LYS 850 1HD LYS 850 -10.288 -11.099 -9.650 268 2HD LYS 850 2HD LYS 850 -10.404 -9.499 -8.918 269 1HE LYS 850 1HE LYS 850 -12.648 -9.510 -10.494 270 2HE LYS 850 2HE LYS 850 -12.548 -11.215 -10.008 271 1HZ LYS 850 1HZ LYS 850 -12.282 -8.912 -8.147 272 2HZ LYS 850 2HZ LYS 850 -13.705 -9.818 -8.351 273 3HZ LYS 850 3HZ LYS 850 -12.313 -10.558 -7.726 274 HA ARG 851 HA ARG 851 -6.696 -14.043 -11.179 275 1HB ARG 851 1HB ARG 851 -4.847 -11.882 -10.887 276 2HB ARG 851 2HB ARG 851 -4.333 -13.190 -9.824 277 1HG ARG 851 1HG ARG 851 -5.076 -13.608 -12.728 278 2HG ARG 851 2HG ARG 851 -3.422 -13.342 -12.178 279 1HD ARG 851 1HD ARG 851 -3.238 -15.458 -11.342 280 2HD ARG 851 2HD ARG 851 -4.884 -15.433 -10.677 281 HE ARG 851 HE ARG 851 -4.940 -15.456 -13.569 282 1HH1 ARG 851 1HH1 ARG 851 -6.965 -17.028 -12.384 283 2HH1 ARG 851 2HH1 ARG 851 -6.371 -18.654 -12.422 284 1HH2 ARG 851 1HH2 ARG 851 -3.070 -17.718 -12.924 285 2HH2 ARG 851 2HH2 ARG 851 -4.166 -19.045 -12.729 286 HA ILE 852 HA ILE 852 -6.978 -14.399 -6.565 287 HB ILE 852 HB ILE 852 -5.471 -16.060 -6.040 288 1HG1 ILE 852 1HG1 ILE 852 -3.769 -14.605 -5.055 289 2HG1 ILE 852 2HG1 ILE 852 -3.002 -15.791 -6.106 290 1HG2 ILE 852 1HG2 ILE 852 -4.391 -15.131 -8.713 291 2HG2 ILE 852 2HG2 ILE 852 -4.151 -16.729 -8.012 292 3HG2 ILE 852 3HG2 ILE 852 -5.770 -16.203 -8.467 293 1HD1 ILE 852 3HD1 ILE 852 -3.774 -13.229 -7.390 294 2HD1 ILE 852 1HD1 ILE 852 -2.454 -13.144 -6.238 295 3HD1 ILE 852 2HD1 ILE 852 -2.348 -14.218 -7.632 296 HA THR 853 HA THR 853 -3.630 -11.430 -4.271 297 HB THR 853 HB THR 853 -4.131 -8.989 -4.738 298 HG1 THR 853 HG1 THR 853 -5.560 -10.234 -6.840 299 1HG2 THR 853 1HG2 THR 853 -3.039 -10.818 -6.879 300 2HG2 THR 853 2HG2 THR 853 -2.920 -9.065 -6.974 301 3HG2 THR 853 3HG2 THR 853 -2.137 -9.932 -5.657 302 HA THR 854 HA THR 854 -7.058 -11.994 -1.555 303 HB THR 854 HB THR 854 -4.659 -10.702 -0.268 304 HG1 THR 854 HG1 THR 854 -6.075 -13.087 0.295 305 1HG2 THR 854 1HG2 THR 854 -7.401 -10.519 0.687 306 2HG2 THR 854 2HG2 THR 854 -6.389 -11.422 1.812 307 3HG2 THR 854 3HG2 THR 854 -5.937 -9.786 1.340 308 HA PRO 855 HA PRO 855 -8.988 -8.084 -2.722 309 1HB PRO 855 1HB PRO 855 -11.138 -8.846 -2.763 310 2HB PRO 855 2HB PRO 855 -11.199 -8.769 -0.999 311 1HG PRO 855 1HG PRO 855 -11.146 -11.110 -2.634 312 2HG PRO 855 2HG PRO 855 -11.085 -11.034 -0.871 313 1HD PRO 855 1HD PRO 855 -8.929 -11.792 -0.974 314 2HD PRO 855 2HD PRO 855 -8.925 -11.658 -2.751 315 HA TYR 856 HA TYR 856 -7.853 -5.599 0.764 316 1HB TYR 856 1HB TYR 856 -8.537 -7.670 1.925 317 2HB TYR 856 2HB TYR 856 -6.922 -8.316 1.729 318 HD1 TYR 856 HD1 TYR 856 -4.976 -6.744 2.714 319 HD2 TYR 856 HD2 TYR 856 -9.100 -6.612 3.903 320 HE1 TYR 856 HE1 TYR 856 -4.324 -5.711 4.861 321 HE2 TYR 856 HE2 TYR 856 -8.447 -5.593 6.057 322 HH TYR 856 HH TYR 856 -6.637 -4.362 7.034 323 HA MET 857 HA MET 857 -3.761 -5.276 -1.186 324 1HB MET 857 1HB MET 857 -4.799 -2.998 -1.274 325 2HB MET 857 2HB MET 857 -4.275 -2.740 0.380 326 1HG MET 857 1HG MET 857 -1.983 -3.645 -0.964 327 2HG MET 857 2HG MET 857 -2.314 -1.997 -0.439 328 1HE MET 857 1HE MET 857 -4.301 -0.751 -1.724 329 2HE MET 857 2HE MET 857 -2.714 -0.033 -2.004 330 3HE MET 857 3HE MET 857 -3.846 -0.224 -3.337 331 HA THR 858 HA THR 858 -1.495 -5.591 2.682 332 HB THR 858 HB THR 858 0.293 -7.251 2.166 333 HG1 THR 858 HG1 THR 858 1.109 -6.987 0.248 334 1HG2 THR 858 1HG2 THR 858 -2.303 -7.607 2.245 335 2HG2 THR 858 2HG2 THR 858 -2.129 -7.888 0.512 336 3HG2 THR 858 3HG2 THR 858 -1.269 -8.912 1.663 337 HA LYS 859 HA LYS 859 0.958 -2.083 3.493 338 1HB LYS 859 1HB LYS 859 1.314 -3.528 5.435 339 2HB LYS 859 2HB LYS 859 2.833 -2.772 4.954 340 1HG LYS 859 1HG LYS 859 1.974 -5.545 4.075 341 2HG LYS 859 2HG LYS 859 3.552 -4.794 3.833 342 1HD LYS 859 1HD LYS 859 3.217 -4.575 6.562 343 2HD LYS 859 2HD LYS 859 4.144 -5.840 5.756 344 1HE LYS 859 1HE LYS 859 1.183 -6.230 6.000 345 2HE LYS 859 2HE LYS 859 2.180 -6.468 7.449 346 1HZ LYS 859 1HZ LYS 859 2.856 -7.624 4.795 347 2HZ LYS 859 2HZ LYS 859 3.534 -8.016 6.303 348 3HZ LYS 859 3HZ LYS 859 1.934 -8.465 5.944 349 HA TYR 860 HA TYR 860 4.902 -3.295 1.049 350 1HB TYR 860 1HB TYR 860 4.892 -5.704 0.938 351 2HB TYR 860 2HB TYR 860 3.599 -5.701 -0.252 352 HD1 TYR 860 HD1 TYR 860 6.048 -3.010 -0.444 353 HD2 TYR 860 HD2 TYR 860 5.175 -6.994 -1.813 354 HE1 TYR 860 HE1 TYR 860 7.692 -2.730 -2.260 355 HE2 TYR 860 HE2 TYR 860 6.835 -6.702 -3.634 356 HH TYR 860 HH TYR 860 8.560 -5.421 -4.379 357 HA GLU 861 HA GLU 861 2.288 -2.679 -3.066 358 1HB GLU 861 1HB GLU 861 -0.088 -3.069 -1.242 359 2HB GLU 861 2HB GLU 861 -0.249 -2.108 -2.711 360 1HG GLU 861 1HG GLU 861 1.028 -4.269 -3.720 361 2HG GLU 861 2HG GLU 861 -0.730 -4.141 -3.646 362 HA ARG 862 HA ARG 862 1.226 1.318 -0.606 363 1HB ARG 862 1HB ARG 862 0.327 -0.268 1.435 364 2HB ARG 862 2HB ARG 862 1.732 0.496 2.182 365 1HG ARG 862 1HG ARG 862 0.139 2.393 0.626 366 2HG ARG 862 2HG ARG 862 -0.794 1.645 1.920 367 1HD ARG 862 1HD ARG 862 0.349 3.697 2.727 368 2HD ARG 862 2HD ARG 862 1.007 2.264 3.538 369 HE ARG 862 HE ARG 862 2.349 3.138 1.046 370 1HH1 ARG 862 1HH1 ARG 862 3.792 1.245 2.684 371 2HH1 ARG 862 2HH1 ARG 862 4.813 2.233 3.673 372 1HH2 ARG 862 1HH2 ARG 862 3.010 5.138 3.095 373 2HH2 ARG 862 2HH2 ARG 862 4.371 4.438 3.906 374 HA ALA 863 HA ALA 863 5.569 1.127 1.384 375 1HB ALA 863 2HB ALA 863 6.556 -1.584 0.804 376 2HB ALA 863 3HB ALA 863 6.664 -0.650 2.296 377 3HB ALA 863 1HB ALA 863 5.192 -1.547 1.921 378 HA ARG 864 HA ARG 864 7.197 0.185 -2.930 379 1HB ARG 864 1HB ARG 864 4.990 -1.595 -3.276 380 2HB ARG 864 2HB ARG 864 4.958 -0.483 -4.644 381 1HG ARG 864 1HG ARG 864 7.651 -1.468 -3.944 382 2HG ARG 864 2HG ARG 864 6.545 -2.720 -4.507 383 1HD ARG 864 1HD ARG 864 5.989 -1.160 -6.466 384 2HD ARG 864 2HD ARG 864 7.401 -0.207 -5.967 385 HE ARG 864 HE ARG 864 7.478 -2.891 -7.146 386 1HH1 ARG 864 1HH1 ARG 864 9.011 -2.949 -4.529 387 2HH1 ARG 864 2HH1 ARG 864 10.605 -2.525 -5.056 388 1HH2 ARG 864 1HH2 ARG 864 9.553 -1.298 -8.123 389 2HH2 ARG 864 2HH2 ARG 864 10.912 -1.591 -7.090 390 HA VAL 865 HA VAL 865 3.403 3.167 -4.275 391 HB VAL 865 HB VAL 865 2.575 1.910 -1.731 392 1HG1 VAL 865 1HG1 VAL 865 2.158 4.809 -2.202 393 2HG1 VAL 865 2HG1 VAL 865 0.870 3.863 -1.457 394 3HG1 VAL 865 3HG1 VAL 865 2.456 3.942 -0.696 395 1HG2 VAL 865 1HG2 VAL 865 1.338 2.799 -4.259 396 2HG2 VAL 865 2HG2 VAL 865 1.377 1.199 -3.520 397 3HG2 VAL 865 3HG2 VAL 865 0.323 2.445 -2.860 398 HA LEU 866 HA LEU 866 4.940 5.782 -0.315 399 1HB LEU 866 1HB LEU 866 5.152 4.335 1.497 400 2HB LEU 866 2HB LEU 866 5.865 3.059 0.515 401 HG LEU 866 HG LEU 866 7.549 5.478 0.801 402 1HD1 LEU 866 1HD1 LEU 866 6.284 4.911 3.083 403 2HD1 LEU 866 2HD1 LEU 866 7.527 3.662 3.171 404 3HD1 LEU 866 3HD1 LEU 866 7.990 5.361 3.061 405 1HD2 LEU 866 1HD2 LEU 866 8.020 3.070 -0.178 406 2HD2 LEU 866 2HD2 LEU 866 9.276 3.912 0.728 407 3HD2 LEU 866 3HD2 LEU 866 8.310 2.661 1.512 408 1HA GLY 867 1HA GLY 867 9.159 4.958 -2.385 409 2HA GLY 867 2HA GLY 867 8.744 3.519 -3.323 410 HA THR 868 HA THR 868 7.016 5.997 -6.544 411 HB THR 868 HB THR 868 4.865 5.382 -7.387 412 HG1 THR 868 HG1 THR 868 3.434 5.545 -5.807 413 1HG2 THR 868 1HG2 THR 868 6.796 3.713 -6.965 414 2HG2 THR 868 2HG2 THR 868 5.699 3.031 -5.769 415 3HG2 THR 868 3HG2 THR 868 5.215 3.107 -7.463 416 HA ARG 869 HA ARG 869 4.060 8.828 -4.157 417 1HB ARG 869 1HB ARG 869 4.775 7.229 -1.669 418 2HB ARG 869 2HB ARG 869 4.057 8.835 -1.541 419 1HG ARG 869 1HG ARG 869 2.787 6.718 -3.268 420 2HG ARG 869 2HG ARG 869 2.466 6.779 -1.534 421 1HD ARG 869 1HD ARG 869 1.528 8.980 -1.687 422 2HD ARG 869 2HD ARG 869 2.124 9.190 -3.345 423 HE ARG 869 HE ARG 869 -0.258 7.701 -2.582 424 1HH1 ARG 869 1HH1 ARG 869 0.868 5.459 -3.847 425 2HH1 ARG 869 2HH1 ARG 869 0.698 5.743 -5.546 426 1HH2 ARG 869 1HH2 ARG 869 0.164 9.151 -5.193 427 2HH2 ARG 869 2HH2 ARG 869 0.303 7.834 -6.309 428 HA ALA 870 HA ALA 870 8.211 10.032 -1.869 429 1HB ALA 870 3HB ALA 870 8.929 8.030 -0.849 430 2HB ALA 870 2HB ALA 870 10.221 8.385 -1.995 431 3HB ALA 870 1HB ALA 870 9.000 7.176 -2.391 432 HA LEU 871 HA LEU 871 10.275 10.108 -5.988 433 1HB LEU 871 1HB LEU 871 9.420 8.552 -8.166 434 2HB LEU 871 2HB LEU 871 10.907 8.345 -7.256 435 HG LEU 871 HG LEU 871 8.445 7.115 -6.131 436 1HD1 LEU 871 1HD1 LEU 871 8.411 6.658 -8.611 437 2HD1 LEU 871 2HD1 LEU 871 9.971 5.861 -8.415 438 3HD1 LEU 871 3HD1 LEU 871 8.545 5.219 -7.601 439 1HD2 LEU 871 1HD2 LEU 871 11.358 6.310 -6.422 440 2HD2 LEU 871 2HD2 LEU 871 10.589 6.928 -4.961 441 3HD2 LEU 871 3HD2 LEU 871 10.137 5.345 -5.592 442 HA GLN 872 HA GLN 872 6.109 10.855 -8.488 443 1HB GLN 872 1HB GLN 872 5.064 10.059 -5.823 444 2HB GLN 872 2HB GLN 872 4.226 11.402 -6.592 445 1HG GLN 872 1HG GLN 872 3.583 10.102 -8.456 446 2HG GLN 872 2HG GLN 872 4.808 8.878 -8.127 447 2HE2 GLN 872 1HE2 GLN 872 3.097 7.203 -8.088 448 1HE2 GLN 872 2HE2 GLN 872 2.073 7.057 -6.742 449 HA ILE 873 HA ILE 873 6.231 14.801 -5.631 450 HB ILE 873 HB ILE 873 7.541 14.592 -3.316 451 1HG1 ILE 873 1HG1 ILE 873 6.266 12.112 -2.755 452 2HG1 ILE 873 2HG1 ILE 873 7.276 11.874 -4.168 453 1HG2 ILE 873 1HG2 ILE 873 4.714 14.114 -4.084 454 2HG2 ILE 873 2HG2 ILE 873 5.175 13.918 -2.400 455 3HG2 ILE 873 3HG2 ILE 873 5.432 15.460 -3.204 456 1HD1 ILE 873 1HD1 ILE 873 8.458 13.414 -1.935 457 2HD1 ILE 873 2HD1 ILE 873 8.244 11.684 -1.694 458 3HD1 ILE 873 3HD1 ILE 873 9.207 12.275 -3.044 459 HA ALA 874 HA ALA 874 11.009 14.152 -5.022 460 1HB ALA 874 2HB ALA 874 10.871 11.656 -6.718 461 2HB ALA 874 1HB ALA 874 11.000 11.652 -4.960 462 3HB ALA 874 3HB ALA 874 12.308 12.311 -5.936 463 HA MET 875 HA MET 875 10.634 15.326 -9.445 464 1HB MET 875 1HB MET 875 8.079 13.731 -9.657 465 2HB MET 875 2HB MET 875 8.432 14.946 -10.885 466 1HG MET 875 1HG MET 875 10.834 13.494 -10.498 467 2HG MET 875 2HG MET 875 9.544 12.297 -10.593 468 1HE MET 875 2HE MET 875 7.503 12.983 -11.998 469 2HE MET 875 3HE MET 875 7.633 13.285 -13.736 470 3HE MET 875 1HE MET 875 8.198 11.759 -13.057 471 HA CYS 876 HA CYS 876 7.384 18.201 -7.664 472 1HB CYS 876 1HB CYS 876 5.763 16.897 -9.833 473 2HB CYS 876 2HB CYS 876 5.012 18.196 -8.906 474 HG CYS 876 HG CYS 876 6.246 19.439 -10.776 475 HA ALA 877 HA ALA 877 4.403 15.109 -5.462 476 1HB ALA 877 3HB ALA 877 4.285 17.266 -4.601 477 2HB ALA 877 1HB ALA 877 3.321 17.855 -5.955 478 3HB ALA 877 2HB ALA 877 2.584 16.822 -4.731 479 HA PRO 878 HA PRO 878 0.894 13.980 -8.529 480 1HB PRO 878 1HB PRO 878 2.083 11.377 -8.716 481 2HB PRO 878 2HB PRO 878 1.881 12.562 -10.010 482 1HG PRO 878 1HG PRO 878 4.305 11.764 -8.721 483 2HG PRO 878 2HG PRO 878 4.105 12.934 -10.016 484 1HD PRO 878 1HD PRO 878 4.751 13.445 -7.264 485 2HD PRO 878 2HD PRO 878 4.538 14.619 -8.578 486 HA VAL 879 HA VAL 879 1.449 10.821 -4.638 487 HB VAL 879 HB VAL 879 2.353 13.523 -3.608 488 1HG1 VAL 879 1HG1 VAL 879 0.885 12.309 -1.898 489 2HG1 VAL 879 2HG1 VAL 879 2.147 11.080 -1.844 490 3HG1 VAL 879 3HG1 VAL 879 2.500 12.740 -1.374 491 1HG2 VAL 879 1HG2 VAL 879 3.885 11.850 -4.854 492 2HG2 VAL 879 2HG2 VAL 879 4.464 12.528 -3.350 493 3HG2 VAL 879 3HG2 VAL 879 3.811 10.901 -3.374 494 HA MET 880 HA MET 880 -2.632 12.202 -3.674 495 1HB MET 880 1HB MET 880 -3.612 10.703 -1.960 496 2HB MET 880 2HB MET 880 -1.989 10.290 -1.407 497 1HG MET 880 1HG MET 880 -1.474 9.472 -3.721 498 2HG MET 880 2HG MET 880 -2.765 8.558 -2.944 499 1HE MET 880 1HE MET 880 -1.382 10.385 -5.499 500 2HE MET 880 2HE MET 880 -2.553 10.421 -6.815 501 3HE MET 880 3HE MET 880 -2.431 11.787 -5.696 502 HA VAL 881 HA VAL 881 -2.071 15.361 -0.602 503 HB VAL 881 HB VAL 881 -0.219 15.291 1.173 504 1HG1 VAL 881 1HG1 VAL 881 -2.499 13.849 0.956 505 2HG1 VAL 881 2HG1 VAL 881 -1.329 12.531 1.013 506 3HG1 VAL 881 3HG1 VAL 881 -1.405 13.700 2.331 507 1HG2 VAL 881 1HG2 VAL 881 1.302 14.054 -0.596 508 2HG2 VAL 881 2HG2 VAL 881 1.435 13.654 1.116 509 3HG2 VAL 881 3HG2 VAL 881 0.509 12.611 0.036 510 HA GLU 882 HA GLU 882 1.071 17.946 -2.456 511 1HB GLU 882 1HB GLU 882 -1.463 18.891 -2.027 512 2HB GLU 882 2HB GLU 882 -0.488 20.178 -1.319 513 1HG GLU 882 1HG GLU 882 0.412 19.120 -3.951 514 2HG GLU 882 2HG GLU 882 -1.064 20.086 -3.949 515 HA LEU 883 HA LEU 883 3.129 19.061 1.622 516 1HB LEU 883 1HB LEU 883 4.181 16.860 1.299 517 2HB LEU 883 2HB LEU 883 5.090 17.479 -0.077 518 HG LEU 883 HG LEU 883 5.873 19.301 1.693 519 1HD1 LEU 883 1HD1 LEU 883 4.426 17.374 3.286 520 2HD1 LEU 883 2HD1 LEU 883 6.125 17.384 3.760 521 3HD1 LEU 883 3HD1 LEU 883 5.191 18.879 3.796 522 1HD2 LEU 883 1HD2 LEU 883 6.851 16.570 1.039 523 2HD2 LEU 883 2HD2 LEU 883 7.647 18.129 0.830 524 3HD2 LEU 883 3HD2 LEU 883 7.613 17.360 2.417 525 HA GLU 884 HA GLU 884 5.189 22.004 -1.335 526 1HB GLU 884 1HB GLU 884 7.065 20.830 0.458 527 2HB GLU 884 2HB GLU 884 7.979 21.518 -0.882 528 1HG GLU 884 1HG GLU 884 7.363 23.670 -0.381 529 2HG GLU 884 2HG GLU 884 5.769 23.188 0.200 530 1HA GLY 885 1HA GLY 885 6.146 19.016 -5.197 531 2HA GLY 885 2HA GLY 885 7.295 20.341 -5.004 532 HA GLU 886 HA GLU 886 9.217 16.359 -2.473 533 1HB GLU 886 1HB GLU 886 9.969 16.437 -4.732 534 2HB GLU 886 2HB GLU 886 10.642 18.052 -4.536 535 1HG GLU 886 1HG GLU 886 12.407 17.212 -3.119 536 2HG GLU 886 2HG GLU 886 11.661 15.615 -3.055 537 HA THR 887 HA THR 887 12.342 18.321 0.061 538 HB THR 887 HB THR 887 9.628 18.322 1.443 539 HG1 THR 887 HG1 THR 887 9.339 20.119 0.397 540 1HG2 THR 887 1HG2 THR 887 12.309 19.287 2.320 541 2HG2 THR 887 2HG2 THR 887 10.932 20.342 2.640 542 3HG2 THR 887 3HG2 THR 887 10.953 18.701 3.285 543 HA ASP 888 HA ASP 888 11.886 14.954 3.231 544 1HB ASP 888 1HB ASP 888 9.317 15.540 3.386 545 2HB ASP 888 2HB ASP 888 9.158 13.920 2.716 546 HA PRO 889 HA PRO 889 12.939 11.574 0.546 547 1HB PRO 889 1HB PRO 889 13.332 9.778 2.756 548 2HB PRO 889 2HB PRO 889 14.560 10.663 1.846 549 1HG PRO 889 1HG PRO 889 13.771 11.117 4.536 550 2HG PRO 889 2HG PRO 889 14.871 12.102 3.567 551 1HD PRO 889 1HD PRO 889 13.319 13.771 3.632 552 2HD PRO 889 2HD PRO 889 12.117 12.686 4.373 553 HA LEU 890 HA LEU 890 8.729 9.756 1.098 554 1HB LEU 890 1HB LEU 890 10.389 8.168 2.118 555 2HB LEU 890 2HB LEU 890 8.725 7.773 2.508 556 HG LEU 890 HG LEU 890 10.363 7.614 4.439 557 1HD1 LEU 890 1HD1 LEU 890 11.591 9.740 3.791 558 2HD1 LEU 890 2HD1 LEU 890 10.218 10.630 4.447 559 3HD1 LEU 890 3HD1 LEU 890 11.176 9.588 5.497 560 1HD2 LEU 890 1HD2 LEU 890 7.740 8.285 4.420 561 2HD2 LEU 890 2HD2 LEU 890 8.673 8.061 5.898 562 3HD2 LEU 890 3HD2 LEU 890 8.409 9.683 5.261 563 HA LEU 891 HA LEU 891 6.766 11.756 5.266 564 1HB LEU 891 1HB LEU 891 7.675 13.905 5.339 565 2HB LEU 891 2HB LEU 891 7.741 14.015 3.592 566 HG LEU 891 HG LEU 891 6.105 15.572 4.603 567 1HD1 LEU 891 1HD1 LEU 891 5.798 14.155 2.296 568 2HD1 LEU 891 2HD1 LEU 891 4.271 13.820 3.113 569 3HD1 LEU 891 3HD1 LEU 891 4.756 15.483 2.791 570 1HD2 LEU 891 1HD2 LEU 891 5.017 13.011 5.672 571 2HD2 LEU 891 2HD2 LEU 891 5.130 14.590 6.448 572 3HD2 LEU 891 3HD2 LEU 891 3.874 14.286 5.250 573 HA ILE 892 HA ILE 892 4.050 12.679 1.293 574 HB ILE 892 HB ILE 892 6.291 11.227 -0.128 575 1HG1 ILE 892 1HG1 ILE 892 6.791 13.418 -1.166 576 2HG1 ILE 892 2HG1 ILE 892 7.040 13.458 0.568 577 1HG2 ILE 892 1HG2 ILE 892 3.746 11.285 -0.861 578 2HG2 ILE 892 2HG2 ILE 892 4.284 12.798 -1.581 579 3HG2 ILE 892 3HG2 ILE 892 5.080 11.281 -2.004 580 1HD1 ILE 892 1HD1 ILE 892 4.321 14.115 -0.016 581 2HD1 ILE 892 2HD1 ILE 892 5.558 15.105 0.755 582 3HD1 ILE 892 3HD1 ILE 892 5.391 15.119 -0.995 583 HA ALA 893 HA ALA 893 3.987 7.960 0.682 584 1HB ALA 893 3HB ALA 893 6.089 7.239 0.035 585 2HB ALA 893 1HB ALA 893 6.855 7.849 1.499 586 3HB ALA 893 2HB ALA 893 5.895 6.374 1.556 587 HA MET 894 HA MET 894 4.204 7.465 5.438 588 1HB MET 894 1HB MET 894 6.293 8.708 5.828 589 2HB MET 894 2HB MET 894 5.450 10.237 5.592 590 1HG MET 894 1HG MET 894 4.157 9.929 7.589 591 2HG MET 894 2HG MET 894 4.697 8.259 7.757 592 1HE MET 894 2HE MET 894 5.769 11.619 6.971 593 2HE MET 894 1HE MET 894 6.648 12.197 8.384 594 3HE MET 894 3HE MET 894 7.526 11.442 7.058 595 HA LYS 895 HA LYS 895 1.335 11.375 5.871 596 1HB LYS 895 1HB LYS 895 2.433 13.110 4.681 597 2HB LYS 895 2HB LYS 895 2.446 12.184 3.182 598 1HG LYS 895 1HG LYS 895 0.383 12.887 2.597 599 2HG LYS 895 2HG LYS 895 -0.254 12.667 4.226 600 1HD LYS 895 1HD LYS 895 1.665 14.910 3.837 601 2HD LYS 895 2HD LYS 895 0.064 15.104 3.120 602 1HE LYS 895 1HE LYS 895 -0.495 14.083 5.651 603 2HE LYS 895 2HE LYS 895 -0.585 15.796 5.194 604 1HZ LYS 895 1HZ LYS 895 1.812 15.956 5.676 605 2HZ LYS 895 2HZ LYS 895 0.920 15.521 7.055 606 3HZ LYS 895 3HZ LYS 895 1.808 14.345 6.216 607 HA GLU 896 HA GLU 896 -1.046 9.441 2.068 608 1HB GLU 896 1HB GLU 896 1.129 8.952 0.721 609 2HB GLU 896 2HB GLU 896 1.111 7.391 1.543 610 1HG GLU 896 1HG GLU 896 -1.495 7.609 0.700 611 2HG GLU 896 2HG GLU 896 -0.625 8.396 -0.616 612 HA LEU 897 HA LEU 897 -1.052 5.477 4.559 613 1HB LEU 897 1HB LEU 897 1.289 4.688 4.422 614 2HB LEU 897 2HB LEU 897 1.727 5.772 5.741 615 HG LEU 897 HG LEU 897 1.023 3.150 6.092 616 1HD1 LEU 897 1HD1 LEU 897 1.886 5.125 7.656 617 2HD1 LEU 897 2HD1 LEU 897 0.217 5.082 8.224 618 3HD1 LEU 897 3HD1 LEU 897 1.224 3.639 8.337 619 1HD2 LEU 897 1HD2 LEU 897 -1.393 4.027 5.382 620 2HD2 LEU 897 2HD2 LEU 897 -1.213 2.873 6.697 621 3HD2 LEU 897 3HD2 LEU 897 -1.439 4.578 7.054 622 HA LYS 898 HA LYS 898 -0.326 7.997 8.774 623 1HB LYS 898 1HB LYS 898 1.502 9.430 7.919 624 2HB LYS 898 2HB LYS 898 0.344 10.248 6.873 625 1HG LYS 898 1HG LYS 898 -0.694 11.349 8.631 626 2HG LYS 898 2HG LYS 898 -0.198 10.142 9.818 627 1HD LYS 898 1HD LYS 898 2.067 11.495 8.525 628 2HD LYS 898 2HD LYS 898 1.025 12.592 9.432 629 1HE LYS 898 1HE LYS 898 1.165 10.807 11.330 630 2HE LYS 898 2HE LYS 898 2.599 11.815 11.045 631 1HZ LYS 898 3HZ LYS 898 2.080 9.156 9.805 632 2HZ LYS 898 1HZ LYS 898 3.470 10.107 9.586 633 3HZ LYS 898 2HZ LYS 898 3.134 9.426 11.106 634 HA ALA 899 HA ALA 899 -3.966 10.218 6.776 635 1HB ALA 899 2HB ALA 899 -4.385 10.481 4.281 636 2HB ALA 899 1HB ALA 899 -2.856 9.647 4.003 637 3HB ALA 899 3HB ALA 899 -2.873 11.201 4.833 638 HA ARG 900 HA ARG 900 -3.648 5.168 5.097 639 1HB ARG 900 1HB ARG 900 -4.723 4.535 7.021 640 2HB ARG 900 2HB ARG 900 -4.547 6.216 7.509 641 1HG ARG 900 1HG ARG 900 -6.786 6.580 6.213 642 2HG ARG 900 2HG ARG 900 -6.957 4.833 6.349 643 1HD ARG 900 1HD ARG 900 -6.429 5.220 8.886 644 2HD ARG 900 2HD ARG 900 -8.046 5.652 8.294 645 HE ARG 900 HE ARG 900 -5.803 7.599 8.713 646 1HH1 ARG 900 1HH1 ARG 900 -8.605 7.528 6.985 647 2HH1 ARG 900 2HH1 ARG 900 -9.408 8.802 7.840 648 1HH2 ARG 900 1HH2 ARG 900 -7.053 8.938 10.381 649 2HH2 ARG 900 2HH2 ARG 900 -8.531 9.599 9.764 650 HA LYS 901 HA LYS 901 -7.035 6.594 2.572 651 1HB LYS 901 1HB LYS 901 -6.807 8.673 1.106 652 2HB LYS 901 2HB LYS 901 -6.830 8.974 2.841 653 1HG LYS 901 1HG LYS 901 -4.376 9.100 2.865 654 2HG LYS 901 2HG LYS 901 -4.325 8.765 1.140 655 1HD LYS 901 1HD LYS 901 -6.143 10.906 1.462 656 2HD LYS 901 2HD LYS 901 -4.760 11.285 2.487 657 1HE LYS 901 1HE LYS 901 -3.459 11.743 0.688 658 2HE LYS 901 2HE LYS 901 -3.921 10.225 -0.106 659 1HZ LYS 901 1HZ LYS 901 -5.623 12.659 0.054 660 2HZ LYS 901 2HZ LYS 901 -4.751 12.173 -1.321 661 3HZ LYS 901 3HZ LYS 901 -6.024 11.211 -0.734 662 HA ILE 902 HA ILE 902 -2.600 6.175 -0.419 663 HB ILE 902 HB ILE 902 -4.070 3.748 0.652 664 1HG1 ILE 902 1HG1 ILE 902 -1.622 3.547 1.692 665 2HG1 ILE 902 2HG1 ILE 902 -1.667 5.301 1.520 666 1HG2 ILE 902 1HG2 ILE 902 -2.462 3.984 -1.634 667 2HG2 ILE 902 2HG2 ILE 902 -1.388 3.330 -0.398 668 3HG2 ILE 902 3HG2 ILE 902 -2.885 2.489 -0.799 669 1HD1 ILE 902 1HD1 ILE 902 -4.114 4.101 2.662 670 2HD1 ILE 902 2HD1 ILE 902 -2.675 3.960 3.670 671 3HD1 ILE 902 3HD1 ILE 902 -3.235 5.549 3.150 672 HA PRO 903 HA PRO 903 -6.742 5.970 -2.846 673 1HB PRO 903 1HB PRO 903 -6.044 8.423 -4.166 674 2HB PRO 903 2HB PRO 903 -7.409 8.112 -3.093 675 1HG PRO 903 1HG PRO 903 -5.084 9.680 -2.545 676 2HG PRO 903 2HG PRO 903 -6.423 9.322 -1.453 677 1HD PRO 903 1HD PRO 903 -5.059 7.986 -0.234 678 2HD PRO 903 2HD PRO 903 -3.718 8.284 -1.356 679 HA ILE 904 HA ILE 904 -4.562 4.927 -6.460 680 HB ILE 904 HB ILE 904 -2.518 5.503 -4.584 681 1HG1 ILE 904 1HG1 ILE 904 -3.166 5.838 -7.416 682 2HG1 ILE 904 2HG1 ILE 904 -1.434 5.729 -7.130 683 1HG2 ILE 904 1HG2 ILE 904 -1.853 3.272 -6.518 684 2HG2 ILE 904 2HG2 ILE 904 -0.653 4.242 -5.664 685 3HG2 ILE 904 3HG2 ILE 904 -1.757 3.209 -4.757 686 1HD1 ILE 904 1HD1 ILE 904 -2.202 7.401 -5.102 687 2HD1 ILE 904 2HD1 ILE 904 -1.614 7.956 -6.670 688 3HD1 ILE 904 3HD1 ILE 904 -3.347 7.850 -6.366 689 HA ILE 905 HA ILE 905 -4.903 0.571 -6.743 690 HB ILE 905 HB ILE 905 -5.802 1.642 -8.832 691 1HG1 ILE 905 1HG1 ILE 905 -4.769 -1.025 -8.499 692 2HG1 ILE 905 2HG1 ILE 905 -4.618 -0.552 -10.193 693 1HG2 ILE 905 1HG2 ILE 905 -3.138 2.278 -9.290 694 2HG2 ILE 905 2HG2 ILE 905 -3.448 0.986 -10.444 695 3HG2 ILE 905 3HG2 ILE 905 -4.446 2.439 -10.458 696 1HD1 ILE 905 1HD1 ILE 905 -7.052 0.305 -9.934 697 2HD1 ILE 905 2HD1 ILE 905 -6.798 -1.434 -10.059 698 3HD1 ILE 905 3HD1 ILE 905 -7.096 -0.693 -8.483 699 HA ILE 906 HA ILE 906 -0.615 -0.660 -7.505 700 HB ILE 906 HB ILE 906 -1.514 -2.511 -5.298 701 1HG1 ILE 906 1HG1 ILE 906 -2.606 -0.435 -4.715 702 2HG1 ILE 906 2HG1 ILE 906 -1.175 -0.594 -3.704 703 1HG2 ILE 906 1HG2 ILE 906 0.883 -2.274 -6.273 704 2HG2 ILE 906 2HG2 ILE 906 0.922 -0.770 -5.362 705 3HG2 ILE 906 3HG2 ILE 906 0.680 -2.295 -4.525 706 1HD1 ILE 906 1HD1 ILE 906 -0.339 0.736 -6.043 707 2HD1 ILE 906 2HD1 ILE 906 -1.854 1.488 -5.554 708 3HD1 ILE 906 3HD1 ILE 906 -0.512 1.409 -4.425 709 HA ARG 907 HA ARG 907 -1.522 -4.512 -9.565 710 1HB ARG 907 1HB ARG 907 1.000 -3.332 -10.622 711 2HB ARG 907 2HB ARG 907 0.510 -4.940 -11.135 712 1HG ARG 907 1HG ARG 907 -0.381 -3.199 -12.651 713 2HG ARG 907 2HG ARG 907 -1.664 -4.084 -11.830 714 1HD ARG 907 1HD ARG 907 -2.301 -2.255 -10.551 715 2HD ARG 907 2HD ARG 907 -0.663 -1.568 -10.535 716 HE ARG 907 HE ARG 907 -1.194 -0.450 -12.545 717 1HH1 ARG 907 1HH1 ARG 907 -1.642 -2.763 -14.279 718 2HH1 ARG 907 2HH1 ARG 907 -3.320 -2.639 -14.691 719 1HH2 ARG 907 1HH2 ARG 907 -4.066 -0.452 -12.107 720 2HH2 ARG 907 2HH2 ARG 907 -4.692 -1.332 -13.461 721 HA ARG 908 HA ARG 908 0.950 -6.842 -6.695 722 1HB ARG 908 1HB ARG 908 -1.964 -7.586 -6.796 723 2HB ARG 908 2HB ARG 908 -0.845 -8.730 -6.071 724 1HG ARG 908 1HG ARG 908 -0.059 -6.821 -4.577 725 2HG ARG 908 2HG ARG 908 -1.442 -5.903 -5.179 726 1HD ARG 908 1HD ARG 908 -2.407 -8.510 -4.437 727 2HD ARG 908 2HD ARG 908 -2.782 -6.966 -3.640 728 HE ARG 908 HE ARG 908 -0.166 -7.710 -2.836 729 1HH1 ARG 908 1HH1 ARG 908 -3.446 -8.799 -2.541 730 2HH1 ARG 908 2HH1 ARG 908 -3.149 -9.672 -1.077 731 1HH2 ARG 908 1HH2 ARG 908 0.225 -8.900 -0.965 732 2HH2 ARG 908 2HH2 ARG 908 -1.081 -9.730 -0.188 733 HA TYR 909 HA TYR 909 1.168 -9.922 -10.063 734 1HB TYR 909 1HB TYR 909 4.066 -9.212 -10.111 735 2HB TYR 909 2HB TYR 909 3.058 -9.812 -11.407 736 HD1 TYR 909 HD1 TYR 909 1.691 -8.305 -12.747 737 HD2 TYR 909 HD2 TYR 909 4.139 -6.789 -9.577 738 HE1 TYR 909 HE1 TYR 909 1.519 -6.045 -13.688 739 HE2 TYR 909 HE2 TYR 909 3.965 -4.534 -10.503 740 HH TYR 909 HH TYR 909 1.705 -3.714 -12.928 741 HA LEU 910 HA LEU 910 3.777 -12.342 -7.317 742 1HB LEU 910 1HB LEU 910 1.830 -14.074 -8.834 743 2HB LEU 910 2HB LEU 910 2.514 -14.478 -7.256 744 HG LEU 910 HG LEU 910 0.757 -12.099 -7.932 745 1HD1 LEU 910 1HD1 LEU 910 0.337 -14.751 -6.621 746 2HD1 LEU 910 2HD1 LEU 910 -0.597 -13.368 -6.054 747 3HD1 LEU 910 3HD1 LEU 910 -0.701 -13.872 -7.738 748 1HD2 LEU 910 1HD2 LEU 910 2.681 -12.370 -5.866 749 2HD2 LEU 910 2HD2 LEU 910 1.451 -11.120 -6.033 750 3HD2 LEU 910 3HD2 LEU 910 1.101 -12.582 -5.115 751 HA PRO 911 HA PRO 911 7.054 -13.917 -9.981 752 1HB PRO 911 1HB PRO 911 8.502 -14.468 -7.557 753 2HB PRO 911 2HB PRO 911 8.784 -13.153 -8.702 754 1HG PRO 911 1HG PRO 911 7.993 -11.671 -7.182 755 2HG PRO 911 2HG PRO 911 7.673 -12.988 -6.053 756 1HD PRO 911 1HD PRO 911 5.435 -12.734 -6.409 757 2HD PRO 911 2HD PRO 911 5.760 -11.447 -7.590 758 HA ASP 912 HA ASP 912 6.196 -17.913 -7.380 759 1HB ASP 912 1HB ASP 912 3.858 -16.349 -6.413 760 2HB ASP 912 2HB ASP 912 3.601 -18.087 -6.564 761 1HA GLY 913 1HA GLY 913 3.707 -17.315 -11.650 762 2HA GLY 913 2HA GLY 913 3.174 -18.734 -10.750 763 HA SER 914 HA SER 914 -0.305 -15.581 -11.528 764 1HB SER 914 1HB SER 914 0.241 -15.592 -8.555 765 2HB SER 914 2HB SER 914 -1.299 -15.048 -9.214 766 HG SER 914 HG SER 914 -0.776 -17.450 -8.635 767 HA TYR 915 HA TYR 915 0.029 -11.225 -9.709 768 1HB TYR 915 1HB TYR 915 1.329 -11.100 -11.611 769 2HB TYR 915 2HB TYR 915 0.170 -11.994 -12.586 770 HD1 TYR 915 HD1 TYR 915 -0.193 -8.782 -10.634 771 HD2 TYR 915 HD2 TYR 915 -0.321 -10.712 -14.474 772 HE1 TYR 915 HE1 TYR 915 -0.950 -6.668 -11.677 773 HE2 TYR 915 HE2 TYR 915 -1.079 -8.596 -15.510 774 HH TYR 915 HH TYR 915 -0.776 -5.988 -14.795 775 HA GLU 916 HA GLU 916 -4.008 -9.429 -10.948 776 1HB GLU 916 1HB GLU 916 -3.826 -10.665 -8.492 777 2HB GLU 916 2HB GLU 916 -4.380 -9.044 -8.076 778 1HG GLU 916 1HG GLU 916 -5.731 -10.222 -10.410 779 2HG GLU 916 2HG GLU 916 -6.019 -11.075 -8.893 780 HA ASP 917 HA ASP 917 -3.154 -5.155 -9.960 781 1HB ASP 917 1HB ASP 917 -3.290 -5.292 -12.394 782 2HB ASP 917 2HB ASP 917 -4.019 -3.823 -11.808 783 HA TRP 918 HA TRP 918 -6.359 -2.270 -8.572 784 1HB TRP 918 1HB TRP 918 -7.830 -3.558 -7.045 785 2HB TRP 918 2HB TRP 918 -7.802 -4.183 -8.671 786 HD1 TRP 918 HD1 TRP 918 -4.709 -5.542 -7.465 787 HE1 TRP 918 HE1 TRP 918 -5.070 -7.940 -6.568 788 HE3 TRP 918 HE3 TRP 918 -9.664 -5.337 -6.738 789 HZ2 TRP 918 HZ2 TRP 918 -7.291 -9.512 -5.531 790 HZ3 TRP 918 HZ3 TRP 918 -10.901 -7.171 -5.714 791 HH2 TRP 918 HH2 TRP 918 -9.741 -9.302 -5.118 792 1HA GLY 919 1HA GLY 919 -4.753 -2.605 -4.291 793 2HA GLY 919 2HA GLY 919 -4.454 -1.005 -4.943 794 HA VAL 920 HA VAL 920 -7.559 0.070 -2.044 795 HB VAL 920 HB VAL 920 -6.355 2.598 -3.225 796 1HG1 VAL 920 1HG1 VAL 920 -7.911 2.093 -0.673 797 2HG1 VAL 920 2HG1 VAL 920 -6.901 3.518 -0.913 798 3HG1 VAL 920 3HG1 VAL 920 -8.296 3.242 -1.955 799 1HG2 VAL 920 1HG2 VAL 920 -5.497 0.531 -1.263 800 2HG2 VAL 920 2HG2 VAL 920 -4.524 1.500 -2.370 801 3HG2 VAL 920 3HG2 VAL 920 -5.112 2.204 -0.865 802 HA ASP 921 HA ASP 921 -10.395 2.064 -5.145 803 1HB ASP 921 1HB ASP 921 -8.740 2.350 -7.003 804 2HB ASP 921 2HB ASP 921 -9.070 0.690 -7.501 805 HA GLU 922 HA GLU 922 -12.165 -2.109 -5.403 806 1HB GLU 922 1HB GLU 922 -10.317 -2.456 -7.224 807 2HB GLU 922 2HB GLU 922 -9.709 -3.677 -6.109 808 1HG GLU 922 1HG GLU 922 -11.559 -5.052 -6.384 809 2HG GLU 922 2HG GLU 922 -12.636 -3.698 -6.729 810 HA LEU 923 HA LEU 923 -10.483 -3.769 -1.495 811 1HB LEU 923 1HB LEU 923 -8.199 -4.982 -1.371 812 2HB LEU 923 2HB LEU 923 -9.287 -5.379 -2.684 813 HG LEU 923 HG LEU 923 -7.743 -3.182 -3.577 814 1HD1 LEU 923 1HD1 LEU 923 -6.075 -5.397 -2.364 815 2HD1 LEU 923 2HD1 LEU 923 -5.474 -4.169 -3.478 816 3HD1 LEU 923 3HD1 LEU 923 -6.060 -3.704 -1.884 817 1HD2 LEU 923 1HD2 LEU 923 -8.364 -5.944 -4.196 818 2HD2 LEU 923 2HD2 LEU 923 -8.184 -4.544 -5.256 819 3HD2 LEU 923 3HD2 LEU 923 -6.761 -5.454 -4.746 820 HA ILE 924 HA ILE 924 -8.157 -1.716 1.601 821 HB ILE 924 HB ILE 924 -7.015 -4.392 1.603 822 1HG1 ILE 924 1HG1 ILE 924 -7.537 -4.019 4.064 823 2HG1 ILE 924 2HG1 ILE 924 -8.145 -2.439 3.570 824 1HG2 ILE 924 1HG2 ILE 924 -4.874 -3.110 1.780 825 2HG2 ILE 924 2HG2 ILE 924 -5.520 -2.332 3.221 826 3HG2 ILE 924 3HG2 ILE 924 -5.249 -4.070 3.198 827 1HD1 ILE 924 3HD1 ILE 924 -9.019 -5.024 2.278 828 2HD1 ILE 924 1HD1 ILE 924 -9.897 -4.259 3.604 829 3HD1 ILE 924 2HD1 ILE 924 -9.724 -3.422 2.060 830 HA ILE 925 HA ILE 925 -4.458 0.358 0.330 831 HB ILE 925 HB ILE 925 -4.147 2.154 2.051 832 1HG1 ILE 925 1HG1 ILE 925 -6.446 1.127 3.629 833 2HG1 ILE 925 2HG1 ILE 925 -4.925 0.264 3.850 834 1HG2 ILE 925 1HG2 ILE 925 -6.659 1.426 0.724 835 2HG2 ILE 925 2HG2 ILE 925 -6.898 2.482 2.115 836 3HG2 ILE 925 3HG2 ILE 925 -5.841 2.986 0.798 837 1HD1 ILE 925 1HD1 ILE 925 -5.265 3.267 4.098 838 2HD1 ILE 925 2HD1 ILE 925 -5.163 2.146 5.456 839 3HD1 ILE 925 3HD1 ILE 925 -3.778 2.363 4.386 840 HA THR 926 HA THR 926 -0.865 -0.833 2.826 841 HB THR 926 HB THR 926 -1.575 0.436 5.453 842 HG1 THR 926 HG1 THR 926 -0.680 2.400 4.481 843 1HG2 THR 926 1HG2 THR 926 0.908 -0.112 3.850 844 2HG2 THR 926 2HG2 THR 926 0.923 1.110 5.122 845 3HG2 THR 926 3HG2 THR 926 0.538 -0.565 5.513 846 HA ASP 927 HA ASP 927 -3.860 -3.738 5.068 847 1HB ASP 927 1HB ASP 927 -1.898 -2.550 6.635 848 2HB ASP 927 2HB ASP 927 -3.252 -2.692 7.756 No H/Q in entry = 848 Start of MODEL 16 1 HA MET 801 HA MET 801 22.865 9.324 34.901 2 1HB MET 801 1HB MET 801 24.206 7.563 36.056 3 2HB MET 801 2HB MET 801 24.550 6.832 34.488 4 1HG MET 801 1HG MET 801 25.505 9.080 33.778 5 2HG MET 801 2HG MET 801 25.385 9.570 35.467 6 1HE MET 801 1HE MET 801 26.685 9.397 36.977 7 2HE MET 801 2HE MET 801 26.954 7.752 37.547 8 3HE MET 801 3HE MET 801 28.319 8.739 37.007 9 HA SER 802 HA SER 802 23.720 8.580 30.426 10 1HB SER 802 1HB SER 802 25.040 6.808 29.335 11 2HB SER 802 2HB SER 802 25.697 7.161 30.930 12 HG SER 802 HG SER 802 25.512 4.963 30.781 13 HA ASP 803 HA ASP 803 20.132 5.879 29.402 14 1HB ASP 803 1HB ASP 803 19.226 7.543 31.683 15 2HB ASP 803 2HB ASP 803 17.963 7.039 30.560 16 HA ASN 804 HA ASN 804 19.494 9.398 26.489 17 1HB ASN 804 1HB ASN 804 19.905 6.770 25.163 18 2HB ASN 804 2HB ASN 804 19.018 7.978 24.232 19 2HD2 ASN 804 1HD2 ASN 804 22.167 7.008 25.254 20 1HD2 ASN 804 2HD2 ASN 804 23.009 8.373 24.697 21 HA GLU 805 HA GLU 805 15.117 8.223 25.584 22 1HB GLU 805 1HB GLU 805 16.108 5.761 24.247 23 2HB GLU 805 2HB GLU 805 14.383 5.798 24.614 24 1HG GLU 805 1HG GLU 805 14.254 8.042 23.500 25 2HG GLU 805 2HG GLU 805 15.938 7.850 23.015 26 HA ASP 806 HA ASP 806 13.819 6.171 29.282 27 1HB ASP 806 1HB ASP 806 12.142 7.989 28.802 28 2HB ASP 806 2HB ASP 806 11.155 6.788 27.969 29 HA ASN 807 HA ASN 807 12.431 2.210 27.652 30 1HB ASN 807 1HB ASN 807 14.382 0.690 27.486 31 2HB ASN 807 2HB ASN 807 15.341 1.818 28.444 32 2HD2 ASN 807 1HD2 ASN 807 14.833 0.901 25.297 33 1HD2 ASN 807 2HD2 ASN 807 15.200 2.359 24.509 34 HA PHE 808 HA PHE 808 13.148 0.246 31.936 35 1HB PHE 808 1HB PHE 808 10.923 0.160 30.726 36 2HB PHE 808 2HB PHE 808 11.329 -1.485 30.235 37 HD1 PHE 808 HD1 PHE 808 11.744 -3.240 31.999 38 HD2 PHE 808 HD2 PHE 808 10.148 0.637 32.930 39 HE1 PHE 808 HE1 PHE 808 10.953 -4.093 34.190 40 HE2 PHE 808 HE2 PHE 808 9.357 -0.215 35.120 41 HZ PHE 808 HZ PHE 808 9.758 -2.579 35.750 42 HA ASP 809 HA ASP 809 15.375 -3.669 30.847 43 1HB ASP 809 1HB ASP 809 14.067 -5.785 30.883 44 2HB ASP 809 2HB ASP 809 13.293 -4.523 31.843 45 1HA GLY 810 1HA GLY 810 16.306 -3.258 26.296 46 2HA GLY 810 2HA GLY 810 15.260 -4.678 26.350 47 HA ASP 811 HA ASP 811 12.986 -2.004 23.548 48 1HB ASP 811 1HB ASP 811 14.334 -3.398 22.011 49 2HB ASP 811 2HB ASP 811 12.674 -3.255 21.438 50 HA ASP 812 HA ASP 812 9.218 -4.301 24.846 51 1HB ASP 812 1HB ASP 812 10.504 -3.427 27.395 52 2HB ASP 812 2HB ASP 812 8.765 -3.726 27.430 53 HA PHE 813 HA PHE 813 7.512 0.015 25.134 54 1HB PHE 813 1HB PHE 813 9.822 0.440 23.510 55 2HB PHE 813 2HB PHE 813 8.449 1.150 22.663 56 HD1 PHE 813 HD1 PHE 813 10.058 0.993 26.039 57 HD2 PHE 813 HD2 PHE 813 7.611 3.243 23.319 58 HE1 PHE 813 HE1 PHE 813 10.082 2.915 27.608 59 HE2 PHE 813 HE2 PHE 813 7.635 5.165 24.887 60 HZ PHE 813 HZ PHE 813 8.870 5.001 27.031 61 HA ASP 814 HA ASP 814 4.991 -1.344 21.566 62 1HB ASP 814 1HB ASP 814 6.160 -4.074 22.147 63 2HB ASP 814 2HB ASP 814 4.889 -3.842 20.946 64 HA ASP 815 HA ASP 815 2.636 -1.787 25.991 65 1HB ASP 815 1HB ASP 815 1.703 -0.831 23.691 66 2HB ASP 815 2HB ASP 815 1.009 -2.448 23.562 67 HA VAL 816 HA VAL 816 1.892 -6.119 26.426 68 HB VAL 816 HB VAL 816 3.224 -6.183 24.359 69 1HG1 VAL 816 1HG1 VAL 816 5.202 -5.010 25.782 70 2HG1 VAL 816 2HG1 VAL 816 5.760 -6.683 25.827 71 3HG1 VAL 816 3HG1 VAL 816 5.495 -5.883 24.278 72 1HG2 VAL 816 1HG2 VAL 816 2.649 -8.306 25.626 73 2HG2 VAL 816 2HG2 VAL 816 4.038 -8.441 24.547 74 3HG2 VAL 816 3HG2 VAL 816 4.285 -8.268 26.285 75 HA GLU 817 HA GLU 817 4.304 -6.723 30.156 76 1HB GLU 817 1HB GLU 817 1.348 -6.810 30.499 77 2HB GLU 817 2HB GLU 817 2.308 -7.512 31.802 78 1HG GLU 817 1HG GLU 817 3.321 -5.492 32.335 79 2HG GLU 817 2HG GLU 817 3.108 -4.840 30.710 80 HA GLU 818 HA GLU 818 3.617 -11.310 29.835 81 1HB GLU 818 1HB GLU 818 2.433 -10.599 27.345 82 2HB GLU 818 2HB GLU 818 3.596 -11.881 27.010 83 1HG GLU 818 1HG GLU 818 2.585 -13.270 28.780 84 2HG GLU 818 2HG GLU 818 1.423 -11.988 29.123 85 HA ASP 819 HA ASP 819 7.841 -12.888 29.993 86 1HB ASP 819 1HB ASP 819 6.627 -13.774 27.872 87 2HB ASP 819 2HB ASP 819 7.404 -12.426 27.040 88 HA GLU 820 HA GLU 820 9.899 -9.154 28.181 89 1HB GLU 820 1HB GLU 820 11.325 -8.555 30.131 90 2HB GLU 820 2HB GLU 820 9.757 -9.182 30.637 91 1HG GLU 820 1HG GLU 820 10.924 -11.485 30.746 92 2HG GLU 820 2HG GLU 820 12.433 -10.574 30.689 93 1HA GLY 821 1HA GLY 821 13.984 -9.155 26.346 94 2HA GLY 821 2HA GLY 821 13.682 -10.884 26.531 95 HA LEU 822 HA LEU 822 10.860 -11.739 22.754 96 1HB LEU 822 1HB LEU 822 11.034 -9.026 23.272 97 2HB LEU 822 2HB LEU 822 11.995 -9.201 21.805 98 HG LEU 822 HG LEU 822 9.928 -10.725 21.075 99 1HD1 LEU 822 1HD1 LEU 822 8.994 -10.011 23.494 100 2HD1 LEU 822 2HD1 LEU 822 8.393 -8.643 22.555 101 3HD1 LEU 822 3HD1 LEU 822 7.925 -10.287 22.117 102 1HD2 LEU 822 1HD2 LEU 822 10.774 -8.679 19.932 103 2HD2 LEU 822 2HD2 LEU 822 9.013 -8.759 19.930 104 3HD2 LEU 822 3HD2 LEU 822 9.846 -7.691 21.059 105 HA ASP 823 HA ASP 823 15.277 -11.885 21.139 106 1HB ASP 823 1HB ASP 823 16.046 -12.850 23.914 107 2HB ASP 823 2HB ASP 823 17.174 -12.630 22.575 108 HA ASP 824 HA ASP 824 14.832 -16.517 21.508 109 1HB ASP 824 1HB ASP 824 14.626 -16.663 23.960 110 2HB ASP 824 2HB ASP 824 13.624 -17.890 23.187 111 HA LEU 825 HA LEU 825 10.802 -16.474 19.450 112 1HB LEU 825 1HB LEU 825 10.291 -14.096 21.121 113 2HB LEU 825 2HB LEU 825 9.280 -14.190 19.678 114 HG LEU 825 HG LEU 825 9.038 -16.729 20.455 115 1HD1 LEU 825 1HD1 LEU 825 10.632 -16.053 22.436 116 2HD1 LEU 825 2HD1 LEU 825 9.159 -15.386 23.140 117 3HD1 LEU 825 3HD1 LEU 825 9.250 -17.103 22.750 118 1HD2 LEU 825 1HD2 LEU 825 7.282 -14.871 20.206 119 2HD2 LEU 825 2HD2 LEU 825 6.918 -16.139 21.376 120 3HD2 LEU 825 3HD2 LEU 825 7.512 -14.573 21.929 121 HA GLU 826 HA GLU 826 10.897 -11.688 17.016 122 1HB GLU 826 1HB GLU 826 13.260 -12.595 17.750 123 2HB GLU 826 2HB GLU 826 13.131 -13.565 16.283 124 1HG GLU 826 1HG GLU 826 12.394 -11.192 15.265 125 2HG GLU 826 2HG GLU 826 13.410 -10.614 16.586 126 HA ASN 827 HA ASN 827 11.383 -14.340 12.668 127 1HB ASN 827 1HB ASN 827 11.183 -16.043 14.670 128 2HB ASN 827 2HB ASN 827 9.452 -15.773 14.474 129 2HD2 ASN 827 1HD2 ASN 827 8.738 -15.922 12.007 130 1HD2 ASN 827 2HD2 ASN 827 9.419 -17.206 11.131 131 HA ALA 828 HA ALA 828 7.362 -12.152 12.600 132 1HB ALA 828 2HB ALA 828 8.904 -9.641 12.044 133 2HB ALA 828 1HB ALA 828 8.978 -10.313 13.673 134 3HB ALA 828 3HB ALA 828 7.423 -9.857 12.977 135 HA GLU 829 HA GLU 829 7.549 -11.493 8.171 136 1HB GLU 829 1HB GLU 829 5.937 -9.267 9.208 137 2HB GLU 829 2HB GLU 829 6.435 -9.032 7.532 138 1HG GLU 829 1HG GLU 829 5.693 -11.629 7.418 139 2HG GLU 829 2HG GLU 829 4.576 -10.300 7.108 140 HA GLU 830 HA GLU 830 9.676 -6.541 7.731 141 1HB GLU 830 1HB GLU 830 10.770 -8.641 9.222 142 2HB GLU 830 2HB GLU 830 11.772 -8.576 7.773 143 1HG GLU 830 1HG GLU 830 11.559 -5.924 8.330 144 2HG GLU 830 2HG GLU 830 12.872 -6.941 8.925 145 HA GLU 831 HA GLU 831 9.605 -7.931 3.429 146 1HB GLU 831 1HB GLU 831 10.708 -10.104 2.877 147 2HB GLU 831 2HB GLU 831 11.429 -9.334 4.289 148 1HG GLU 831 1HG GLU 831 10.756 -10.993 5.686 149 2HG GLU 831 2HG GLU 831 9.169 -11.113 4.926 150 1HA GLY 832 1HA GLY 832 6.631 -11.515 2.313 151 2HA GLY 832 2HA GLY 832 6.235 -10.009 1.485 152 HA GLN 833 HA GLN 833 7.729 -11.514 -2.376 153 1HB GLN 833 1HB GLN 833 7.789 -13.605 -1.067 154 2HB GLN 833 2HB GLN 833 6.062 -13.838 -1.357 155 1HG GLN 833 1HG GLN 833 6.460 -13.935 -3.775 156 2HG GLN 833 2HG GLN 833 8.182 -13.659 -3.515 157 2HE2 GLN 833 1HE2 GLN 833 8.965 -15.352 -1.574 158 1HE2 GLN 833 2HE2 GLN 833 8.561 -16.964 -1.919 159 HA GLU 834 HA GLU 834 4.425 -10.971 -5.239 160 1HB GLU 834 1HB GLU 834 3.063 -10.904 -3.203 161 2HB GLU 834 2HB GLU 834 3.553 -9.239 -2.896 162 1HG GLU 834 1HG GLU 834 1.985 -8.425 -4.296 163 2HG GLU 834 2HG GLU 834 2.440 -9.553 -5.572 164 HA ASN 835 HA ASN 835 6.454 -7.234 -6.759 165 1HB ASN 835 1HB ASN 835 6.467 -7.226 -9.136 166 2HB ASN 835 2HB ASN 835 4.999 -8.188 -9.244 167 2HD2 ASN 835 1HD2 ASN 835 5.761 -10.101 -10.265 168 1HD2 ASN 835 2HD2 ASN 835 7.054 -11.038 -9.692 169 HA VAL 836 HA VAL 836 2.612 -5.116 -7.205 170 HB VAL 836 HB VAL 836 2.005 -4.535 -5.113 171 1HG1 VAL 836 1HG1 VAL 836 4.835 -5.395 -4.528 172 2HG1 VAL 836 2HG1 VAL 836 3.572 -5.218 -3.312 173 3HG1 VAL 836 3HG1 VAL 836 3.406 -6.426 -4.587 174 1HG2 VAL 836 1HG2 VAL 836 4.462 -2.791 -5.149 175 2HG2 VAL 836 2HG2 VAL 836 2.773 -2.296 -5.180 176 3HG2 VAL 836 3HG2 VAL 836 3.473 -2.962 -3.705 177 HA GLU 837 HA GLU 837 4.145 -1.268 -8.773 178 1HB GLU 837 1HB GLU 837 3.555 -2.792 -10.733 179 2HB GLU 837 2HB GLU 837 1.937 -2.096 -10.679 180 1HG GLU 837 1HG GLU 837 2.672 0.004 -11.359 181 2HG GLU 837 2HG GLU 837 4.314 -0.272 -10.777 182 HA ILE 838 HA ILE 838 0.347 0.950 -7.900 183 HB ILE 838 HB ILE 838 2.873 2.020 -7.314 184 1HG1 ILE 838 1HG1 ILE 838 0.114 2.252 -6.218 185 2HG1 ILE 838 2HG1 ILE 838 1.366 3.300 -5.553 186 1HG2 ILE 838 1HG2 ILE 838 2.397 3.859 -8.916 187 2HG2 ILE 838 2HG2 ILE 838 0.952 4.255 -7.987 188 3HG2 ILE 838 3HG2 ILE 838 2.546 4.433 -7.256 189 1HD1 ILE 838 1HD1 ILE 838 2.150 0.460 -5.893 190 2HD1 ILE 838 2HD1 ILE 838 2.462 1.559 -4.550 191 3HD1 ILE 838 3HD1 ILE 838 0.902 0.751 -4.684 192 HA LEU 839 HA LEU 839 -0.774 4.168 -10.870 193 1HB LEU 839 1HB LEU 839 -1.660 1.428 -11.132 194 2HB LEU 839 2HB LEU 839 -2.970 2.513 -11.596 195 HG LEU 839 HG LEU 839 -0.863 3.727 -12.825 196 1HD1 LEU 839 1HD1 LEU 839 0.184 1.258 -12.023 197 2HD1 LEU 839 2HD1 LEU 839 -0.217 1.031 -13.725 198 3HD1 LEU 839 3HD1 LEU 839 0.865 2.336 -13.241 199 1HD2 LEU 839 1HD2 LEU 839 -2.879 1.678 -13.676 200 2HD2 LEU 839 2HD2 LEU 839 -2.744 3.373 -14.141 201 3HD2 LEU 839 3HD2 LEU 839 -1.649 2.179 -14.837 202 HA PRO 840 HA PRO 840 -4.105 6.352 -8.993 203 1HB PRO 840 1HB PRO 840 -4.663 7.804 -10.635 204 2HB PRO 840 2HB PRO 840 -5.743 6.596 -11.340 205 1HG PRO 840 1HG PRO 840 -3.226 7.523 -12.367 206 2HG PRO 840 2HG PRO 840 -4.285 6.289 -13.055 207 1HD PRO 840 1HD PRO 840 -2.763 4.688 -12.481 208 2HD PRO 840 2HD PRO 840 -1.733 5.924 -11.717 209 HA SER 841 HA SER 841 -6.833 2.989 -8.009 210 1HB SER 841 1HB SER 841 -7.529 3.813 -6.024 211 2HB SER 841 2HB SER 841 -7.401 5.472 -6.597 212 HG SER 841 HG SER 841 -9.576 4.484 -6.015 213 1HA GLY 842 1HA GLY 842 -10.775 3.229 -10.170 214 2HA GLY 842 2HA GLY 842 -9.537 3.317 -11.417 215 HA GLU 843 HA GLU 843 -8.350 -1.340 -11.716 216 1HB GLU 843 1HB GLU 843 -10.083 -0.912 -9.659 217 2HB GLU 843 2HB GLU 843 -11.205 -1.485 -10.894 218 1HG GLU 843 1HG GLU 843 -8.660 -2.921 -10.075 219 2HG GLU 843 2HG GLU 843 -10.279 -3.347 -9.518 220 HA ARG 844 HA ARG 844 -10.241 -0.067 -15.696 221 1HB ARG 844 1HB ARG 844 -8.198 -2.278 -16.029 222 2HB ARG 844 2HB ARG 844 -9.044 -1.508 -17.372 223 1HG ARG 844 1HG ARG 844 -7.962 0.532 -17.062 224 2HG ARG 844 2HG ARG 844 -7.619 0.207 -15.362 225 1HD ARG 844 1HD ARG 844 -6.216 -1.818 -16.526 226 2HD ARG 844 2HD ARG 844 -5.509 -0.225 -16.192 227 HE ARG 844 HE ARG 844 -6.949 -0.584 -18.769 228 1HH1 ARG 844 1HH1 ARG 844 -4.033 -1.721 -17.826 229 2HH1 ARG 844 2HH1 ARG 844 -3.063 -0.696 -18.832 230 1HH2 ARG 844 1HH2 ARG 844 -5.697 1.376 -19.719 231 2HH2 ARG 844 2HH2 ARG 844 -4.005 1.055 -19.903 232 HA PRO 845 HA PRO 845 -13.371 -3.267 -14.983 233 1HB PRO 845 1HB PRO 845 -15.011 -1.909 -16.920 234 2HB PRO 845 2HB PRO 845 -15.184 -1.911 -15.163 235 1HG PRO 845 1HG PRO 845 -14.346 0.256 -16.820 236 2HG PRO 845 2HG PRO 845 -14.440 0.223 -15.057 237 1HD PRO 845 1HD PRO 845 -12.164 0.277 -14.961 238 2HD PRO 845 2HD PRO 845 -12.067 0.184 -16.736 239 HA GLN 846 HA GLN 846 -12.695 -5.756 -18.578 240 1HB GLN 846 1HB GLN 846 -12.417 -3.584 -19.697 241 2HB GLN 846 2HB GLN 846 -10.714 -3.556 -19.242 242 1HG GLN 846 1HG GLN 846 -10.237 -5.470 -20.635 243 2HG GLN 846 2HG GLN 846 -11.953 -5.726 -20.954 244 2HE2 GLN 846 1HE2 GLN 846 -11.482 -5.451 -23.304 245 1HE2 GLN 846 2HE2 GLN 846 -11.249 -3.897 -23.943 246 HA ALA 847 HA ALA 847 -8.290 -7.090 -17.811 247 1HB ALA 847 1HB ALA 847 -7.437 -4.464 -16.544 248 2HB ALA 847 3HB ALA 847 -7.208 -4.920 -18.232 249 3HB ALA 847 2HB ALA 847 -6.343 -5.784 -16.960 250 HA ASN 848 HA ASN 848 -9.172 -6.676 -12.999 251 1HB ASN 848 1HB ASN 848 -11.593 -5.935 -13.791 252 2HB ASN 848 2HB ASN 848 -11.943 -7.655 -13.613 253 2HD2 ASN 848 1HD2 ASN 848 -10.630 -8.451 -11.370 254 1HD2 ASN 848 2HD2 ASN 848 -11.075 -7.523 -10.020 255 HA GLN 849 HA GLN 849 -8.891 -11.118 -13.707 256 1HB GLN 849 1HB GLN 849 -6.628 -10.012 -14.433 257 2HB GLN 849 2HB GLN 849 -6.634 -11.722 -14.012 258 1HG GLN 849 1HG GLN 849 -6.210 -9.935 -11.707 259 2HG GLN 849 2HG GLN 849 -5.333 -11.390 -12.177 260 2HE2 GLN 849 1HE2 GLN 849 -5.422 -7.902 -12.457 261 1HE2 GLN 849 2HE2 GLN 849 -3.926 -7.726 -13.228 262 HA LYS 850 HA LYS 850 -7.413 -11.879 -9.199 263 1HB LYS 850 1HB LYS 850 -9.378 -13.501 -10.694 264 2HB LYS 850 2HB LYS 850 -8.815 -14.230 -9.191 265 1HG LYS 850 1HG LYS 850 -9.365 -11.400 -8.828 266 2HG LYS 850 2HG LYS 850 -10.784 -12.246 -9.446 267 1HD LYS 850 1HD LYS 850 -10.065 -14.035 -7.602 268 2HD LYS 850 2HD LYS 850 -9.334 -12.613 -6.859 269 1HE LYS 850 1HE LYS 850 -11.465 -11.450 -6.827 270 2HE LYS 850 2HE LYS 850 -12.233 -12.749 -7.760 271 1HZ LYS 850 1HZ LYS 850 -10.937 -13.072 -5.104 272 2HZ LYS 850 2HZ LYS 850 -12.613 -13.038 -5.380 273 3HZ LYS 850 3HZ LYS 850 -11.673 -14.306 -6.004 274 HA ARG 851 HA ARG 851 -5.297 -15.965 -8.915 275 1HB ARG 851 1HB ARG 851 -4.034 -13.568 -9.726 276 2HB ARG 851 2HB ARG 851 -2.970 -14.290 -8.521 277 1HG ARG 851 1HG ARG 851 -2.305 -15.864 -9.986 278 2HG ARG 851 2HG ARG 851 -3.972 -16.358 -10.265 279 1HD ARG 851 1HD ARG 851 -4.241 -14.867 -12.079 280 2HD ARG 851 2HD ARG 851 -2.848 -13.884 -11.589 281 HE ARG 851 HE ARG 851 -1.671 -16.305 -11.986 282 1HH1 ARG 851 1HH1 ARG 851 -4.151 -16.831 -13.738 283 2HH1 ARG 851 2HH1 ARG 851 -3.529 -16.415 -15.300 284 1HH2 ARG 851 1HH2 ARG 851 -0.759 -14.748 -14.048 285 2HH2 ARG 851 2HH2 ARG 851 -1.610 -15.236 -15.476 286 HA ILE 852 HA ILE 852 -4.465 -15.210 -4.452 287 HB ILE 852 HB ILE 852 -2.264 -15.660 -4.004 288 1HG1 ILE 852 1HG1 ILE 852 -1.644 -13.315 -3.574 289 2HG1 ILE 852 2HG1 ILE 852 -0.380 -14.138 -4.479 290 1HG2 ILE 852 1HG2 ILE 852 -2.609 -16.445 -6.315 291 2HG2 ILE 852 2HG2 ILE 852 -2.010 -14.903 -6.924 292 3HG2 ILE 852 3HG2 ILE 852 -0.932 -15.977 -6.036 293 1HD1 ILE 852 1HD1 ILE 852 -2.150 -13.072 -6.412 294 2HD1 ILE 852 2HD1 ILE 852 -1.894 -11.798 -5.220 295 3HD1 ILE 852 3HD1 ILE 852 -0.518 -12.522 -6.039 296 HA THR 853 HA THR 853 -3.296 -10.576 -3.359 297 HB THR 853 HB THR 853 -4.494 -8.757 -4.610 298 HG1 THR 853 HG1 THR 853 -5.000 -10.866 -6.438 299 1HG2 THR 853 1HG2 THR 853 -2.139 -9.663 -5.049 300 2HG2 THR 853 2HG2 THR 853 -2.843 -10.475 -6.442 301 3HG2 THR 853 3HG2 THR 853 -2.887 -8.715 -6.335 302 HA THR 854 HA THR 854 -6.942 -11.920 -1.144 303 HB THR 854 HB THR 854 -4.956 -10.340 0.499 304 HG1 THR 854 HG1 THR 854 -6.033 -12.944 0.792 305 1HG2 THR 854 1HG2 THR 854 -7.287 -9.730 1.202 306 2HG2 THR 854 2HG2 THR 854 -7.593 -11.437 1.512 307 3HG2 THR 854 3HG2 THR 854 -6.375 -10.573 2.450 308 HA PRO 855 HA PRO 855 -9.299 -8.314 -2.317 309 1HB PRO 855 1HB PRO 855 -11.369 -9.269 -2.155 310 2HB PRO 855 2HB PRO 855 -11.347 -9.009 -0.408 311 1HG PRO 855 1HG PRO 855 -11.135 -11.498 -1.812 312 2HG PRO 855 2HG PRO 855 -11.043 -11.235 -0.068 313 1HD PRO 855 1HD PRO 855 -8.812 -11.754 -0.143 314 2HD PRO 855 2HD PRO 855 -8.879 -11.888 -1.917 315 HA TYR 856 HA TYR 856 -8.141 -5.467 0.896 316 1HB TYR 856 1HB TYR 856 -8.756 -7.353 2.314 317 2HB TYR 856 2HB TYR 856 -7.186 -8.089 2.069 318 HD1 TYR 856 HD1 TYR 856 -5.111 -6.633 2.841 319 HD2 TYR 856 HD2 TYR 856 -9.140 -6.030 4.191 320 HE1 TYR 856 HE1 TYR 856 -4.264 -5.451 4.833 321 HE2 TYR 856 HE2 TYR 856 -8.291 -4.862 6.197 322 HH TYR 856 HH TYR 856 -5.159 -5.028 7.235 323 HA MET 857 HA MET 857 -4.031 -5.172 -1.010 324 1HB MET 857 1HB MET 857 -5.012 -2.916 -1.377 325 2HB MET 857 2HB MET 857 -4.685 -2.519 0.307 326 1HG MET 857 1HG MET 857 -2.234 -3.031 -0.166 327 2HG MET 857 2HG MET 857 -2.658 -3.091 -1.874 328 1HE MET 857 1HE MET 857 -3.986 -1.467 -2.976 329 2HE MET 857 2HE MET 857 -5.003 -0.562 -1.866 330 3HE MET 857 3HE MET 857 -3.801 0.284 -2.833 331 HA THR 858 HA THR 858 -1.975 -5.089 2.994 332 HB THR 858 HB THR 858 -0.210 -6.829 2.737 333 HG1 THR 858 HG1 THR 858 0.210 -7.559 0.661 334 1HG2 THR 858 1HG2 THR 858 -2.784 -7.204 1.184 335 2HG2 THR 858 2HG2 THR 858 -1.791 -8.509 1.834 336 3HG2 THR 858 3HG2 THR 858 -2.595 -7.383 2.927 337 HA LYS 859 HA LYS 859 0.658 -1.752 3.829 338 1HB LYS 859 1HB LYS 859 0.929 -3.183 5.804 339 2HB LYS 859 2HB LYS 859 2.476 -2.472 5.348 340 1HG LYS 859 1HG LYS 859 1.785 -5.111 4.141 341 2HG LYS 859 2HG LYS 859 3.351 -4.490 4.661 342 1HD LYS 859 1HD LYS 859 1.887 -4.628 7.027 343 2HD LYS 859 2HD LYS 859 3.110 -5.784 6.498 344 1HE LYS 859 1HE LYS 859 0.943 -6.662 5.078 345 2HE LYS 859 2HE LYS 859 1.356 -7.272 6.692 346 1HZ LYS 859 1HZ LYS 859 0.046 -5.430 7.636 347 2HZ LYS 859 2HZ LYS 859 -0.439 -4.985 6.069 348 3HZ LYS 859 3HZ LYS 859 -0.905 -6.488 6.712 349 HA TYR 860 HA TYR 860 4.533 -3.170 1.394 350 1HB TYR 860 1HB TYR 860 4.396 -5.577 1.252 351 2HB TYR 860 2HB TYR 860 3.111 -5.487 0.055 352 HD1 TYR 860 HD1 TYR 860 5.683 -2.919 -0.098 353 HD2 TYR 860 HD2 TYR 860 4.642 -6.848 -1.508 354 HE1 TYR 860 HE1 TYR 860 7.348 -2.695 -1.902 355 HE2 TYR 860 HE2 TYR 860 6.323 -6.612 -3.316 356 HH TYR 860 HH TYR 860 8.719 -4.293 -3.334 357 HA GLU 861 HA GLU 861 1.922 -2.351 -2.707 358 1HB GLU 861 1HB GLU 861 -0.441 -2.665 -0.850 359 2HB GLU 861 2HB GLU 861 -0.587 -1.652 -2.286 360 1HG GLU 861 1HG GLU 861 0.489 -3.764 -3.476 361 2HG GLU 861 2HG GLU 861 -1.246 -3.694 -3.161 362 HA ARG 862 HA ARG 862 1.082 1.614 0.003 363 1HB ARG 862 1HB ARG 862 -0.029 0.749 1.938 364 2HB ARG 862 2HB ARG 862 1.389 -0.174 2.420 365 1HG ARG 862 1HG ARG 862 1.766 2.764 2.145 366 2HG ARG 862 2HG ARG 862 0.800 2.225 3.514 367 1HD ARG 862 1HD ARG 862 2.777 0.489 3.837 368 2HD ARG 862 2HD ARG 862 3.695 1.710 2.934 369 HE ARG 862 HE ARG 862 2.608 3.349 4.678 370 1HH1 ARG 862 1HH1 ARG 862 2.160 0.236 5.710 371 2HH1 ARG 862 2HH1 ARG 862 3.071 0.379 7.177 372 1HH2 ARG 862 1HH2 ARG 862 4.389 3.482 6.368 373 2HH2 ARG 862 2HH2 ARG 862 4.332 2.216 7.549 374 HA ALA 863 HA ALA 863 5.557 1.201 1.676 375 1HB ALA 863 2HB ALA 863 6.412 -1.526 1.039 376 2HB ALA 863 3HB ALA 863 6.583 -0.628 2.545 377 3HB ALA 863 1HB ALA 863 5.081 -1.481 2.194 378 HA ARG 864 HA ARG 864 6.823 0.239 -2.728 379 1HB ARG 864 1HB ARG 864 4.455 -1.415 -2.953 380 2HB ARG 864 2HB ARG 864 4.588 -0.392 -4.386 381 1HG ARG 864 1HG ARG 864 7.150 -1.555 -3.516 382 2HG ARG 864 2HG ARG 864 5.960 -2.755 -4.017 383 1HD ARG 864 1HD ARG 864 5.638 -0.973 -6.025 384 2HD ARG 864 2HD ARG 864 6.865 -2.255 -6.094 385 HE ARG 864 HE ARG 864 7.451 0.494 -5.033 386 1HH1 ARG 864 1HH1 ARG 864 9.001 -2.368 -5.345 387 2HH1 ARG 864 2HH1 ARG 864 10.240 -1.829 -6.429 388 1HH2 ARG 864 1HH2 ARG 864 8.717 1.218 -7.076 389 2HH2 ARG 864 2HH2 ARG 864 10.080 0.201 -7.408 390 HA VAL 865 HA VAL 865 3.041 3.338 -3.882 391 HB VAL 865 HB VAL 865 2.341 2.151 -1.266 392 1HG1 VAL 865 1HG1 VAL 865 2.109 5.062 -1.678 393 2HG1 VAL 865 2HG1 VAL 865 0.742 4.224 -0.943 394 3HG1 VAL 865 3HG1 VAL 865 2.335 4.138 -0.195 395 1HG2 VAL 865 1HG2 VAL 865 0.977 3.056 -3.711 396 2HG2 VAL 865 2HG2 VAL 865 0.949 1.488 -2.913 397 3HG2 VAL 865 3HG2 VAL 865 0.036 2.833 -2.237 398 HA LEU 866 HA LEU 866 4.963 6.056 -0.211 399 1HB LEU 866 1HB LEU 866 5.149 4.869 1.757 400 2HB LEU 866 2HB LEU 866 5.515 3.370 0.915 401 HG LEU 866 HG LEU 866 7.664 5.422 0.847 402 1HD1 LEU 866 1HD1 LEU 866 6.546 5.399 3.217 403 2HD1 LEU 866 2HD1 LEU 866 7.329 3.826 3.374 404 3HD1 LEU 866 3HD1 LEU 866 8.300 5.270 3.094 405 1HD2 LEU 866 1HD2 LEU 866 7.386 2.438 1.176 406 2HD2 LEU 866 2HD2 LEU 866 8.248 3.332 -0.076 407 3HD2 LEU 866 3HD2 LEU 866 8.911 3.238 1.554 408 1HA GLY 867 1HA GLY 867 9.051 4.667 -2.236 409 2HA GLY 867 2HA GLY 867 8.479 3.215 -3.064 410 HA THR 868 HA THR 868 7.030 5.690 -6.409 411 HB THR 868 HB THR 868 4.955 5.125 -7.359 412 HG1 THR 868 HG1 THR 868 4.083 4.860 -4.675 413 1HG2 THR 868 1HG2 THR 868 6.530 3.267 -6.197 414 2HG2 THR 868 2HG2 THR 868 4.968 2.892 -5.472 415 3HG2 THR 868 3HG2 THR 868 5.145 2.898 -7.226 416 HA ARG 869 HA ARG 869 4.247 8.853 -4.262 417 1HB ARG 869 1HB ARG 869 4.147 7.029 -2.051 418 2HB ARG 869 2HB ARG 869 4.783 8.551 -1.427 419 1HG ARG 869 1HG ARG 869 2.651 9.289 -1.351 420 2HG ARG 869 2HG ARG 869 2.695 9.331 -3.113 421 1HD ARG 869 1HD ARG 869 0.766 7.998 -2.392 422 2HD ARG 869 2HD ARG 869 1.824 6.963 -1.415 423 HE ARG 869 HE ARG 869 2.814 6.126 -3.484 424 1HH1 ARG 869 1HH1 ARG 869 2.342 8.725 -5.038 425 2HH1 ARG 869 2HH1 ARG 869 1.157 8.206 -6.189 426 1HH2 ARG 869 1HH2 ARG 869 0.375 5.297 -4.472 427 2HH2 ARG 869 2HH2 ARG 869 0.044 6.264 -5.869 428 HA ALA 870 HA ALA 870 8.433 9.866 -1.947 429 1HB ALA 870 3HB ALA 870 9.028 7.817 -0.905 430 2HB ALA 870 2HB ALA 870 10.352 8.130 -2.028 431 3HB ALA 870 1HB ALA 870 9.094 6.966 -2.447 432 HA LEU 871 HA LEU 871 10.402 9.698 -6.115 433 1HB LEU 871 1HB LEU 871 9.302 8.118 -8.200 434 2HB LEU 871 2HB LEU 871 10.869 7.925 -7.431 435 HG LEU 871 HG LEU 871 8.493 6.778 -6.048 436 1HD1 LEU 871 1HD1 LEU 871 9.826 5.566 -8.477 437 2HD1 LEU 871 2HD1 LEU 871 8.688 4.730 -7.419 438 3HD1 LEU 871 3HD1 LEU 871 8.152 6.112 -8.376 439 1HD2 LEU 871 1HD2 LEU 871 11.392 5.990 -6.473 440 2HD2 LEU 871 2HD2 LEU 871 10.682 6.628 -4.990 441 3HD2 LEU 871 3HD2 LEU 871 10.235 5.020 -5.561 442 HA GLN 872 HA GLN 872 6.244 10.680 -8.524 443 1HB GLN 872 1HB GLN 872 5.125 9.705 -6.009 444 2HB GLN 872 2HB GLN 872 4.480 11.287 -6.419 445 1HG GLN 872 1HG GLN 872 3.086 9.475 -7.376 446 2HG GLN 872 2HG GLN 872 3.806 10.459 -8.644 447 2HE2 GLN 872 1HE2 GLN 872 5.620 9.511 -9.880 448 1HE2 GLN 872 2HE2 GLN 872 5.878 7.834 -9.880 449 HA ILE 873 HA ILE 873 6.516 14.601 -5.663 450 HB ILE 873 HB ILE 873 7.562 14.411 -3.271 451 1HG1 ILE 873 1HG1 ILE 873 6.425 11.858 -2.758 452 2HG1 ILE 873 2HG1 ILE 873 7.507 11.661 -4.129 453 1HG2 ILE 873 1HG2 ILE 873 4.860 13.760 -4.304 454 2HG2 ILE 873 2HG2 ILE 873 5.151 13.534 -2.581 455 3HG2 ILE 873 3HG2 ILE 873 5.390 15.117 -3.314 456 1HD1 ILE 873 1HD1 ILE 873 9.011 13.234 -2.502 457 2HD1 ILE 873 2HD1 ILE 873 8.132 12.258 -1.327 458 3HD1 ILE 873 3HD1 ILE 873 9.108 11.479 -2.564 459 HA ALA 874 HA ALA 874 11.206 13.802 -4.882 460 1HB ALA 874 1HB ALA 874 10.867 11.168 -6.302 461 2HB ALA 874 3HB ALA 874 11.436 11.435 -4.656 462 3HB ALA 874 2HB ALA 874 12.449 11.886 -6.024 463 HA MET 875 HA MET 875 11.040 14.788 -9.404 464 1HB MET 875 1HB MET 875 9.003 12.929 -9.710 465 2HB MET 875 2HB MET 875 8.197 14.434 -10.151 466 1HG MET 875 1HG MET 875 10.797 14.425 -11.359 467 2HG MET 875 2HG MET 875 10.013 12.888 -11.721 468 1HE MET 875 1HE MET 875 7.653 12.658 -12.347 469 2HE MET 875 2HE MET 875 6.801 14.001 -11.573 470 3HE MET 875 3HE MET 875 6.708 13.785 -13.319 471 HA CYS 876 HA CYS 876 8.166 18.070 -7.694 472 1HB CYS 876 1HB CYS 876 6.392 16.876 -9.791 473 2HB CYS 876 2HB CYS 876 5.729 18.216 -8.856 474 HG CYS 876 HG CYS 876 7.664 19.731 -9.694 475 HA ALA 877 HA ALA 877 4.992 15.291 -5.319 476 1HB ALA 877 3HB ALA 877 4.981 17.379 -4.411 477 2HB ALA 877 1HB ALA 877 4.237 18.107 -5.835 478 3HB ALA 877 2HB ALA 877 3.251 17.186 -4.700 479 HA PRO 878 HA PRO 878 1.328 14.423 -8.361 480 1HB PRO 878 1HB PRO 878 2.338 11.745 -8.578 481 2HB PRO 878 2HB PRO 878 2.181 12.944 -9.866 482 1HG PRO 878 1HG PRO 878 4.582 12.016 -8.560 483 2HG PRO 878 2HG PRO 878 4.436 13.094 -9.942 484 1HD PRO 878 1HD PRO 878 5.247 13.792 -7.315 485 2HD PRO 878 2HD PRO 878 4.881 14.898 -8.656 486 HA VAL 879 HA VAL 879 1.628 11.129 -4.584 487 HB VAL 879 HB VAL 879 3.189 13.502 -3.659 488 1HG1 VAL 879 1HG1 VAL 879 1.491 13.022 -1.824 489 2HG1 VAL 879 2HG1 VAL 879 2.299 11.472 -1.625 490 3HG1 VAL 879 3HG1 VAL 879 3.178 12.971 -1.363 491 1HG2 VAL 879 1HG2 VAL 879 3.853 11.017 -4.598 492 2HG2 VAL 879 2HG2 VAL 879 4.922 12.037 -3.659 493 3HG2 VAL 879 3HG2 VAL 879 3.986 10.788 -2.861 494 HA MET 880 HA MET 880 -2.141 13.011 -3.303 495 1HB MET 880 1HB MET 880 -1.438 10.714 -1.620 496 2HB MET 880 2HB MET 880 -2.677 11.740 -0.898 497 1HG MET 880 1HG MET 880 -4.156 10.672 -2.233 498 2HG MET 880 2HG MET 880 -3.451 11.583 -3.567 499 1HE MET 880 3HE MET 880 -1.580 11.108 -4.729 500 2HE MET 880 1HE MET 880 -0.892 9.541 -5.146 501 3HE MET 880 2HE MET 880 -2.462 10.006 -5.797 502 HA VAL 881 HA VAL 881 -1.041 16.175 -0.396 503 HB VAL 881 HB VAL 881 0.816 15.916 1.325 504 1HG1 VAL 881 1HG1 VAL 881 -1.567 14.609 1.153 505 2HG1 VAL 881 2HG1 VAL 881 -0.467 13.234 1.234 506 3HG1 VAL 881 3HG1 VAL 881 -0.473 14.439 2.518 507 1HG2 VAL 881 1HG2 VAL 881 2.183 14.570 -0.502 508 2HG2 VAL 881 2HG2 VAL 881 2.359 14.185 1.210 509 3HG2 VAL 881 3HG2 VAL 881 1.324 13.191 0.185 510 HA GLU 882 HA GLU 882 2.353 18.298 -2.419 511 1HB GLU 882 1HB GLU 882 1.519 20.644 -2.571 512 2HB GLU 882 2HB GLU 882 0.239 19.451 -2.797 513 1HG GLU 882 1HG GLU 882 0.625 20.186 0.017 514 2HG GLU 882 2HG GLU 882 0.170 21.557 -0.995 515 HA LEU 883 HA LEU 883 4.507 19.427 1.597 516 1HB LEU 883 1HB LEU 883 5.412 17.155 1.315 517 2HB LEU 883 2HB LEU 883 6.351 17.688 -0.077 518 HG LEU 883 HG LEU 883 7.385 19.431 1.525 519 1HD1 LEU 883 1HD1 LEU 883 5.822 17.671 3.378 520 2HD1 LEU 883 2HD1 LEU 883 7.383 18.288 3.920 521 3HD1 LEU 883 3HD1 LEU 883 6.103 19.411 3.460 522 1HD2 LEU 883 1HD2 LEU 883 8.548 17.399 0.655 523 2HD2 LEU 883 2HD2 LEU 883 9.059 17.821 2.288 524 3HD2 LEU 883 3HD2 LEU 883 7.931 16.489 2.033 525 HA GLU 884 HA GLU 884 6.738 22.170 -1.425 526 1HB GLU 884 1HB GLU 884 8.556 20.893 0.356 527 2HB GLU 884 2HB GLU 884 9.493 21.498 -1.008 528 1HG GLU 884 1HG GLU 884 7.475 23.169 0.514 529 2HG GLU 884 2HG GLU 884 9.206 23.172 0.854 530 1HA GLY 885 1HA GLY 885 7.390 19.170 -5.289 531 2HA GLY 885 2HA GLY 885 8.751 20.269 -5.057 532 HA GLU 886 HA GLU 886 10.162 16.134 -2.620 533 1HB GLU 886 1HB GLU 886 10.794 16.095 -4.932 534 2HB GLU 886 2HB GLU 886 11.791 17.537 -4.754 535 1HG GLU 886 1HG GLU 886 13.284 16.241 -3.211 536 2HG GLU 886 2HG GLU 886 12.325 14.802 -3.557 537 HA THR 887 HA THR 887 13.699 17.536 -0.235 538 HB THR 887 HB THR 887 11.041 18.070 1.142 539 HG1 THR 887 HG1 THR 887 11.363 20.104 0.398 540 1HG2 THR 887 1HG2 THR 887 13.828 18.394 2.132 541 2HG2 THR 887 2HG2 THR 887 12.738 19.754 2.402 542 3HG2 THR 887 3HG2 THR 887 12.331 18.160 3.036 543 HA ASP 888 HA ASP 888 12.717 14.371 3.049 544 1HB ASP 888 1HB ASP 888 10.289 15.385 3.213 545 2HB ASP 888 2HB ASP 888 9.842 13.813 2.555 546 HA PRO 889 HA PRO 889 13.200 10.851 0.380 547 1HB PRO 889 1HB PRO 889 13.414 9.055 2.615 548 2HB PRO 889 2HB PRO 889 14.720 9.738 1.644 549 1HG PRO 889 1HG PRO 889 14.094 10.353 4.349 550 2HG PRO 889 2HG PRO 889 15.304 11.135 3.328 551 1HD PRO 889 1HD PRO 889 14.033 13.027 3.369 552 2HD PRO 889 2HD PRO 889 12.713 12.169 4.203 553 HA LEU 890 HA LEU 890 8.799 9.641 1.138 554 1HB LEU 890 1HB LEU 890 8.604 7.687 2.577 555 2HB LEU 890 2HB LEU 890 10.283 7.857 2.099 556 HG LEU 890 HG LEU 890 10.293 7.326 4.430 557 1HD1 LEU 890 1HD1 LEU 890 11.768 9.256 3.683 558 2HD1 LEU 890 2HD1 LEU 890 10.573 10.332 4.406 559 3HD1 LEU 890 3HD1 LEU 890 11.434 9.169 5.410 560 1HD2 LEU 890 1HD2 LEU 890 7.796 8.318 4.557 561 2HD2 LEU 890 2HD2 LEU 890 8.789 8.062 5.989 562 3HD2 LEU 890 3HD2 LEU 890 8.671 9.670 5.276 563 HA LEU 891 HA LEU 891 7.371 11.913 5.366 564 1HB LEU 891 1HB LEU 891 8.357 13.991 5.301 565 2HB LEU 891 2HB LEU 891 8.409 13.990 3.551 566 HG LEU 891 HG LEU 891 6.937 15.755 4.549 567 1HD1 LEU 891 1HD1 LEU 891 6.555 14.368 2.238 568 2HD1 LEU 891 2HD1 LEU 891 4.990 14.147 3.027 569 3HD1 LEU 891 3HD1 LEU 891 5.603 15.768 2.719 570 1HD2 LEU 891 1HD2 LEU 891 5.779 13.400 5.829 571 2HD2 LEU 891 2HD2 LEU 891 5.642 15.099 6.273 572 3HD2 LEU 891 3HD2 LEU 891 4.568 14.418 5.053 573 HA ILE 892 HA ILE 892 4.151 12.773 1.867 574 HB ILE 892 HB ILE 892 6.557 12.348 0.223 575 1HG1 ILE 892 1HG1 ILE 892 4.271 13.900 -0.770 576 2HG1 ILE 892 2HG1 ILE 892 4.895 14.413 0.798 577 1HG2 ILE 892 1HG2 ILE 892 3.916 11.210 -0.561 578 2HG2 ILE 892 2HG2 ILE 892 4.882 12.026 -1.777 579 3HG2 ILE 892 3HG2 ILE 892 5.544 10.638 -0.927 580 1HD1 ILE 892 1HD1 ILE 892 6.814 13.756 -1.374 581 2HD1 ILE 892 2HD1 ILE 892 5.979 15.307 -1.426 582 3HD1 ILE 892 3HD1 ILE 892 6.985 14.888 -0.039 583 HA ALA 893 HA ALA 893 4.314 8.141 0.682 584 1HB ALA 893 1HB ALA 893 7.176 8.173 1.347 585 2HB ALA 893 3HB ALA 893 6.333 7.326 0.057 586 3HB ALA 893 2HB ALA 893 6.350 6.657 1.684 587 HA MET 894 HA MET 894 4.297 7.443 5.371 588 1HB MET 894 1HB MET 894 6.396 8.408 6.058 589 2HB MET 894 2HB MET 894 5.872 10.027 5.605 590 1HG MET 894 1HG MET 894 4.233 10.028 7.436 591 2HG MET 894 2HG MET 894 4.713 8.391 7.882 592 1HE MET 894 2HE MET 894 6.000 11.574 6.709 593 2HE MET 894 1HE MET 894 6.570 12.374 8.171 594 3HE MET 894 3HE MET 894 7.712 11.501 7.152 595 HA LYS 895 HA LYS 895 1.707 11.554 5.971 596 1HB LYS 895 1HB LYS 895 3.098 13.185 4.875 597 2HB LYS 895 2HB LYS 895 2.891 12.396 3.314 598 1HG LYS 895 1HG LYS 895 0.304 12.897 3.907 599 2HG LYS 895 2HG LYS 895 1.328 14.030 3.028 600 1HD LYS 895 1HD LYS 895 1.964 14.692 5.585 601 2HD LYS 895 2HD LYS 895 0.669 15.474 4.679 602 1HE LYS 895 1HE LYS 895 -0.991 13.975 5.654 603 2HE LYS 895 2HE LYS 895 0.283 13.050 6.472 604 1HZ LYS 895 1HZ LYS 895 -0.157 15.966 6.830 605 2HZ LYS 895 2HZ LYS 895 -0.734 14.784 7.900 606 3HZ LYS 895 3HZ LYS 895 0.938 14.988 7.685 607 HA GLU 896 HA GLU 896 -0.733 10.126 2.000 608 1HB GLU 896 1HB GLU 896 0.057 8.148 0.563 609 2HB GLU 896 2HB GLU 896 0.848 9.689 0.271 610 1HG GLU 896 1HG GLU 896 2.337 8.445 2.287 611 2HG GLU 896 2HG GLU 896 2.788 8.648 0.599 612 HA LEU 897 HA LEU 897 -1.067 5.915 3.915 613 1HB LEU 897 1HB LEU 897 1.231 4.961 3.771 614 2HB LEU 897 2HB LEU 897 1.630 5.769 5.290 615 HG LEU 897 HG LEU 897 0.705 3.229 5.205 616 1HD1 LEU 897 1HD1 LEU 897 1.422 4.839 7.146 617 2HD1 LEU 897 2HD1 LEU 897 -0.316 5.037 7.378 618 3HD1 LEU 897 3HD1 LEU 897 0.416 3.439 7.517 619 1HD2 LEU 897 1HD2 LEU 897 -1.479 4.242 4.178 620 2HD2 LEU 897 2HD2 LEU 897 -1.647 3.082 5.491 621 3HD2 LEU 897 3HD2 LEU 897 -1.807 4.800 5.816 622 HA LYS 898 HA LYS 898 -0.338 7.830 8.424 623 1HB LYS 898 1HB LYS 898 1.652 9.173 7.861 624 2HB LYS 898 2HB LYS 898 0.655 10.206 6.838 625 1HG LYS 898 1HG LYS 898 1.088 11.223 9.078 626 2HG LYS 898 2HG LYS 898 -0.628 10.960 8.767 627 1HD LYS 898 1HD LYS 898 -0.819 9.426 10.427 628 2HD LYS 898 2HD LYS 898 0.722 8.666 10.030 629 1HE LYS 898 1HE LYS 898 1.259 11.294 11.068 630 2HE LYS 898 2HE LYS 898 0.181 10.442 12.192 631 1HZ LYS 898 1HZ LYS 898 2.628 9.265 10.983 632 2HZ LYS 898 2HZ LYS 898 2.547 9.902 12.557 633 3HZ LYS 898 3HZ LYS 898 1.624 8.538 12.138 634 HA ALA 899 HA ALA 899 -3.653 10.585 6.567 635 1HB ALA 899 3HB ALA 899 -3.888 11.352 4.230 636 2HB ALA 899 1HB ALA 899 -2.210 11.542 4.736 637 3HB ALA 899 2HB ALA 899 -2.670 10.188 3.707 638 HA ARG 900 HA ARG 900 -3.846 5.853 4.008 639 1HB ARG 900 1HB ARG 900 -4.735 4.862 5.884 640 2HB ARG 900 2HB ARG 900 -4.263 6.340 6.711 641 1HG ARG 900 1HG ARG 900 -6.585 7.243 5.948 642 2HG ARG 900 2HG ARG 900 -6.978 5.548 5.674 643 1HD ARG 900 1HD ARG 900 -5.721 5.679 8.223 644 2HD ARG 900 2HD ARG 900 -6.933 6.974 8.173 645 HE ARG 900 HE ARG 900 -8.603 5.261 7.495 646 1HH1 ARG 900 1HH1 ARG 900 -5.725 3.634 7.334 647 2HH1 ARG 900 2HH1 ARG 900 -6.190 2.307 8.346 648 1HH2 ARG 900 1HH2 ARG 900 -9.145 3.793 9.390 649 2HH2 ARG 900 2HH2 ARG 900 -8.126 2.397 9.509 650 HA LYS 901 HA LYS 901 -7.288 8.213 2.416 651 1HB LYS 901 1HB LYS 901 -6.573 10.264 3.597 652 2HB LYS 901 2HB LYS 901 -5.431 10.598 2.293 653 1HG LYS 901 1HG LYS 901 -8.216 10.117 1.418 654 2HG LYS 901 2HG LYS 901 -7.977 11.581 2.370 655 1HD LYS 901 1HD LYS 901 -5.854 11.798 0.729 656 2HD LYS 901 2HD LYS 901 -6.934 10.888 -0.329 657 1HE LYS 901 1HE LYS 901 -8.660 12.769 0.653 658 2HE LYS 901 2HE LYS 901 -7.732 12.984 -0.845 659 1HZ LYS 901 1HZ LYS 901 -5.916 13.904 0.518 660 2HZ LYS 901 2HZ LYS 901 -7.331 14.834 0.648 661 3HZ LYS 901 3HZ LYS 901 -6.889 13.775 1.902 662 HA ILE 902 HA ILE 902 -4.311 8.921 -1.483 663 HB ILE 902 HB ILE 902 -2.491 7.257 -1.823 664 1HG1 ILE 902 1HG1 ILE 902 -3.721 6.202 0.682 665 2HG1 ILE 902 2HG1 ILE 902 -2.923 5.337 -0.623 666 1HG2 ILE 902 1HG2 ILE 902 -2.544 9.537 -0.306 667 2HG2 ILE 902 2HG2 ILE 902 -1.867 8.385 0.839 668 3HG2 ILE 902 3HG2 ILE 902 -1.079 8.652 -0.717 669 1HD1 ILE 902 1HD1 ILE 902 -0.752 6.439 0.282 670 2HD1 ILE 902 2HD1 ILE 902 -1.698 6.733 1.739 671 3HD1 ILE 902 3HD1 ILE 902 -1.439 5.084 1.176 672 HA PRO 903 HA PRO 903 -7.345 5.714 -2.713 673 1HB PRO 903 1HB PRO 903 -8.082 7.460 -4.877 674 2HB PRO 903 2HB PRO 903 -9.002 7.132 -3.404 675 1HG PRO 903 1HG PRO 903 -7.819 9.586 -4.087 676 2HG PRO 903 2HG PRO 903 -8.423 9.139 -2.488 677 1HD PRO 903 1HD PRO 903 -6.238 9.402 -1.799 678 2HD PRO 903 2HD PRO 903 -5.614 9.277 -3.462 679 HA ILE 904 HA ILE 904 -5.376 4.691 -6.546 680 HB ILE 904 HB ILE 904 -3.434 5.405 -4.568 681 1HG1 ILE 904 1HG1 ILE 904 -2.736 5.529 -7.432 682 2HG1 ILE 904 2HG1 ILE 904 -4.294 6.243 -7.030 683 1HG2 ILE 904 1HG2 ILE 904 -2.636 3.245 -6.529 684 2HG2 ILE 904 2HG2 ILE 904 -1.475 4.341 -5.784 685 3HG2 ILE 904 3HG2 ILE 904 -2.422 3.247 -4.778 686 1HD1 ILE 904 1HD1 ILE 904 -2.024 6.908 -5.226 687 2HD1 ILE 904 2HD1 ILE 904 -1.990 7.622 -6.839 688 3HD1 ILE 904 3HD1 ILE 904 -3.362 7.920 -5.771 689 HA ILE 905 HA ILE 905 -5.460 0.332 -6.609 690 HB ILE 905 HB ILE 905 -6.358 1.200 -8.756 691 1HG1 ILE 905 1HG1 ILE 905 -4.815 -0.914 -9.950 692 2HG1 ILE 905 2HG1 ILE 905 -5.173 -1.337 -8.276 693 1HG2 ILE 905 1HG2 ILE 905 -3.435 1.154 -9.554 694 2HG2 ILE 905 2HG2 ILE 905 -4.760 1.259 -10.712 695 3HG2 ILE 905 3HG2 ILE 905 -4.517 2.543 -9.535 696 1HD1 ILE 905 1HD1 ILE 905 -7.305 -0.246 -10.094 697 2HD1 ILE 905 2HD1 ILE 905 -6.929 -1.966 -10.062 698 3HD1 ILE 905 3HD1 ILE 905 -7.503 -1.158 -8.600 699 HA ILE 906 HA ILE 906 -1.071 -0.709 -7.272 700 HB ILE 906 HB ILE 906 -1.902 -2.566 -5.034 701 1HG1 ILE 906 1HG1 ILE 906 -1.814 -0.644 -3.465 702 2HG1 ILE 906 2HG1 ILE 906 -3.143 -0.486 -4.612 703 1HG2 ILE 906 1HG2 ILE 906 0.504 -0.879 -5.701 704 2HG2 ILE 906 2HG2 ILE 906 0.262 -1.543 -4.089 705 3HG2 ILE 906 3HG2 ILE 906 0.422 -2.623 -5.471 706 1HD1 ILE 906 1HD1 ILE 906 -0.807 0.693 -5.769 707 2HD1 ILE 906 2HD1 ILE 906 -2.317 1.475 -5.309 708 3HD1 ILE 906 3HD1 ILE 906 -1.005 1.337 -4.140 709 HA ARG 907 HA ARG 907 -1.706 -4.714 -9.188 710 1HB ARG 907 1HB ARG 907 0.742 -3.411 -10.336 711 2HB ARG 907 2HB ARG 907 0.196 -4.993 -10.882 712 1HG ARG 907 1HG ARG 907 -0.789 -3.323 -12.328 713 2HG ARG 907 2HG ARG 907 -2.055 -4.014 -11.318 714 1HD ARG 907 1HD ARG 907 -2.447 -2.034 -10.239 715 2HD ARG 907 2HD ARG 907 -0.723 -1.618 -10.180 716 HE ARG 907 HE ARG 907 -0.992 -0.486 -12.233 717 1HH1 ARG 907 1HH1 ARG 907 -1.707 -2.384 -14.164 718 2HH1 ARG 907 2HH1 ARG 907 -3.382 -2.109 -14.506 719 1HH2 ARG 907 1HH2 ARG 907 -3.947 -0.285 -11.613 720 2HH2 ARG 907 2HH2 ARG 907 -4.650 -0.921 -13.062 721 HA ARG 908 HA ARG 908 1.280 -6.848 -6.654 722 1HB ARG 908 1HB ARG 908 -0.956 -8.715 -6.079 723 2HB ARG 908 2HB ARG 908 0.203 -8.010 -4.975 724 1HG ARG 908 1HG ARG 908 -1.088 -5.816 -5.201 725 2HG ARG 908 2HG ARG 908 -2.334 -6.735 -6.044 726 1HD ARG 908 1HD ARG 908 -2.826 -6.515 -3.552 727 2HD ARG 908 2HD ARG 908 -2.622 -8.208 -4.048 728 HE ARG 908 HE ARG 908 -0.101 -6.953 -3.286 729 1HH1 ARG 908 1HH1 ARG 908 -2.877 -7.439 -1.504 730 2HH1 ARG 908 2HH1 ARG 908 -2.188 -8.570 -0.389 731 1HH2 ARG 908 1HH2 ARG 908 0.779 -8.910 -2.151 732 2HH2 ARG 908 2HH2 ARG 908 -0.118 -9.402 -0.754 733 HA TYR 909 HA TYR 909 1.213 -9.902 -10.030 734 1HB TYR 909 1HB TYR 909 4.090 -9.110 -10.194 735 2HB TYR 909 2HB TYR 909 3.026 -9.658 -11.472 736 HD1 TYR 909 HD1 TYR 909 4.044 -6.734 -9.443 737 HD2 TYR 909 HD2 TYR 909 1.596 -8.121 -12.668 738 HE1 TYR 909 HE1 TYR 909 3.709 -4.424 -10.156 739 HE2 TYR 909 HE2 TYR 909 1.245 -5.803 -13.389 740 HH TYR 909 HH TYR 909 1.327 -3.567 -12.512 741 HA LEU 910 HA LEU 910 4.059 -12.392 -7.571 742 1HB LEU 910 1HB LEU 910 2.306 -14.107 -9.335 743 2HB LEU 910 2HB LEU 910 3.038 -14.660 -7.828 744 HG LEU 910 HG LEU 910 1.027 -12.415 -8.168 745 1HD1 LEU 910 1HD1 LEU 910 0.818 -15.257 -7.679 746 2HD1 LEU 910 2HD1 LEU 910 0.176 -14.356 -6.314 747 3HD1 LEU 910 3HD1 LEU 910 -0.468 -14.077 -7.930 748 1HD2 LEU 910 1HD2 LEU 910 2.993 -12.841 -6.122 749 2HD2 LEU 910 2HD2 LEU 910 1.736 -11.607 -6.191 750 3HD2 LEU 910 3HD2 LEU 910 1.401 -13.166 -5.442 751 HA PRO 911 HA PRO 911 7.499 -13.324 -10.340 752 1HB PRO 911 1HB PRO 911 8.978 -14.035 -7.976 753 2HB PRO 911 2HB PRO 911 9.144 -12.570 -8.949 754 1HG PRO 911 1HG PRO 911 8.206 -11.363 -7.282 755 2HG PRO 911 2HG PRO 911 8.013 -12.828 -6.318 756 1HD PRO 911 1HD PRO 911 5.759 -12.760 -6.677 757 2HD PRO 911 2HD PRO 911 5.955 -11.306 -7.678 758 HA ASP 912 HA ASP 912 7.004 -17.677 -8.271 759 1HB ASP 912 1HB ASP 912 4.532 -16.458 -7.152 760 2HB ASP 912 2HB ASP 912 4.444 -18.184 -7.500 761 1HA GLY 913 1HA GLY 913 4.404 -16.835 -12.436 762 2HA GLY 913 2HA GLY 913 4.019 -18.392 -11.705 763 HA SER 914 HA SER 914 0.248 -15.510 -12.114 764 1HB SER 914 1HB SER 914 0.950 -16.070 -9.279 765 2HB SER 914 2HB SER 914 -0.533 -15.165 -9.563 766 HG SER 914 HG SER 914 -0.881 -17.431 -9.571 767 HA TYR 915 HA TYR 915 0.278 -11.373 -9.786 768 1HB TYR 915 1HB TYR 915 1.421 -10.846 -11.706 769 2HB TYR 915 2HB TYR 915 0.386 -11.859 -12.704 770 HD1 TYR 915 HD1 TYR 915 -0.083 -8.719 -10.649 771 HD2 TYR 915 HD2 TYR 915 -0.680 -10.715 -14.407 772 HE1 TYR 915 HE1 TYR 915 -1.198 -6.701 -11.545 773 HE2 TYR 915 HE2 TYR 915 -1.792 -8.691 -15.302 774 HH TYR 915 HH TYR 915 -1.702 -6.154 -14.760 775 HA GLU 916 HA GLU 916 -3.953 -9.797 -10.658 776 1HB GLU 916 1HB GLU 916 -3.328 -10.949 -8.200 777 2HB GLU 916 2HB GLU 916 -4.047 -9.395 -7.778 778 1HG GLU 916 1HG GLU 916 -5.399 -10.967 -9.911 779 2HG GLU 916 2HG GLU 916 -5.548 -11.563 -8.257 780 HA ASP 917 HA ASP 917 -3.330 -5.487 -9.622 781 1HB ASP 917 1HB ASP 917 -3.345 -5.706 -12.062 782 2HB ASP 917 2HB ASP 917 -4.093 -4.216 -11.543 783 HA TRP 918 HA TRP 918 -6.747 -2.762 -8.457 784 1HB TRP 918 1HB TRP 918 -8.078 -4.102 -6.814 785 2HB TRP 918 2HB TRP 918 -8.041 -4.757 -8.431 786 HD1 TRP 918 HD1 TRP 918 -4.828 -5.879 -7.263 787 HE1 TRP 918 HE1 TRP 918 -5.005 -8.286 -6.327 788 HE3 TRP 918 HE3 TRP 918 -9.765 -5.992 -6.420 789 HZ2 TRP 918 HZ2 TRP 918 -7.085 -9.979 -5.191 790 HZ3 TRP 918 HZ3 TRP 918 -10.855 -7.880 -5.335 791 HH2 TRP 918 HH2 TRP 918 -9.539 -9.922 -4.724 792 1HA GLY 919 1HA GLY 919 -5.150 -2.637 -4.143 793 2HA GLY 919 2HA GLY 919 -4.992 -1.068 -4.916 794 HA VAL 920 HA VAL 920 -8.251 -0.077 -2.164 795 HB VAL 920 HB VAL 920 -7.253 2.473 -3.479 796 1HG1 VAL 920 1HG1 VAL 920 -8.789 1.938 -0.927 797 2HG1 VAL 920 2HG1 VAL 920 -7.857 3.416 -1.167 798 3HG1 VAL 920 3HG1 VAL 920 -9.210 3.044 -2.235 799 1HG2 VAL 920 1HG2 VAL 920 -6.274 0.725 -1.220 800 2HG2 VAL 920 2HG2 VAL 920 -5.373 1.341 -2.605 801 3HG2 VAL 920 3HG2 VAL 920 -5.833 2.431 -1.302 802 HA ASP 921 HA ASP 921 -11.136 1.470 -5.486 803 1HB ASP 921 1HB ASP 921 -9.499 1.775 -7.324 804 2HB ASP 921 2HB ASP 921 -9.574 0.045 -7.660 805 HA GLU 922 HA GLU 922 -12.590 -2.844 -5.479 806 1HB GLU 922 1HB GLU 922 -10.722 -3.185 -7.262 807 2HB GLU 922 2HB GLU 922 -9.985 -4.231 -6.050 808 1HG GLU 922 1HG GLU 922 -12.144 -5.512 -5.916 809 2HG GLU 922 2HG GLU 922 -11.388 -5.600 -7.506 810 HA LEU 923 HA LEU 923 -10.832 -4.032 -1.427 811 1HB LEU 923 1HB LEU 923 -8.469 -5.064 -1.205 812 2HB LEU 923 2HB LEU 923 -9.511 -5.646 -2.485 813 HG LEU 923 HG LEU 923 -8.124 -3.424 -3.557 814 1HD1 LEU 923 1HD1 LEU 923 -6.301 -5.401 -2.164 815 2HD1 LEU 923 2HD1 LEU 923 -5.790 -4.225 -3.372 816 3HD1 LEU 923 3HD1 LEU 923 -6.414 -3.678 -1.819 817 1HD2 LEU 923 1HD2 LEU 923 -8.491 -6.286 -3.916 818 2HD2 LEU 923 2HD2 LEU 923 -8.484 -4.977 -5.095 819 3HD2 LEU 923 3HD2 LEU 923 -6.960 -5.676 -4.545 820 HA ILE 924 HA ILE 924 -8.631 -1.511 1.434 821 HB ILE 924 HB ILE 924 -7.364 -4.155 1.691 822 1HG1 ILE 924 1HG1 ILE 924 -8.256 -3.608 4.071 823 2HG1 ILE 924 2HG1 ILE 924 -9.032 -2.250 3.260 824 1HG2 ILE 924 1HG2 ILE 924 -5.374 -2.764 2.095 825 2HG2 ILE 924 2HG2 ILE 924 -6.271 -1.855 3.309 826 3HG2 ILE 924 3HG2 ILE 924 -5.930 -3.562 3.561 827 1HD1 ILE 924 3HD1 ILE 924 -9.239 -5.130 2.374 828 2HD1 ILE 924 1HD1 ILE 924 -10.487 -4.253 3.257 829 3HD1 ILE 924 2HD1 ILE 924 -10.039 -3.750 1.628 830 HA ILE 925 HA ILE 925 -4.868 0.435 0.119 831 HB ILE 925 HB ILE 925 -4.578 2.359 1.675 832 1HG1 ILE 925 1HG1 ILE 925 -6.840 1.596 3.394 833 2HG1 ILE 925 2HG1 ILE 925 -5.432 0.557 3.602 834 1HG2 ILE 925 1HG2 ILE 925 -7.078 1.545 0.412 835 2HG2 ILE 925 2HG2 ILE 925 -7.354 2.638 1.767 836 3HG2 ILE 925 3HG2 ILE 925 -6.302 3.129 0.441 837 1HD1 ILE 925 1HD1 ILE 925 -4.895 3.475 3.449 838 2HD1 ILE 925 2HD1 ILE 925 -5.717 2.908 4.903 839 3HD1 ILE 925 3HD1 ILE 925 -4.143 2.245 4.464 840 HA THR 926 HA THR 926 -1.302 -0.600 2.716 841 HB THR 926 HB THR 926 -2.189 1.280 4.922 842 HG1 THR 926 HG1 THR 926 -1.943 2.562 3.228 843 1HG2 THR 926 1HG2 THR 926 0.533 0.145 4.230 844 2HG2 THR 926 2HG2 THR 926 0.216 1.334 5.490 845 3HG2 THR 926 3HG2 THR 926 -0.445 -0.293 5.627 846 HA ASP 927 HA ASP 927 -4.289 -3.125 5.369 847 1HB ASP 927 1HB ASP 927 -3.674 -2.852 7.799 848 2HB ASP 927 2HB ASP 927 -2.320 -2.581 6.705 No H/Q in entry = 848 Start of MODEL 17 1 HA MET 801 HA MET 801 36.139 25.958 29.466 2 1HB MET 801 1HB MET 801 35.794 27.742 31.528 3 2HB MET 801 2HB MET 801 35.090 28.627 30.174 4 1HG MET 801 1HG MET 801 33.955 26.272 29.680 5 2HG MET 801 2HG MET 801 33.245 27.398 30.837 6 1HE MET 801 1HE MET 801 33.171 27.435 32.892 7 2HE MET 801 2HE MET 801 32.391 25.919 33.335 8 3HE MET 801 3HE MET 801 33.882 26.402 34.139 9 HA SER 802 HA SER 802 35.953 28.769 25.951 10 1HB SER 802 1HB SER 802 38.022 27.187 25.893 11 2HB SER 802 2HB SER 802 37.061 26.215 24.782 12 HG SER 802 HG SER 802 37.616 28.989 24.492 13 HA ASP 803 HA ASP 803 32.832 27.421 23.038 14 1HB ASP 803 1HB ASP 803 34.974 25.924 21.496 15 2HB ASP 803 2HB ASP 803 33.350 26.255 20.892 16 HA ASN 804 HA ASN 804 32.452 23.249 24.913 17 1HB ASN 804 1HB ASN 804 31.492 24.651 26.700 18 2HB ASN 804 2HB ASN 804 30.454 23.260 26.388 19 2HD2 ASN 804 1HD2 ASN 804 29.065 25.216 27.570 20 1HD2 ASN 804 2HD2 ASN 804 28.143 26.126 26.474 21 HA GLU 805 HA GLU 805 29.620 21.627 21.921 22 1HB GLU 805 1HB GLU 805 30.617 19.668 23.180 23 2HB GLU 805 2HB GLU 805 29.132 19.605 24.129 24 1HG GLU 805 1HG GLU 805 27.876 18.813 22.372 25 2HG GLU 805 2HG GLU 805 28.836 19.669 21.165 26 HA ASP 806 HA ASP 806 25.512 22.588 23.495 27 1HB ASP 806 1HB ASP 806 26.979 24.865 23.158 28 2HB ASP 806 2HB ASP 806 25.738 25.094 21.926 29 HA ASN 807 HA ASN 807 24.120 21.522 19.272 30 1HB ASN 807 1HB ASN 807 22.984 19.329 19.394 31 2HB ASN 807 2HB ASN 807 23.017 19.402 21.156 32 2HD2 ASN 807 1HD2 ASN 807 24.638 18.052 18.576 33 1HD2 ASN 807 2HD2 ASN 807 26.176 17.876 19.272 34 HA PHE 808 HA PHE 808 19.885 22.785 20.346 35 1HB PHE 808 1HB PHE 808 20.029 21.314 17.845 36 2HB PHE 808 2HB PHE 808 18.364 21.384 18.423 37 HD1 PHE 808 HD1 PHE 808 17.931 23.864 19.643 38 HD2 PHE 808 HD2 PHE 808 20.531 23.007 16.332 39 HE1 PHE 808 HE1 PHE 808 17.770 26.227 18.905 40 HE2 PHE 808 HE2 PHE 808 20.370 25.370 15.596 41 HZ PHE 808 HZ PHE 808 18.989 26.979 16.881 42 HA ASP 809 HA ASP 809 17.632 19.148 22.078 43 1HB ASP 809 1HB ASP 809 16.012 19.947 20.374 44 2HB ASP 809 2HB ASP 809 15.628 18.307 20.896 45 1HA GLY 810 1HA GLY 810 17.700 14.583 19.817 46 2HA GLY 810 2HA GLY 810 18.991 14.986 20.951 47 HA ASP 811 HA ASP 811 16.272 12.119 23.216 48 1HB ASP 811 1HB ASP 811 14.756 14.476 22.853 49 2HB ASP 811 2HB ASP 811 13.577 13.171 22.980 50 HA ASP 812 HA ASP 812 13.698 9.252 20.952 51 1HB ASP 812 1HB ASP 812 14.267 8.531 23.530 52 2HB ASP 812 2HB ASP 812 12.524 8.264 23.484 53 HA PHE 813 HA PHE 813 9.438 10.955 21.846 54 1HB PHE 813 1HB PHE 813 10.960 13.470 21.241 55 2HB PHE 813 2HB PHE 813 9.204 13.478 21.067 56 HD1 PHE 813 HD1 PHE 813 11.709 12.067 23.491 57 HD2 PHE 813 HD2 PHE 813 8.042 14.233 22.930 58 HE1 PHE 813 HE1 PHE 813 11.465 12.290 25.949 59 HE2 PHE 813 HE2 PHE 813 7.798 14.456 25.387 60 HZ PHE 813 HZ PHE 813 9.510 13.485 26.897 61 HA ASP 814 HA ASP 814 9.137 10.913 17.277 62 1HB ASP 814 1HB ASP 814 11.606 11.228 17.025 63 2HB ASP 814 2HB ASP 814 11.805 9.477 17.096 64 HA ASP 815 HA ASP 815 7.647 6.707 17.406 65 1HB ASP 815 1HB ASP 815 10.086 6.462 18.725 66 2HB ASP 815 2HB ASP 815 8.986 5.523 19.734 67 HA VAL 816 HA VAL 816 4.824 6.585 20.897 68 HB VAL 816 HB VAL 816 3.856 9.052 19.413 69 1HG1 VAL 816 1HG1 VAL 816 3.053 7.684 21.942 70 2HG1 VAL 816 2HG1 VAL 816 3.092 9.447 21.950 71 3HG1 VAL 816 3HG1 VAL 816 2.067 8.592 20.797 72 1HG2 VAL 816 1HG2 VAL 816 5.978 8.555 21.463 73 2HG2 VAL 816 2HG2 VAL 816 5.958 9.710 20.131 74 3HG2 VAL 816 3HG2 VAL 816 5.034 10.038 21.596 75 HA GLU 817 HA GLU 817 1.746 5.189 17.696 76 1HB GLU 817 1HB GLU 817 3.696 4.602 16.232 77 2HB GLU 817 2HB GLU 817 3.885 3.107 17.149 78 1HG GLU 817 1HG GLU 817 2.017 2.144 16.228 79 2HG GLU 817 2HG GLU 817 1.162 3.682 16.095 80 HA GLU 818 HA GLU 818 2.303 2.548 22.135 81 1HB GLU 818 1HB GLU 818 0.010 3.395 20.506 82 2HB GLU 818 2HB GLU 818 -0.247 1.841 21.299 83 1HG GLU 818 1HG GLU 818 0.855 3.217 23.350 84 2HG GLU 818 2HG GLU 818 0.074 4.544 22.490 85 HA ASP 819 HA ASP 819 1.522 -2.069 21.727 86 1HB ASP 819 1HB ASP 819 0.626 -0.566 19.338 87 2HB ASP 819 2HB ASP 819 1.289 -2.166 19.005 88 HA GLU 820 HA GLU 820 5.274 -2.402 18.916 89 1HB GLU 820 1HB GLU 820 5.271 -2.559 21.630 90 2HB GLU 820 2HB GLU 820 5.884 -4.164 21.228 91 1HG GLU 820 1HG GLU 820 7.679 -3.213 19.905 92 2HG GLU 820 2HG GLU 820 7.018 -1.590 20.101 93 1HA GLY 821 1HA GLY 821 7.033 -6.603 17.757 94 2HA GLY 821 2HA GLY 821 5.282 -6.787 17.869 95 HA LEU 822 HA LEU 822 5.300 -4.865 13.662 96 1HB LEU 822 1HB LEU 822 6.559 -2.625 14.806 97 2HB LEU 822 2HB LEU 822 7.476 -2.958 13.338 98 HG LEU 822 HG LEU 822 5.585 -1.424 12.896 99 1HD1 LEU 822 1HD1 LEU 822 5.670 -4.167 11.684 100 2HD1 LEU 822 2HD1 LEU 822 4.396 -3.053 11.191 101 3HD1 LEU 822 3HD1 LEU 822 6.088 -2.613 10.963 102 1HD2 LEU 822 1HD2 LEU 822 4.206 -2.773 14.753 103 2HD2 LEU 822 2HD2 LEU 822 3.395 -1.897 13.456 104 3HD2 LEU 822 3HD2 LEU 822 3.629 -3.640 13.330 105 HA ASP 823 HA ASP 823 9.435 -6.460 12.239 106 1HB ASP 823 1HB ASP 823 10.843 -4.840 13.452 107 2HB ASP 823 2HB ASP 823 11.660 -6.398 13.336 108 HA ASP 824 HA ASP 824 9.488 -10.205 15.105 109 1HB ASP 824 1HB ASP 824 8.583 -8.621 17.101 110 2HB ASP 824 2HB ASP 824 7.165 -9.647 16.879 111 HA LEU 825 HA LEU 825 5.726 -11.574 12.999 112 1HB LEU 825 1HB LEU 825 4.879 -8.836 13.492 113 2HB LEU 825 2HB LEU 825 4.105 -9.473 12.042 114 HG LEU 825 HG LEU 825 2.755 -9.964 14.047 115 1HD1 LEU 825 1HD1 LEU 825 3.120 -11.616 12.044 116 2HD1 LEU 825 2HD1 LEU 825 3.985 -12.585 13.236 117 3HD1 LEU 825 3HD1 LEU 825 2.285 -12.186 13.490 118 1HD2 LEU 825 1HD2 LEU 825 5.074 -10.187 15.390 119 2HD2 LEU 825 2HD2 LEU 825 3.592 -10.965 15.945 120 3HD2 LEU 825 3HD2 LEU 825 4.794 -11.895 15.050 121 HA GLU 826 HA GLU 826 6.711 -10.236 8.708 122 1HB GLU 826 1HB GLU 826 4.360 -8.885 9.169 123 2HB GLU 826 2HB GLU 826 5.287 -7.687 8.266 124 1HG GLU 826 1HG GLU 826 5.817 -9.606 6.624 125 2HG GLU 826 2HG GLU 826 4.501 -10.475 7.414 126 HA ASN 827 HA ASN 827 8.618 -6.194 6.507 127 1HB ASN 827 1HB ASN 827 7.540 -5.479 8.882 128 2HB ASN 827 2HB ASN 827 9.216 -5.709 9.382 129 2HD2 ASN 827 1HD2 ASN 827 10.891 -4.426 8.166 130 1HD2 ASN 827 2HD2 ASN 827 10.444 -2.956 7.446 131 HA ALA 828 HA ALA 828 11.808 -9.382 7.983 132 1HB ALA 828 1HB ALA 828 10.463 -10.507 5.936 133 2HB ALA 828 3HB ALA 828 12.059 -11.075 6.428 134 3HB ALA 828 2HB ALA 828 11.897 -9.978 5.057 135 HA GLU 829 HA GLU 829 15.183 -7.067 6.188 136 1HB GLU 829 1HB GLU 829 15.707 -9.662 4.756 137 2HB GLU 829 2HB GLU 829 16.791 -8.294 4.504 138 1HG GLU 829 1HG GLU 829 16.334 -8.457 7.301 139 2HG GLU 829 2HG GLU 829 17.831 -8.798 6.433 140 HA GLU 830 HA GLU 830 12.357 -4.744 3.185 141 1HB GLU 830 1HB GLU 830 14.917 -4.293 3.377 142 2HB GLU 830 2HB GLU 830 15.048 -5.321 1.949 143 1HG GLU 830 1HG GLU 830 13.938 -3.815 0.590 144 2HG GLU 830 2HG GLU 830 13.003 -3.140 1.924 145 HA GLU 831 HA GLU 831 12.312 -8.291 0.160 146 1HB GLU 831 1HB GLU 831 13.510 -9.733 2.224 147 2HB GLU 831 2HB GLU 831 12.040 -10.646 1.884 148 1HG GLU 831 1HG GLU 831 12.886 -10.125 -0.648 149 2HG GLU 831 2HG GLU 831 14.434 -10.223 0.191 150 1HA GLY 832 1HA GLY 832 8.140 -9.945 1.300 151 2HA GLY 832 2HA GLY 832 7.976 -8.949 -0.147 152 HA GLN 833 HA GLN 833 7.477 -12.613 -2.539 153 1HB GLN 833 1HB GLN 833 5.933 -14.251 -1.483 154 2HB GLN 833 2HB GLN 833 7.035 -13.557 -0.291 155 1HG GLN 833 1HG GLN 833 5.314 -11.934 0.377 156 2HG GLN 833 2HG GLN 833 4.210 -12.597 -0.827 157 2HE2 GLN 833 1HE2 GLN 833 6.411 -14.287 1.477 158 1HE2 GLN 833 2HE2 GLN 833 5.182 -15.198 2.214 159 HA GLU 834 HA GLU 834 4.212 -11.129 -5.105 160 1HB GLU 834 1HB GLU 834 3.131 -10.831 -2.787 161 2HB GLU 834 2HB GLU 834 3.431 -9.105 -2.986 162 1HG GLU 834 1HG GLU 834 1.659 -8.881 -4.360 163 2HG GLU 834 2HG GLU 834 2.204 -10.219 -5.369 164 HA ASN 835 HA ASN 835 6.437 -7.530 -6.673 165 1HB ASN 835 1HB ASN 835 4.945 -8.333 -9.169 166 2HB ASN 835 2HB ASN 835 6.521 -7.579 -9.028 167 2HD2 ASN 835 1HD2 ASN 835 8.206 -9.094 -7.797 168 1HD2 ASN 835 2HD2 ASN 835 8.191 -10.720 -8.283 169 HA VAL 836 HA VAL 836 2.666 -5.281 -7.113 170 HB VAL 836 HB VAL 836 2.124 -4.652 -5.014 171 1HG1 VAL 836 1HG1 VAL 836 4.939 -5.592 -4.472 172 2HG1 VAL 836 2HG1 VAL 836 3.694 -5.381 -3.242 173 3HG1 VAL 836 3HG1 VAL 836 3.487 -6.590 -4.509 174 1HG2 VAL 836 1HG2 VAL 836 4.646 -3.002 -5.124 175 2HG2 VAL 836 2HG2 VAL 836 2.977 -2.442 -5.126 176 3HG2 VAL 836 3HG2 VAL 836 3.683 -3.120 -3.659 177 HA GLU 837 HA GLU 837 4.298 -1.510 -8.765 178 1HB GLU 837 1HB GLU 837 2.590 -3.093 -10.486 179 2HB GLU 837 2HB GLU 837 2.303 -1.379 -10.762 180 1HG GLU 837 1HG GLU 837 5.008 -1.381 -10.647 181 2HG GLU 837 2HG GLU 837 4.735 -3.001 -11.288 182 HA ILE 838 HA ILE 838 0.589 0.872 -7.791 183 HB ILE 838 HB ILE 838 3.257 2.000 -7.514 184 1HG1 ILE 838 1HG1 ILE 838 0.779 1.681 -5.889 185 2HG1 ILE 838 2HG1 ILE 838 1.999 2.807 -5.323 186 1HG2 ILE 838 1HG2 ILE 838 0.939 3.931 -7.684 187 2HG2 ILE 838 2HG2 ILE 838 2.446 4.306 -6.856 188 3HG2 ILE 838 3HG2 ILE 838 2.450 3.990 -8.589 189 1HD1 ILE 838 1HD1 ILE 838 2.947 0.115 -6.196 190 2HD1 ILE 838 2HD1 ILE 838 3.532 1.137 -4.890 191 3HD1 ILE 838 3HD1 ILE 838 2.061 0.192 -4.676 192 HA LEU 839 HA LEU 839 -0.347 4.289 -10.654 193 1HB LEU 839 1HB LEU 839 -1.292 1.609 -11.030 194 2HB LEU 839 2HB LEU 839 -2.628 2.705 -11.383 195 HG LEU 839 HG LEU 839 -0.407 3.919 -12.580 196 1HD1 LEU 839 1HD1 LEU 839 0.384 1.329 -12.161 197 2HD1 LEU 839 2HD1 LEU 839 -0.357 1.209 -13.757 198 3HD1 LEU 839 3HD1 LEU 839 0.966 2.343 -13.482 199 1HD2 LEU 839 1HD2 LEU 839 -2.908 3.456 -13.291 200 2HD2 LEU 839 2HD2 LEU 839 -1.674 3.697 -14.527 201 3HD2 LEU 839 3HD2 LEU 839 -2.204 2.066 -14.117 202 HA PRO 840 HA PRO 840 -3.487 6.601 -8.581 203 1HB PRO 840 1HB PRO 840 -3.790 8.285 -10.057 204 2HB PRO 840 2HB PRO 840 -4.925 7.284 -10.968 205 1HG PRO 840 1HG PRO 840 -2.289 8.082 -11.745 206 2HG PRO 840 2HG PRO 840 -3.382 7.001 -12.615 207 1HD PRO 840 1HD PRO 840 -1.972 5.268 -12.140 208 2HD PRO 840 2HD PRO 840 -0.967 6.326 -11.117 209 HA SER 841 HA SER 841 -6.653 3.588 -7.659 210 1HB SER 841 1HB SER 841 -8.360 4.726 -6.675 211 2HB SER 841 2HB SER 841 -7.392 6.160 -6.999 212 HG SER 841 HG SER 841 -8.777 6.728 -8.478 213 1HA GLY 842 1HA GLY 842 -8.349 3.193 -11.739 214 2HA GLY 842 2HA GLY 842 -7.750 1.579 -11.381 215 HA GLU 843 HA GLU 843 -11.333 -0.973 -10.160 216 1HB GLU 843 1HB GLU 843 -11.656 0.672 -8.392 217 2HB GLU 843 2HB GLU 843 -12.031 1.927 -9.570 218 1HG GLU 843 1HG GLU 843 -14.189 1.272 -9.709 219 2HG GLU 843 2HG GLU 843 -13.734 -0.420 -9.906 220 HA ARG 844 HA ARG 844 -12.564 0.652 -14.298 221 1HB ARG 844 1HB ARG 844 -10.082 -0.974 -14.665 222 2HB ARG 844 2HB ARG 844 -11.125 -0.701 -16.062 223 1HG ARG 844 1HG ARG 844 -11.063 1.780 -15.446 224 2HG ARG 844 2HG ARG 844 -9.752 1.370 -14.340 225 1HD ARG 844 1HD ARG 844 -9.258 0.158 -16.924 226 2HD ARG 844 2HD ARG 844 -9.513 1.905 -17.103 227 HE ARG 844 HE ARG 844 -7.550 0.722 -15.172 228 1HH1 ARG 844 1HH1 ARG 844 -8.928 3.638 -15.921 229 2HH1 ARG 844 2HH1 ARG 844 -7.454 4.462 -16.304 230 1HH2 ARG 844 1HH2 ARG 844 -5.522 1.583 -16.255 231 2HH2 ARG 844 2HH2 ARG 844 -5.526 3.298 -16.493 232 HA PRO 845 HA PRO 845 -15.283 -2.960 -14.283 233 1HB PRO 845 1HB PRO 845 -16.967 -1.544 -16.141 234 2HB PRO 845 2HB PRO 845 -17.244 -1.815 -14.419 235 1HG PRO 845 1HG PRO 845 -16.592 0.650 -15.703 236 2HG PRO 845 2HG PRO 845 -16.790 0.356 -13.972 237 1HD PRO 845 1HD PRO 845 -14.549 0.663 -13.688 238 2HD PRO 845 2HD PRO 845 -14.330 0.840 -15.447 239 HA GLN 846 HA GLN 846 -14.046 -4.662 -18.184 240 1HB GLN 846 1HB GLN 846 -13.804 -2.295 -18.836 241 2HB GLN 846 2HB GLN 846 -12.149 -2.297 -18.226 242 1HG GLN 846 1HG GLN 846 -12.096 -4.451 -19.918 243 2HG GLN 846 2HG GLN 846 -11.594 -2.822 -20.368 244 2HE2 GLN 846 1HE2 GLN 846 -12.650 -2.001 -22.181 245 1HE2 GLN 846 2HE2 GLN 846 -14.169 -2.513 -22.742 246 HA ALA 847 HA ALA 847 -9.658 -5.869 -17.137 247 1HB ALA 847 1HB ALA 847 -9.344 -3.335 -15.634 248 2HB ALA 847 2HB ALA 847 -8.293 -4.647 -15.102 249 3HB ALA 847 3HB ALA 847 -8.243 -4.104 -16.779 250 HA ASN 848 HA ASN 848 -11.777 -7.060 -12.929 251 1HB ASN 848 1HB ASN 848 -13.705 -7.408 -14.827 252 2HB ASN 848 2HB ASN 848 -13.184 -9.077 -14.590 253 2HD2 ASN 848 1HD2 ASN 848 -15.540 -7.102 -13.545 254 1HD2 ASN 848 2HD2 ASN 848 -15.695 -7.612 -11.934 255 HA GLN 849 HA GLN 849 -8.835 -10.386 -13.897 256 1HB GLN 849 1HB GLN 849 -7.530 -7.972 -13.298 257 2HB GLN 849 2HB GLN 849 -6.897 -9.117 -12.118 258 1HG GLN 849 1HG GLN 849 -6.170 -10.623 -13.843 259 2HG GLN 849 2HG GLN 849 -7.033 -9.711 -15.083 260 2HE2 GLN 849 1HE2 GLN 849 -5.237 -8.073 -12.502 261 1HE2 GLN 849 2HE2 GLN 849 -4.014 -7.459 -13.491 262 HA LYS 850 HA LYS 850 -7.880 -11.476 -9.274 263 1HB LYS 850 1HB LYS 850 -9.763 -12.832 -11.091 264 2HB LYS 850 2HB LYS 850 -9.186 -13.856 -9.778 265 1HG LYS 850 1HG LYS 850 -9.898 -11.139 -8.908 266 2HG LYS 850 2HG LYS 850 -11.260 -12.043 -9.571 267 1HD LYS 850 1HD LYS 850 -10.961 -13.825 -8.005 268 2HD LYS 850 2HD LYS 850 -9.388 -13.207 -7.499 269 1HE LYS 850 1HE LYS 850 -10.600 -11.107 -6.697 270 2HE LYS 850 2HE LYS 850 -10.996 -12.580 -5.791 271 1HZ LYS 850 1HZ LYS 850 -12.833 -12.898 -7.465 272 2HZ LYS 850 2HZ LYS 850 -13.048 -11.590 -6.405 273 3HZ LYS 850 3HZ LYS 850 -12.534 -11.312 -7.995 274 HA ARG 851 HA ARG 851 -5.666 -15.508 -9.577 275 1HB ARG 851 1HB ARG 851 -4.454 -13.031 -10.065 276 2HB ARG 851 2HB ARG 851 -3.424 -13.787 -8.851 277 1HG ARG 851 1HG ARG 851 -2.491 -14.912 -10.581 278 2HG ARG 851 2HG ARG 851 -3.959 -15.886 -10.568 279 1HD ARG 851 1HD ARG 851 -4.801 -14.877 -12.455 280 2HD ARG 851 2HD ARG 851 -4.102 -13.299 -12.046 281 HE ARG 851 HE ARG 851 -1.839 -14.597 -12.546 282 1HH1 ARG 851 1HH1 ARG 851 -3.998 -16.626 -13.740 283 2HH1 ARG 851 2HH1 ARG 851 -3.714 -16.343 -15.425 284 1HH2 ARG 851 1HH2 ARG 851 -1.841 -13.473 -14.897 285 2HH2 ARG 851 2HH2 ARG 851 -2.493 -14.557 -16.080 286 HA ILE 852 HA ILE 852 -4.914 -15.299 -5.008 287 HB ILE 852 HB ILE 852 -2.742 -15.924 -4.616 288 1HG1 ILE 852 1HG1 ILE 852 -2.012 -13.663 -3.937 289 2HG1 ILE 852 2HG1 ILE 852 -0.776 -14.468 -4.896 290 1HG2 ILE 852 1HG2 ILE 852 -3.119 -16.419 -7.006 291 2HG2 ILE 852 2HG2 ILE 852 -2.408 -14.863 -7.433 292 3HG2 ILE 852 3HG2 ILE 852 -1.419 -16.104 -6.664 293 1HD1 ILE 852 1HD1 ILE 852 -2.477 -13.089 -6.719 294 2HD1 ILE 852 2HD1 ILE 852 -2.089 -11.970 -5.416 295 3HD1 ILE 852 3HD1 ILE 852 -0.799 -12.731 -6.332 296 HA THR 853 HA THR 853 -3.427 -10.837 -3.531 297 HB THR 853 HB THR 853 -4.513 -8.869 -4.642 298 HG1 THR 853 HG1 THR 853 -5.189 -10.774 -6.625 299 1HG2 THR 853 1HG2 THR 853 -2.239 -9.774 -5.228 300 2HG2 THR 853 2HG2 THR 853 -3.002 -10.652 -6.548 301 3HG2 THR 853 3HG2 THR 853 -3.039 -8.896 -6.530 302 HA THR 854 HA THR 854 -7.094 -12.004 -1.293 303 HB THR 854 HB THR 854 -4.983 -10.603 0.354 304 HG1 THR 854 HG1 THR 854 -4.886 -12.604 1.314 305 1HG2 THR 854 1HG2 THR 854 -7.230 -9.838 1.144 306 2HG2 THR 854 2HG2 THR 854 -7.682 -11.523 1.383 307 3HG2 THR 854 3HG2 THR 854 -6.379 -10.816 2.336 308 HA PRO 855 HA PRO 855 -9.325 -8.263 -2.239 309 1HB PRO 855 1HB PRO 855 -11.427 -9.132 -2.021 310 2HB PRO 855 2HB PRO 855 -11.327 -8.921 -0.270 311 1HG PRO 855 1HG PRO 855 -11.273 -11.377 -1.750 312 2HG PRO 855 2HG PRO 855 -11.118 -11.167 -0.003 313 1HD PRO 855 1HD PRO 855 -8.911 -11.766 -0.153 314 2HD PRO 855 2HD PRO 855 -9.043 -11.874 -1.927 315 HA TYR 856 HA TYR 856 -7.942 -5.538 0.989 316 1HB TYR 856 1HB TYR 856 -8.584 -7.412 2.404 317 2HB TYR 856 2HB TYR 856 -7.069 -8.228 2.072 318 HD1 TYR 856 HD1 TYR 856 -4.881 -6.906 2.775 319 HD2 TYR 856 HD2 TYR 856 -8.804 -6.109 4.324 320 HE1 TYR 856 HE1 TYR 856 -3.878 -5.821 4.750 321 HE2 TYR 856 HE2 TYR 856 -7.799 -5.038 6.311 322 HH TYR 856 HH TYR 856 -5.615 -5.147 7.554 323 HA MET 857 HA MET 857 -3.888 -5.364 -1.000 324 1HB MET 857 1HB MET 857 -4.994 -3.046 -1.172 325 2HB MET 857 2HB MET 857 -4.199 -2.675 0.349 326 1HG MET 857 1HG MET 857 -2.074 -3.633 -0.957 327 2HG MET 857 2HG MET 857 -3.009 -3.116 -2.356 328 1HE MET 857 1HE MET 857 -3.408 -0.926 -3.116 329 2HE MET 857 2HE MET 857 -4.549 -0.715 -1.796 330 3HE MET 857 3HE MET 857 -3.387 0.556 -2.156 331 HA THR 858 HA THR 858 -1.686 -5.336 2.927 332 HB THR 858 HB THR 858 0.107 -7.028 2.579 333 HG1 THR 858 HG1 THR 858 0.657 -7.593 0.552 334 1HG2 THR 858 1HG2 THR 858 -2.531 -7.389 1.138 335 2HG2 THR 858 2HG2 THR 858 -1.456 -8.718 1.571 336 3HG2 THR 858 3HG2 THR 858 -2.197 -7.734 2.834 337 HA LYS 859 HA LYS 859 0.900 -1.940 3.704 338 1HB LYS 859 1HB LYS 859 1.231 -3.377 5.671 339 2HB LYS 859 2HB LYS 859 2.748 -2.615 5.195 340 1HG LYS 859 1HG LYS 859 1.974 -5.359 4.195 341 2HG LYS 859 2HG LYS 859 3.575 -4.619 4.232 342 1HD LYS 859 1HD LYS 859 1.993 -5.224 6.740 343 2HD LYS 859 2HD LYS 859 3.141 -6.363 6.035 344 1HE LYS 859 1HE LYS 859 4.946 -5.170 6.767 345 2HE LYS 859 2HE LYS 859 4.192 -3.615 6.362 346 1HZ LYS 859 3HZ LYS 859 2.713 -3.883 8.262 347 2HZ LYS 859 1HZ LYS 859 3.474 -5.346 8.669 348 3HZ LYS 859 2HZ LYS 859 4.337 -3.890 8.761 349 HA TYR 860 HA TYR 860 4.739 -3.226 1.188 350 1HB TYR 860 1HB TYR 860 4.707 -5.641 1.098 351 2HB TYR 860 2HB TYR 860 3.407 -5.634 -0.084 352 HD1 TYR 860 HD1 TYR 860 5.829 -2.946 -0.365 353 HD2 TYR 860 HD2 TYR 860 5.015 -6.986 -1.597 354 HE1 TYR 860 HE1 TYR 860 7.461 -2.698 -2.195 355 HE2 TYR 860 HE2 TYR 860 6.661 -6.727 -3.432 356 HH TYR 860 HH TYR 860 7.992 -3.692 -4.324 357 HA GLU 861 HA GLU 861 2.100 -2.603 -2.918 358 1HB GLU 861 1HB GLU 861 -0.284 -2.975 -1.093 359 2HB GLU 861 2HB GLU 861 -0.439 -2.107 -2.620 360 1HG GLU 861 1HG GLU 861 0.865 -4.284 -3.511 361 2HG GLU 861 2HG GLU 861 -0.895 -4.220 -3.402 362 HA ARG 862 HA ARG 862 1.112 1.354 -0.327 363 1HB ARG 862 1HB ARG 862 -0.029 0.471 1.601 364 2HB ARG 862 2HB ARG 862 1.441 -0.307 2.182 365 1HG ARG 862 1HG ARG 862 1.622 2.623 1.738 366 2HG ARG 862 2HG ARG 862 0.614 2.113 3.085 367 1HD ARG 862 1HD ARG 862 2.626 0.573 3.723 368 2HD ARG 862 2HD ARG 862 3.563 1.654 2.673 369 HE ARG 862 HE ARG 862 1.911 3.227 4.405 370 1HH1 ARG 862 1HH1 ARG 862 3.355 0.891 5.978 371 2HH1 ARG 862 2HH1 ARG 862 4.687 1.784 6.631 372 1HH2 ARG 862 1HH2 ARG 862 4.207 4.525 4.560 373 2HH2 ARG 862 2HH2 ARG 862 5.170 3.842 5.829 374 HA ALA 863 HA ALA 863 5.537 1.127 1.531 375 1HB ALA 863 2HB ALA 863 6.445 -1.600 0.886 376 2HB ALA 863 3HB ALA 863 6.663 -0.670 2.367 377 3HB ALA 863 1HB ALA 863 5.153 -1.534 2.084 378 HA ARG 864 HA ARG 864 6.966 0.232 -2.835 379 1HB ARG 864 1HB ARG 864 4.784 -1.585 -3.110 380 2HB ARG 864 2HB ARG 864 4.684 -0.472 -4.477 381 1HG ARG 864 1HG ARG 864 7.402 -1.466 -3.812 382 2HG ARG 864 2HG ARG 864 6.289 -2.661 -4.475 383 1HD ARG 864 1HD ARG 864 5.773 -0.729 -6.230 384 2HD ARG 864 2HD ARG 864 7.397 -0.190 -5.763 385 HE ARG 864 HE ARG 864 7.489 -3.007 -6.174 386 1HH1 ARG 864 1HH1 ARG 864 6.064 -0.759 -8.219 387 2HH1 ARG 864 2HH1 ARG 864 7.115 -1.052 -9.564 388 1HH2 ARG 864 1HH2 ARG 864 9.271 -3.097 -7.777 389 2HH2 ARG 864 2HH2 ARG 864 8.929 -2.375 -9.314 390 HA VAL 865 HA VAL 865 3.121 3.179 -4.074 391 HB VAL 865 HB VAL 865 2.355 1.948 -1.506 392 1HG1 VAL 865 1HG1 VAL 865 1.973 4.848 -1.931 393 2HG1 VAL 865 2HG1 VAL 865 0.647 3.924 -1.228 394 3HG1 VAL 865 3HG1 VAL 865 2.222 3.943 -0.437 395 1HG2 VAL 865 1HG2 VAL 865 0.809 3.045 -3.807 396 2HG2 VAL 865 2HG2 VAL 865 1.272 1.368 -3.542 397 3HG2 VAL 865 3HG2 VAL 865 0.125 2.139 -2.456 398 HA LEU 866 HA LEU 866 4.705 6.004 -0.388 399 1HB LEU 866 1HB LEU 866 5.285 5.212 1.682 400 2HB LEU 866 2HB LEU 866 4.796 3.640 1.081 401 HG LEU 866 HG LEU 866 7.225 3.420 0.210 402 1HD1 LEU 866 1HD1 LEU 866 7.776 5.854 0.583 403 2HD1 LEU 866 2HD1 LEU 866 7.653 5.563 2.316 404 3HD1 LEU 866 3HD1 LEU 866 8.897 4.748 1.370 405 1HD2 LEU 866 1HD2 LEU 866 5.966 2.738 2.596 406 2HD2 LEU 866 2HD2 LEU 866 7.503 2.097 2.017 407 3HD2 LEU 866 3HD2 LEU 866 7.482 3.473 3.119 408 1HA GLY 867 1HA GLY 867 8.974 4.826 -2.112 409 2HA GLY 867 2HA GLY 867 8.547 3.342 -2.973 410 HA THR 868 HA THR 868 7.076 5.665 -6.428 411 HB THR 868 HB THR 868 4.952 5.066 -7.331 412 HG1 THR 868 HG1 THR 868 3.548 5.636 -5.759 413 1HG2 THR 868 1HG2 THR 868 6.683 3.264 -6.142 414 2HG2 THR 868 2HG2 THR 868 5.072 2.729 -5.660 415 3HG2 THR 868 3HG2 THR 868 5.465 2.910 -7.367 416 HA ARG 869 HA ARG 869 4.143 8.768 -4.366 417 1HB ARG 869 1HB ARG 869 4.257 6.992 -2.030 418 2HB ARG 869 2HB ARG 869 4.475 8.678 -1.559 419 1HG ARG 869 1HG ARG 869 2.100 8.170 -1.522 420 2HG ARG 869 2HG ARG 869 2.420 9.253 -2.878 421 1HD ARG 869 1HD ARG 869 2.789 6.755 -4.017 422 2HD ARG 869 2HD ARG 869 1.428 6.488 -2.909 423 HE ARG 869 HE ARG 869 0.523 8.702 -3.980 424 1HH1 ARG 869 1HH1 ARG 869 1.199 5.770 -5.406 425 2HH1 ARG 869 2HH1 ARG 869 1.135 6.336 -7.042 426 1HH2 ARG 869 1HH2 ARG 869 0.977 9.685 -6.157 427 2HH2 ARG 869 2HH2 ARG 869 1.010 8.552 -7.466 428 HA ALA 870 HA ALA 870 8.212 9.937 -1.900 429 1HB ALA 870 3HB ALA 870 8.830 7.932 -0.802 430 2HB ALA 870 2HB ALA 870 10.174 8.238 -1.904 431 3HB ALA 870 1HB ALA 870 8.944 7.045 -2.323 432 HA LEU 871 HA LEU 871 10.332 9.790 -5.987 433 1HB LEU 871 1HB LEU 871 9.425 8.165 -8.107 434 2HB LEU 871 2HB LEU 871 10.929 7.996 -7.219 435 HG LEU 871 HG LEU 871 8.477 6.818 -6.011 436 1HD1 LEU 871 1HD1 LEU 871 8.372 6.199 -8.414 437 2HD1 LEU 871 2HD1 LEU 871 10.004 5.542 -8.288 438 3HD1 LEU 871 3HD1 LEU 871 8.685 4.810 -7.373 439 1HD2 LEU 871 1HD2 LEU 871 11.398 6.028 -6.256 440 2HD2 LEU 871 2HD2 LEU 871 10.616 6.702 -4.827 441 3HD2 LEU 871 3HD2 LEU 871 10.186 5.087 -5.387 442 HA GLN 872 HA GLN 872 6.235 10.582 -8.585 443 1HB GLN 872 1HB GLN 872 5.079 9.664 -6.053 444 2HB GLN 872 2HB GLN 872 4.383 11.191 -6.573 445 1HG GLN 872 1HG GLN 872 3.160 9.157 -7.440 446 2HG GLN 872 2HG GLN 872 3.712 10.250 -8.703 447 2HE2 GLN 872 1HE2 GLN 872 3.789 6.995 -7.662 448 1HE2 GLN 872 2HE2 GLN 872 5.019 6.449 -8.695 449 HA ILE 873 HA ILE 873 6.334 14.559 -5.787 450 HB ILE 873 HB ILE 873 7.340 14.435 -3.373 451 1HG1 ILE 873 1HG1 ILE 873 6.280 11.873 -2.803 452 2HG1 ILE 873 2HG1 ILE 873 7.339 11.660 -4.191 453 1HG2 ILE 873 1HG2 ILE 873 4.677 13.690 -4.439 454 2HG2 ILE 873 2HG2 ILE 873 4.946 13.494 -2.711 455 3HG2 ILE 873 3HG2 ILE 873 5.151 15.075 -3.457 456 1HD1 ILE 873 1HD1 ILE 873 8.376 13.356 -2.006 457 2HD1 ILE 873 2HD1 ILE 873 8.241 11.632 -1.675 458 3HD1 ILE 873 3HD1 ILE 873 9.208 12.198 -3.035 459 HA ALA 874 HA ALA 874 11.043 13.861 -4.931 460 1HB ALA 874 1HB ALA 874 10.856 11.262 -6.462 461 2HB ALA 874 3HB ALA 874 11.187 11.435 -4.739 462 3HB ALA 874 2HB ALA 874 12.367 11.989 -5.922 463 HA MET 875 HA MET 875 10.911 14.833 -9.452 464 1HB MET 875 1HB MET 875 9.192 12.867 -9.961 465 2HB MET 875 2HB MET 875 8.023 14.185 -10.046 466 1HG MET 875 1HG MET 875 8.703 14.249 -12.233 467 2HG MET 875 2HG MET 875 9.992 15.246 -11.560 468 1HE MET 875 1HE MET 875 9.354 13.492 -13.974 469 2HE MET 875 3HE MET 875 10.856 12.714 -14.465 470 3HE MET 875 2HE MET 875 9.563 11.761 -13.722 471 HA CYS 876 HA CYS 876 7.926 18.048 -7.824 472 1HB CYS 876 1HB CYS 876 6.217 16.781 -9.929 473 2HB CYS 876 2HB CYS 876 5.494 18.104 -9.013 474 HG CYS 876 HG CYS 876 7.912 19.361 -9.723 475 HA ALA 877 HA ALA 877 4.793 15.214 -5.455 476 1HB ALA 877 3HB ALA 877 4.754 17.330 -4.587 477 2HB ALA 877 1HB ALA 877 3.947 18.006 -6.002 478 3HB ALA 877 2HB ALA 877 3.028 17.061 -4.830 479 HA PRO 878 HA PRO 878 1.191 14.236 -8.519 480 1HB PRO 878 1HB PRO 878 2.240 11.570 -8.678 481 2HB PRO 878 2HB PRO 878 2.086 12.746 -9.987 482 1HG PRO 878 1HG PRO 878 4.337 12.944 -10.028 483 2HG PRO 878 2HG PRO 878 4.480 11.862 -8.648 484 1HD PRO 878 1HD PRO 878 5.084 13.638 -7.370 485 2HD PRO 878 2HD PRO 878 4.772 14.739 -8.727 486 HA VAL 879 HA VAL 879 1.474 11.004 -4.688 487 HB VAL 879 HB VAL 879 2.998 13.411 -3.769 488 1HG1 VAL 879 1HG1 VAL 879 1.300 12.882 -1.949 489 2HG1 VAL 879 2HG1 VAL 879 2.139 11.347 -1.754 490 3HG1 VAL 879 3HG1 VAL 879 2.982 12.864 -1.476 491 1HG2 VAL 879 1HG2 VAL 879 3.759 10.996 -4.746 492 2HG2 VAL 879 2HG2 VAL 879 4.768 11.972 -3.701 493 3HG2 VAL 879 3HG2 VAL 879 3.810 10.670 -3.019 494 HA MET 880 HA MET 880 -2.312 12.896 -3.441 495 1HB MET 880 1HB MET 880 -1.754 10.495 -2.138 496 2HB MET 880 2HB MET 880 -2.405 11.526 -0.863 497 1HG MET 880 1HG MET 880 -4.285 10.454 -1.872 498 2HG MET 880 2HG MET 880 -4.291 12.111 -2.471 499 1HE MET 880 1HE MET 880 -5.510 12.070 -4.060 500 2HE MET 880 3HE MET 880 -4.703 12.163 -5.623 501 3HE MET 880 2HE MET 880 -5.784 10.809 -5.260 502 HA VAL 881 HA VAL 881 -1.183 16.041 -0.491 503 HB VAL 881 HB VAL 881 0.710 15.797 1.212 504 1HG1 VAL 881 1HG1 VAL 881 -1.682 14.345 0.937 505 2HG1 VAL 881 2HG1 VAL 881 -0.478 13.136 1.373 506 3HG1 VAL 881 3HG1 VAL 881 -0.740 14.536 2.411 507 1HG2 VAL 881 1HG2 VAL 881 2.023 14.392 -0.617 508 2HG2 VAL 881 2HG2 VAL 881 2.227 14.046 1.100 509 3HG2 VAL 881 3HG2 VAL 881 1.156 13.045 0.118 510 HA GLU 882 HA GLU 882 2.217 18.157 -2.529 511 1HB GLU 882 1HB GLU 882 -0.082 19.803 -1.576 512 2HB GLU 882 2HB GLU 882 1.276 20.649 -2.321 513 1HG GLU 882 1HG GLU 882 0.979 18.612 -4.082 514 2HG GLU 882 2HG GLU 882 -0.690 18.791 -3.539 515 HA LEU 883 HA LEU 883 4.333 19.445 1.462 516 1HB LEU 883 1HB LEU 883 5.325 17.212 1.240 517 2HB LEU 883 2HB LEU 883 6.216 17.727 -0.190 518 HG LEU 883 HG LEU 883 7.289 19.515 1.272 519 1HD1 LEU 883 1HD1 LEU 883 5.840 17.877 3.358 520 2HD1 LEU 883 2HD1 LEU 883 7.263 18.842 3.752 521 3HD1 LEU 883 3HD1 LEU 883 5.810 19.626 3.132 522 1HD2 LEU 883 1HD2 LEU 883 7.695 16.554 1.673 523 2HD2 LEU 883 2HD2 LEU 883 8.680 17.686 0.745 524 3HD2 LEU 883 3HD2 LEU 883 8.719 17.723 2.508 525 HA GLU 884 HA GLU 884 6.457 22.203 -1.626 526 1HB GLU 884 1HB GLU 884 8.332 21.020 0.160 527 2HB GLU 884 2HB GLU 884 9.236 21.618 -1.230 528 1HG GLU 884 1HG GLU 884 8.348 23.834 -0.962 529 2HG GLU 884 2HG GLU 884 7.173 23.283 0.232 530 1HA GLY 885 1HA GLY 885 7.131 19.150 -5.432 531 2HA GLY 885 2HA GLY 885 8.481 20.271 -5.239 532 HA GLU 886 HA GLU 886 9.944 16.150 -2.774 533 1HB GLU 886 1HB GLU 886 10.597 16.087 -5.064 534 2HB GLU 886 2HB GLU 886 11.509 17.588 -4.928 535 1HG GLU 886 1HG GLU 886 13.076 16.396 -3.348 536 2HG GLU 886 2HG GLU 886 12.218 14.900 -3.717 537 HA THR 887 HA THR 887 13.469 17.588 -0.396 538 HB THR 887 HB THR 887 10.799 18.076 0.970 539 HG1 THR 887 HG1 THR 887 12.733 19.745 -0.262 540 1HG2 THR 887 1HG2 THR 887 13.596 18.694 1.936 541 2HG2 THR 887 2HG2 THR 887 12.201 19.631 2.472 542 3HG2 THR 887 3HG2 THR 887 12.287 17.902 2.814 543 HA ASP 888 HA ASP 888 12.551 14.359 2.849 544 1HB ASP 888 1HB ASP 888 10.126 15.372 3.059 545 2HB ASP 888 2HB ASP 888 9.671 13.810 2.389 546 HA PRO 889 HA PRO 889 12.969 10.875 0.117 547 1HB PRO 889 1HB PRO 889 13.244 9.046 2.318 548 2HB PRO 889 2HB PRO 889 14.524 9.751 1.328 549 1HG PRO 889 1HG PRO 889 13.967 10.316 4.055 550 2HG PRO 889 2HG PRO 889 15.140 11.128 3.015 551 1HD PRO 889 1HD PRO 889 13.854 13.006 3.140 552 2HD PRO 889 2HD PRO 889 12.555 12.114 3.973 553 HA LEU 890 HA LEU 890 8.593 9.638 0.962 554 1HB LEU 890 1HB LEU 890 10.085 7.850 1.881 555 2HB LEU 890 2HB LEU 890 8.422 7.687 2.415 556 HG LEU 890 HG LEU 890 10.153 7.312 4.215 557 1HD1 LEU 890 1HD1 LEU 890 11.638 9.216 3.406 558 2HD1 LEU 890 2HD1 LEU 890 10.495 10.309 4.185 559 3HD1 LEU 890 3HD1 LEU 890 11.375 9.121 5.145 560 1HD2 LEU 890 1HD2 LEU 890 7.687 8.343 4.427 561 2HD2 LEU 890 2HD2 LEU 890 8.729 8.096 5.826 562 3HD2 LEU 890 3HD2 LEU 890 8.605 9.694 5.094 563 HA LEU 891 HA LEU 891 7.255 11.952 5.202 564 1HB LEU 891 1HB LEU 891 8.236 14.034 5.059 565 2HB LEU 891 2HB LEU 891 8.229 13.995 3.308 566 HG LEU 891 HG LEU 891 6.776 15.769 4.339 567 1HD1 LEU 891 1HD1 LEU 891 6.359 14.353 2.045 568 2HD1 LEU 891 2HD1 LEU 891 4.809 14.144 2.864 569 3HD1 LEU 891 3HD1 LEU 891 5.418 15.761 2.527 570 1HD2 LEU 891 1HD2 LEU 891 5.847 13.585 5.865 571 2HD2 LEU 891 2HD2 LEU 891 5.270 15.250 5.920 572 3HD2 LEU 891 3HD2 LEU 891 4.500 14.085 4.844 573 HA ILE 892 HA ILE 892 3.947 12.758 1.758 574 HB ILE 892 HB ILE 892 6.329 12.310 0.100 575 1HG1 ILE 892 1HG1 ILE 892 4.045 13.800 -0.956 576 2HG1 ILE 892 2HG1 ILE 892 4.584 14.343 0.633 577 1HG2 ILE 892 1HG2 ILE 892 3.703 11.110 -0.649 578 2HG2 ILE 892 2HG2 ILE 892 4.666 11.898 -1.886 579 3HG2 ILE 892 3HG2 ILE 892 5.339 10.546 -0.989 580 1HD1 ILE 892 1HD1 ILE 892 6.603 13.729 -1.461 581 2HD1 ILE 892 2HD1 ILE 892 5.740 15.262 -1.536 582 3HD1 ILE 892 3HD1 ILE 892 6.704 14.858 -0.116 583 HA ALA 893 HA ALA 893 4.014 8.109 0.728 584 1HB ALA 893 1HB ALA 893 6.907 8.130 1.257 585 2HB ALA 893 3HB ALA 893 5.995 7.220 0.062 586 3HB ALA 893 2HB ALA 893 6.096 6.640 1.720 587 HA MET 894 HA MET 894 4.265 7.597 5.479 588 1HB MET 894 1HB MET 894 6.394 8.683 5.919 589 2HB MET 894 2HB MET 894 5.720 10.264 5.532 590 1HG MET 894 1HG MET 894 4.293 10.189 7.503 591 2HG MET 894 2HG MET 894 4.820 8.546 7.864 592 1HE MET 894 2HE MET 894 5.986 11.767 6.680 593 2HE MET 894 1HE MET 894 6.627 12.539 8.125 594 3HE MET 894 3HE MET 894 7.723 11.727 7.012 595 HA LYS 895 HA LYS 895 1.575 11.631 5.948 596 1HB LYS 895 1HB LYS 895 2.754 13.342 4.814 597 2HB LYS 895 2HB LYS 895 2.772 12.443 3.299 598 1HG LYS 895 1HG LYS 895 1.175 14.225 3.060 599 2HG LYS 895 2HG LYS 895 0.266 12.723 3.204 600 1HD LYS 895 1HD LYS 895 0.460 13.403 5.822 601 2HD LYS 895 2HD LYS 895 -0.886 13.896 4.795 602 1HE LYS 895 1HE LYS 895 1.496 15.655 4.645 603 2HE LYS 895 2HE LYS 895 -0.219 16.087 4.796 604 1HZ LYS 895 1HZ LYS 895 -0.120 15.224 7.105 605 2HZ LYS 895 2HZ LYS 895 1.563 15.062 6.940 606 3HZ LYS 895 3HZ LYS 895 0.848 16.597 6.858 607 HA GLU 896 HA GLU 896 -0.841 9.924 2.012 608 1HB GLU 896 1HB GLU 896 1.752 8.580 1.413 609 2HB GLU 896 2HB GLU 896 0.298 7.672 1.000 610 1HG GLU 896 1HG GLU 896 0.012 10.440 0.197 611 2HG GLU 896 2HG GLU 896 1.480 9.751 -0.494 612 HA LEU 897 HA LEU 897 -1.102 5.926 4.421 613 1HB LEU 897 1HB LEU 897 1.209 5.037 4.364 614 2HB LEU 897 2HB LEU 897 1.634 6.073 5.725 615 HG LEU 897 HG LEU 897 0.821 3.493 6.020 616 1HD1 LEU 897 1HD1 LEU 897 1.592 5.447 7.658 617 2HD1 LEU 897 2HD1 LEU 897 -0.120 5.433 8.087 618 3HD1 LEU 897 3HD1 LEU 897 0.849 3.971 8.276 619 1HD2 LEU 897 1HD2 LEU 897 -1.496 4.383 5.104 620 2HD2 LEU 897 2HD2 LEU 897 -1.471 3.283 6.477 621 3HD2 LEU 897 3HD2 LEU 897 -1.681 5.007 6.740 622 HA LYS 898 HA LYS 898 -0.429 8.364 8.679 623 1HB LYS 898 1HB LYS 898 1.515 9.690 7.979 624 2HB LYS 898 2HB LYS 898 0.505 10.554 6.825 625 1HG LYS 898 1HG LYS 898 0.906 11.856 8.928 626 2HG LYS 898 2HG LYS 898 -0.800 11.548 8.609 627 1HD LYS 898 1HD LYS 898 -0.708 9.600 10.156 628 2HD LYS 898 2HD LYS 898 -0.316 11.116 10.966 629 1HE LYS 898 1HE LYS 898 1.644 9.002 9.994 630 2HE LYS 898 2HE LYS 898 2.127 10.590 10.624 631 1HZ LYS 898 1HZ LYS 898 0.313 8.750 12.083 632 2HZ LYS 898 2HZ LYS 898 1.991 8.771 12.329 633 3HZ LYS 898 3HZ LYS 898 1.065 10.152 12.676 634 HA ALA 899 HA ALA 899 -3.814 10.869 6.554 635 1HB ALA 899 2HB ALA 899 -4.135 10.955 3.962 636 2HB ALA 899 3HB ALA 899 -2.740 11.798 4.633 637 3HB ALA 899 1HB ALA 899 -2.535 10.216 3.883 638 HA ARG 900 HA ARG 900 -3.866 5.773 4.993 639 1HB ARG 900 1HB ARG 900 -4.703 6.933 7.391 640 2HB ARG 900 2HB ARG 900 -4.964 5.254 6.936 641 1HG ARG 900 1HG ARG 900 -6.902 7.412 6.098 642 2HG ARG 900 2HG ARG 900 -7.167 5.672 6.194 643 1HD ARG 900 1HD ARG 900 -6.651 5.986 8.747 644 2HD ARG 900 2HD ARG 900 -7.053 7.685 8.430 645 HE ARG 900 HE ARG 900 -9.299 7.031 8.091 646 1HH1 ARG 900 1HH1 ARG 900 -9.485 5.265 5.973 647 2HH1 ARG 900 2HH1 ARG 900 -9.715 3.690 6.657 648 1HH2 ARG 900 1HH2 ARG 900 -8.588 4.602 9.807 649 2HH2 ARG 900 2HH2 ARG 900 -9.207 3.314 8.827 650 HA LYS 901 HA LYS 901 -7.134 7.610 2.508 651 1HB LYS 901 1HB LYS 901 -6.607 9.507 0.914 652 2HB LYS 901 2HB LYS 901 -6.430 9.929 2.613 653 1HG LYS 901 1HG LYS 901 -3.956 9.365 2.373 654 2HG LYS 901 2HG LYS 901 -4.229 9.280 0.637 655 1HD LYS 901 1HD LYS 901 -4.940 11.688 2.328 656 2HD LYS 901 2HD LYS 901 -3.420 11.528 1.449 657 1HE LYS 901 1HE LYS 901 -5.525 10.899 -0.380 658 2HE LYS 901 2HE LYS 901 -4.455 12.315 -0.404 659 1HZ LYS 901 1HZ LYS 901 -5.930 13.255 1.376 660 2HZ LYS 901 2HZ LYS 901 -6.668 13.114 -0.144 661 3HZ LYS 901 3HZ LYS 901 -7.014 11.982 1.075 662 HA ILE 902 HA ILE 902 -2.937 6.359 -0.586 663 HB ILE 902 HB ILE 902 -4.435 4.205 0.934 664 1HG1 ILE 902 1HG1 ILE 902 -1.858 5.677 1.314 665 2HG1 ILE 902 2HG1 ILE 902 -1.913 3.969 1.755 666 1HG2 ILE 902 1HG2 ILE 902 -2.971 4.040 -1.496 667 2HG2 ILE 902 2HG2 ILE 902 -1.934 3.374 -0.236 668 3HG2 ILE 902 3HG2 ILE 902 -3.544 2.706 -0.497 669 1HD1 ILE 902 1HD1 ILE 902 -4.290 5.107 2.767 670 2HD1 ILE 902 2HD1 ILE 902 -2.886 4.573 3.693 671 3HD1 ILE 902 3HD1 ILE 902 -3.004 6.249 3.159 672 HA PRO 903 HA PRO 903 -7.163 5.912 -2.779 673 1HB PRO 903 1HB PRO 903 -6.694 8.309 -4.296 674 2HB PRO 903 2HB PRO 903 -7.967 8.007 -3.111 675 1HG PRO 903 1HG PRO 903 -5.779 9.773 -2.824 676 2HG PRO 903 2HG PRO 903 -6.924 9.302 -1.568 677 1HD PRO 903 1HD PRO 903 -5.185 8.287 -0.502 678 2HD PRO 903 2HD PRO 903 -4.122 8.467 -1.912 679 HA ILE 904 HA ILE 904 -4.973 4.822 -6.415 680 HB ILE 904 HB ILE 904 -2.953 5.315 -4.417 681 1HG1 ILE 904 1HG1 ILE 904 -2.362 5.632 -7.293 682 2HG1 ILE 904 2HG1 ILE 904 -3.846 6.409 -6.746 683 1HG2 ILE 904 1HG2 ILE 904 -2.352 3.268 -6.555 684 2HG2 ILE 904 2HG2 ILE 904 -1.098 4.259 -5.815 685 3HG2 ILE 904 3HG2 ILE 904 -2.047 3.151 -4.825 686 1HD1 ILE 904 1HD1 ILE 904 -1.450 6.766 -5.021 687 2HD1 ILE 904 2HD1 ILE 904 -1.445 7.613 -6.569 688 3HD1 ILE 904 3HD1 ILE 904 -2.739 7.906 -5.407 689 HA ILE 905 HA ILE 905 -5.081 0.443 -6.531 690 HB ILE 905 HB ILE 905 -6.142 1.377 -8.582 691 1HG1 ILE 905 1HG1 ILE 905 -4.719 -0.726 -9.940 692 2HG1 ILE 905 2HG1 ILE 905 -4.970 -1.185 -8.255 693 1HG2 ILE 905 1HG2 ILE 905 -3.281 1.374 -9.566 694 2HG2 ILE 905 2HG2 ILE 905 -4.661 1.416 -10.662 695 3HG2 ILE 905 3HG2 ILE 905 -4.409 2.728 -9.514 696 1HD1 ILE 905 1HD1 ILE 905 -7.198 -0.027 -9.921 697 2HD1 ILE 905 2HD1 ILE 905 -6.855 -1.756 -9.908 698 3HD1 ILE 905 3HD1 ILE 905 -7.318 -0.937 -8.416 699 HA ILE 906 HA ILE 906 -0.794 -0.636 -7.532 700 HB ILE 906 HB ILE 906 -1.982 -1.703 -4.996 701 1HG1 ILE 906 1HG1 ILE 906 0.434 -0.064 -5.758 702 2HG1 ILE 906 2HG1 ILE 906 0.072 -0.530 -4.098 703 1HG2 ILE 906 1HG2 ILE 906 0.418 -2.869 -6.354 704 2HG2 ILE 906 2HG2 ILE 906 0.499 -2.611 -4.613 705 3HG2 ILE 906 3HG2 ILE 906 -0.756 -3.647 -5.293 706 1HD1 ILE 906 1HD1 ILE 906 -2.336 0.500 -4.968 707 2HD1 ILE 906 2HD1 ILE 906 -1.139 1.388 -4.025 708 3HD1 ILE 906 3HD1 ILE 906 -1.165 1.536 -5.781 709 HA ARG 907 HA ARG 907 -1.560 -4.603 -9.396 710 1HB ARG 907 1HB ARG 907 0.960 -3.395 -10.438 711 2HB ARG 907 2HB ARG 907 0.459 -4.991 -10.986 712 1HG ARG 907 1HG ARG 907 -0.472 -3.310 -12.476 713 2HG ARG 907 2HG ARG 907 -1.764 -4.066 -11.548 714 1HD ARG 907 1HD ARG 907 -2.253 -2.134 -10.397 715 2HD ARG 907 2HD ARG 907 -0.556 -1.617 -10.349 716 HE ARG 907 HE ARG 907 -0.864 -0.559 -12.449 717 1HH1 ARG 907 1HH1 ARG 907 -2.027 -3.010 -13.799 718 2HH1 ARG 907 2HH1 ARG 907 -3.605 -2.446 -14.239 719 1HH2 ARG 907 1HH2 ARG 907 -3.505 0.295 -12.118 720 2HH2 ARG 907 2HH2 ARG 907 -4.442 -0.574 -13.287 721 HA ARG 908 HA ARG 908 0.995 -6.947 -6.598 722 1HB ARG 908 1HB ARG 908 -1.899 -7.821 -6.633 723 2HB ARG 908 2HB ARG 908 -0.700 -8.767 -5.763 724 1HG ARG 908 1HG ARG 908 -0.106 -6.626 -4.509 725 2HG ARG 908 2HG ARG 908 -1.536 -5.900 -5.244 726 1HD ARG 908 1HD ARG 908 -2.495 -8.341 -4.219 727 2HD ARG 908 2HD ARG 908 -2.706 -6.760 -3.435 728 HE ARG 908 HE ARG 908 -0.085 -7.662 -2.821 729 1HH1 ARG 908 1HH1 ARG 908 -3.176 -7.534 -1.570 730 2HH1 ARG 908 2HH1 ARG 908 -2.957 -8.800 -0.406 731 1HH2 ARG 908 1HH2 ARG 908 0.133 -9.768 -1.645 732 2HH2 ARG 908 2HH2 ARG 908 -1.085 -10.063 -0.450 733 HA TYR 909 HA TYR 909 1.176 -9.918 -10.072 734 1HB TYR 909 1HB TYR 909 4.079 -9.209 -10.015 735 2HB TYR 909 2HB TYR 909 3.112 -9.763 -11.361 736 HD1 TYR 909 HD1 TYR 909 4.077 -6.806 -9.354 737 HD2 TYR 909 HD2 TYR 909 1.793 -8.234 -12.683 738 HE1 TYR 909 HE1 TYR 909 3.901 -4.514 -10.198 739 HE2 TYR 909 HE2 TYR 909 1.599 -5.939 -13.529 740 HH TYR 909 HH TYR 909 1.720 -3.653 -12.714 741 HA LEU 910 HA LEU 910 3.771 -12.546 -7.487 742 1HB LEU 910 1HB LEU 910 2.158 -14.136 -9.482 743 2HB LEU 910 2HB LEU 910 2.780 -14.802 -7.971 744 HG LEU 910 HG LEU 910 0.819 -12.511 -8.285 745 1HD1 LEU 910 1HD1 LEU 910 0.545 -15.372 -8.044 746 2HD1 LEU 910 2HD1 LEU 910 -0.152 -14.589 -6.635 747 3HD1 LEU 910 3HD1 LEU 910 -0.714 -14.153 -8.246 748 1HD2 LEU 910 1HD2 LEU 910 2.625 -13.169 -6.128 749 2HD2 LEU 910 2HD2 LEU 910 1.466 -11.845 -6.234 750 3HD2 LEU 910 3HD2 LEU 910 0.960 -13.411 -5.604 751 HA PRO 911 HA PRO 911 7.457 -13.414 -9.929 752 1HB PRO 911 1HB PRO 911 8.664 -14.297 -7.469 753 2HB PRO 911 2HB PRO 911 8.956 -12.780 -8.325 754 1HG PRO 911 1HG PRO 911 7.859 -11.651 -6.694 755 2HG PRO 911 2HG PRO 911 7.547 -13.169 -5.850 756 1HD PRO 911 1HD PRO 911 5.345 -13.042 -6.441 757 2HD PRO 911 2HD PRO 911 5.666 -11.531 -7.318 758 HA ASP 912 HA ASP 912 6.669 -17.870 -8.212 759 1HB ASP 912 1HB ASP 912 4.139 -16.656 -7.225 760 2HB ASP 912 2HB ASP 912 4.048 -18.358 -7.680 761 1HA GLY 913 1HA GLY 913 4.397 -16.735 -12.497 762 2HA GLY 913 2HA GLY 913 3.937 -18.327 -11.895 763 HA SER 914 HA SER 914 0.246 -15.359 -12.453 764 1HB SER 914 1HB SER 914 0.690 -16.194 -9.655 765 2HB SER 914 2HB SER 914 -0.691 -15.132 -9.906 766 HG SER 914 HG SER 914 -0.231 -17.730 -10.768 767 HA TYR 915 HA TYR 915 0.193 -11.372 -9.895 768 1HB TYR 915 1HB TYR 915 1.345 -10.728 -11.770 769 2HB TYR 915 2HB TYR 915 0.344 -11.718 -12.823 770 HD1 TYR 915 HD1 TYR 915 0.093 -8.554 -10.788 771 HD2 TYR 915 HD2 TYR 915 -1.009 -10.647 -14.374 772 HE1 TYR 915 HE1 TYR 915 -1.040 -6.519 -11.627 773 HE2 TYR 915 HE2 TYR 915 -2.141 -8.608 -15.213 774 HH TYR 915 HH TYR 915 -1.621 -5.713 -14.301 775 HA GLU 916 HA GLU 916 -4.006 -9.643 -10.814 776 1HB GLU 916 1HB GLU 916 -3.392 -10.845 -8.368 777 2HB GLU 916 2HB GLU 916 -4.127 -9.297 -7.940 778 1HG GLU 916 1HG GLU 916 -5.411 -10.922 -10.095 779 2HG GLU 916 2HG GLU 916 -5.647 -11.417 -8.419 780 HA ASP 917 HA ASP 917 -3.280 -5.340 -9.827 781 1HB ASP 917 1HB ASP 917 -3.519 -5.525 -12.233 782 2HB ASP 917 2HB ASP 917 -4.332 -4.083 -11.662 783 HA TRP 918 HA TRP 918 -6.514 -2.559 -8.326 784 1HB TRP 918 1HB TRP 918 -7.858 -3.885 -6.706 785 2HB TRP 918 2HB TRP 918 -7.894 -4.499 -8.339 786 HD1 TRP 918 HD1 TRP 918 -4.707 -5.790 -7.250 787 HE1 TRP 918 HE1 TRP 918 -4.979 -8.213 -6.375 788 HE3 TRP 918 HE3 TRP 918 -9.634 -5.709 -6.370 789 HZ2 TRP 918 HZ2 TRP 918 -7.137 -9.845 -5.264 790 HZ3 TRP 918 HZ3 TRP 918 -10.805 -7.572 -5.328 791 HH2 TRP 918 HH2 TRP 918 -9.582 -9.687 -4.778 792 1HA GLY 919 1HA GLY 919 -4.780 -2.636 -4.075 793 2HA GLY 919 2HA GLY 919 -4.578 -1.049 -4.801 794 HA VAL 920 HA VAL 920 -7.796 -0.042 -1.981 795 HB VAL 920 HB VAL 920 -6.700 2.525 -3.183 796 1HG1 VAL 920 1HG1 VAL 920 -8.350 1.923 -0.733 797 2HG1 VAL 920 2HG1 VAL 920 -7.260 3.310 -0.756 798 3HG1 VAL 920 3HG1 VAL 920 -8.574 3.201 -1.928 799 1HG2 VAL 920 1HG2 VAL 920 -5.729 0.541 -1.178 800 2HG2 VAL 920 2HG2 VAL 920 -4.819 1.509 -2.335 801 3HG2 VAL 920 3HG2 VAL 920 -5.414 2.245 -0.852 802 HA ASP 921 HA ASP 921 -10.614 1.781 -5.182 803 1HB ASP 921 1HB ASP 921 -8.575 1.552 -7.043 804 2HB ASP 921 2HB ASP 921 -9.830 0.510 -7.719 805 HA GLU 922 HA GLU 922 -12.204 -2.460 -5.396 806 1HB GLU 922 1HB GLU 922 -10.253 -2.795 -7.128 807 2HB GLU 922 2HB GLU 922 -9.673 -3.967 -5.947 808 1HG GLU 922 1HG GLU 922 -11.553 -5.350 -6.197 809 2HG GLU 922 2HG GLU 922 -12.552 -4.037 -6.819 810 HA LEU 923 HA LEU 923 -10.563 -3.852 -1.349 811 1HB LEU 923 1HB LEU 923 -8.260 -5.028 -1.150 812 2HB LEU 923 2HB LEU 923 -9.340 -5.512 -2.440 813 HG LEU 923 HG LEU 923 -7.833 -3.355 -3.471 814 1HD1 LEU 923 3HD1 LEU 923 -6.182 -3.781 -1.681 815 2HD1 LEU 923 1HD1 LEU 923 -6.085 -5.464 -2.189 816 3HD1 LEU 923 2HD1 LEU 923 -5.549 -4.179 -3.273 817 1HD2 LEU 923 1HD2 LEU 923 -8.346 -6.184 -3.875 818 2HD2 LEU 923 2HD2 LEU 923 -8.257 -4.857 -5.031 819 3HD2 LEU 923 3HD2 LEU 923 -6.778 -5.649 -4.484 820 HA ILE 924 HA ILE 924 -8.262 -1.605 1.638 821 HB ILE 924 HB ILE 924 -7.087 -4.276 1.784 822 1HG1 ILE 924 1HG1 ILE 924 -7.744 -3.715 4.231 823 2HG1 ILE 924 2HG1 ILE 924 -8.483 -2.288 3.510 824 1HG2 ILE 924 1HG2 ILE 924 -4.990 -2.953 2.036 825 2HG2 ILE 924 2HG2 ILE 924 -5.741 -2.099 3.383 826 3HG2 ILE 924 3HG2 ILE 924 -5.444 -3.830 3.491 827 1HD1 ILE 924 3HD1 ILE 924 -8.966 -5.104 2.534 828 2HD1 ILE 924 1HD1 ILE 924 -10.044 -4.242 3.631 829 3HD1 ILE 924 2HD1 ILE 924 -9.782 -3.638 1.994 830 HA ILE 925 HA ILE 925 -4.556 0.434 0.360 831 HB ILE 925 HB ILE 925 -4.282 2.285 2.012 832 1HG1 ILE 925 1HG1 ILE 925 -6.524 1.261 3.670 833 2HG1 ILE 925 2HG1 ILE 925 -4.981 0.440 3.887 834 1HG2 ILE 925 1HG2 ILE 925 -6.778 1.483 0.725 835 2HG2 ILE 925 2HG2 ILE 925 -7.061 2.512 2.129 836 3HG2 ILE 925 3HG2 ILE 925 -6.027 3.076 0.817 837 1HD1 ILE 925 2HD1 ILE 925 -4.119 2.997 3.900 838 2HD1 ILE 925 3HD1 ILE 925 -5.745 3.237 4.541 839 3HD1 ILE 925 1HD1 ILE 925 -4.621 2.155 5.366 840 HA THR 926 HA THR 926 -0.960 -0.663 2.903 841 HB THR 926 HB THR 926 -1.742 0.824 5.403 842 HG1 THR 926 HG1 THR 926 -0.780 2.671 4.328 843 1HG2 THR 926 1HG2 THR 926 0.781 -0.029 4.040 844 2HG2 THR 926 2HG2 THR 926 0.814 1.407 5.063 845 3HG2 THR 926 3HG2 THR 926 0.333 -0.148 5.741 846 HA ASP 927 HA ASP 927 -3.925 -3.385 5.404 847 1HB ASP 927 1HB ASP 927 -3.210 -3.351 7.810 848 2HB ASP 927 2HB ASP 927 -1.895 -2.956 6.707 No H/Q in entry = 848 Start of MODEL 18 1 HA MET 801 HA MET 801 42.338 -21.980 23.782 2 1HB MET 801 1HB MET 801 45.191 -22.036 23.881 3 2HB MET 801 2HB MET 801 44.733 -21.222 22.384 4 1HG MET 801 1HG MET 801 43.372 -20.515 24.975 5 2HG MET 801 2HG MET 801 44.931 -19.801 24.561 6 1HE MET 801 1HE MET 801 44.372 -17.768 24.710 7 2HE MET 801 2HE MET 801 44.779 -17.264 23.072 8 3HE MET 801 3HE MET 801 43.237 -16.783 23.792 9 HA SER 802 HA SER 802 42.003 -23.483 19.496 10 1HB SER 802 1HB SER 802 39.687 -24.357 21.139 11 2HB SER 802 2HB SER 802 39.389 -24.200 19.409 12 HG SER 802 HG SER 802 40.182 -26.281 20.015 13 HA ASP 803 HA ASP 803 39.414 -19.663 19.035 14 1HB ASP 803 1HB ASP 803 41.400 -18.832 21.070 15 2HB ASP 803 2HB ASP 803 40.814 -17.543 20.018 16 HA ASN 804 HA ASN 804 42.385 -18.190 15.946 17 1HB ASN 804 1HB ASN 804 42.071 -20.818 15.642 18 2HB ASN 804 2HB ASN 804 41.160 -20.311 14.220 19 2HD2 ASN 804 1HD2 ASN 804 42.608 -20.665 12.504 20 1HD2 ASN 804 2HD2 ASN 804 44.188 -20.048 12.445 21 HA GLU 805 HA GLU 805 39.542 -16.055 13.287 22 1HB GLU 805 1HB GLU 805 41.774 -14.989 12.980 23 2HB GLU 805 2HB GLU 805 42.058 -16.032 11.587 24 1HG GLU 805 1HG GLU 805 39.825 -15.085 10.678 25 2HG GLU 805 2HG GLU 805 40.033 -13.819 11.889 26 HA ASP 806 HA ASP 806 38.443 -18.934 10.032 27 1HB ASP 806 1HB ASP 806 36.208 -17.921 11.692 28 2HB ASP 806 2HB ASP 806 35.737 -18.569 10.121 29 HA ASN 807 HA ASN 807 37.814 -15.451 7.145 30 1HB ASN 807 1HB ASN 807 40.405 -16.156 7.204 31 2HB ASN 807 2HB ASN 807 39.974 -16.888 5.659 32 2HD2 ASN 807 1HD2 ASN 807 40.555 -13.856 7.293 33 1HD2 ASN 807 2HD2 ASN 807 40.281 -12.852 5.953 34 HA PHE 808 HA PHE 808 36.343 -18.482 4.010 35 1HB PHE 808 1HB PHE 808 35.493 -16.162 3.652 36 2HB PHE 808 2HB PHE 808 36.705 -15.941 2.389 37 HD1 PHE 808 HD1 PHE 808 34.294 -18.666 3.336 38 HD2 PHE 808 HD2 PHE 808 35.831 -16.113 0.242 39 HE1 PHE 808 HE1 PHE 808 32.784 -19.748 1.693 40 HE2 PHE 808 HE2 PHE 808 34.320 -17.194 -1.400 41 HZ PHE 808 HZ PHE 808 32.797 -19.012 -0.675 42 HA ASP 809 HA ASP 809 39.645 -19.169 0.876 43 1HB ASP 809 1HB ASP 809 38.389 -16.819 -0.482 44 2HB ASP 809 2HB ASP 809 39.710 -17.638 -1.316 45 1HA GLY 810 1HA GLY 810 43.069 -16.637 3.035 46 2HA GLY 810 2HA GLY 810 43.142 -16.295 1.306 47 HA ASP 811 HA ASP 811 42.574 -12.155 2.901 48 1HB ASP 811 1HB ASP 811 44.342 -12.057 0.433 49 2HB ASP 811 2HB ASP 811 44.090 -10.708 1.542 50 HA ASP 812 HA ASP 812 39.695 -11.265 -0.573 51 1HB ASP 812 1HB ASP 812 37.666 -12.700 -0.676 52 2HB ASP 812 2HB ASP 812 39.146 -13.658 -0.651 53 HA PHE 813 HA PHE 813 37.187 -9.012 2.432 54 1HB PHE 813 1HB PHE 813 38.925 -10.364 4.199 55 2HB PHE 813 2HB PHE 813 38.923 -8.686 4.738 56 HD1 PHE 813 HD1 PHE 813 36.684 -7.530 5.128 57 HD2 PHE 813 HD2 PHE 813 37.062 -11.775 4.593 58 HE1 PHE 813 HE1 PHE 813 34.444 -7.856 6.142 59 HE2 PHE 813 HE2 PHE 813 34.822 -12.102 5.609 60 HZ PHE 813 HZ PHE 813 33.515 -10.143 6.383 61 HA ASP 814 HA ASP 814 39.557 -5.208 1.954 62 1HB ASP 814 1HB ASP 814 41.675 -6.478 2.286 63 2HB ASP 814 2HB ASP 814 41.794 -6.696 0.539 64 HA ASP 815 HA ASP 815 38.623 -4.436 -2.364 65 1HB ASP 815 1HB ASP 815 37.256 -7.099 -2.087 66 2HB ASP 815 2HB ASP 815 36.975 -6.133 -3.537 67 HA VAL 816 HA VAL 816 35.633 -1.175 -1.023 68 HB VAL 816 HB VAL 816 34.389 -3.145 -2.964 69 1HG1 VAL 816 1HG1 VAL 816 32.858 -1.467 -1.951 70 2HG1 VAL 816 2HG1 VAL 816 33.921 -0.182 -2.526 71 3HG1 VAL 816 3HG1 VAL 816 33.074 -1.210 -3.683 72 1HG2 VAL 816 1HG2 VAL 816 36.386 -0.917 -3.328 73 2HG2 VAL 816 2HG2 VAL 816 36.403 -2.538 -4.024 74 3HG2 VAL 816 3HG2 VAL 816 35.268 -1.331 -4.628 75 HA GLU 817 HA GLU 817 32.966 -3.698 1.565 76 1HB GLU 817 1HB GLU 817 35.192 -2.931 2.854 77 2HB GLU 817 2HB GLU 817 34.035 -1.897 3.693 78 1HG GLU 817 1HG GLU 817 32.611 -4.030 3.973 79 2HG GLU 817 2HG GLU 817 34.062 -3.893 4.968 80 HA GLU 818 HA GLU 818 30.507 0.522 0.288 81 1HB GLU 818 1HB GLU 818 29.681 -1.934 1.313 82 2HB GLU 818 2HB GLU 818 29.136 -0.778 2.528 83 1HG GLU 818 1HG GLU 818 27.657 0.242 1.095 84 2HG GLU 818 2HG GLU 818 28.667 -0.050 -0.322 85 HA ASP 819 HA ASP 819 30.968 2.624 4.276 86 1HB ASP 819 1HB ASP 819 32.222 3.716 2.386 87 2HB ASP 819 2HB ASP 819 30.793 4.700 2.070 88 HA GLU 820 HA GLU 820 27.268 3.677 6.630 89 1HB GLU 820 1HB GLU 820 28.561 5.801 6.046 90 2HB GLU 820 2HB GLU 820 27.583 5.885 4.580 91 1HG GLU 820 1HG GLU 820 25.604 5.541 6.357 92 2HG GLU 820 2HG GLU 820 26.237 7.140 5.963 93 1HA GLY 821 1HA GLY 821 24.879 2.716 2.734 94 2HA GLY 821 2HA GLY 821 25.660 1.135 2.643 95 HA LEU 822 HA LEU 822 22.508 0.512 5.982 96 1HB LEU 822 1HB LEU 822 23.188 3.115 6.968 97 2HB LEU 822 2HB LEU 822 21.452 2.890 7.184 98 HG LEU 822 HG LEU 822 23.048 0.519 7.890 99 1HD1 LEU 822 1HD1 LEU 822 24.385 2.693 8.591 100 2HD1 LEU 822 2HD1 LEU 822 23.171 2.769 9.867 101 3HD1 LEU 822 3HD1 LEU 822 24.210 1.352 9.722 102 1HD2 LEU 822 1HD2 LEU 822 20.829 2.168 9.113 103 2HD2 LEU 822 2HD2 LEU 822 20.736 0.534 8.454 104 3HD2 LEU 822 3HD2 LEU 822 21.573 0.824 9.979 105 HA ASP 823 HA ASP 823 18.806 2.987 4.138 106 1HB ASP 823 1HB ASP 823 20.124 5.036 3.490 107 2HB ASP 823 2HB ASP 823 20.549 4.223 1.982 108 HA ASP 824 HA ASP 824 19.343 0.206 0.448 109 1HB ASP 824 1HB ASP 824 22.304 0.688 0.501 110 2HB ASP 824 2HB ASP 824 21.679 -0.617 -0.507 111 HA LEU 825 HA LEU 825 19.970 -3.484 2.883 112 1HB LEU 825 1HB LEU 825 22.140 -2.020 3.643 113 2HB LEU 825 2HB LEU 825 21.456 -2.411 5.219 114 HG LEU 825 HG LEU 825 23.064 -4.138 4.530 115 1HD1 LEU 825 1HD1 LEU 825 21.036 -4.771 5.843 116 2HD1 LEU 825 2HD1 LEU 825 20.213 -5.152 4.331 117 3HD1 LEU 825 3HD1 LEU 825 21.625 -6.085 4.825 118 1HD2 LEU 825 1HD2 LEU 825 22.395 -3.665 2.008 119 2HD2 LEU 825 2HD2 LEU 825 22.977 -5.257 2.494 120 3HD2 LEU 825 3HD2 LEU 825 21.248 -4.973 2.293 121 HA GLU 826 HA GLU 826 17.111 -2.217 6.347 122 1HB GLU 826 1HB GLU 826 16.180 -0.684 4.370 123 2HB GLU 826 2HB GLU 826 14.969 -1.962 4.269 124 1HG GLU 826 1HG GLU 826 14.068 -1.463 6.323 125 2HG GLU 826 2HG GLU 826 15.614 -0.937 6.989 126 HA ASN 827 HA ASN 827 15.108 -6.195 5.777 127 1HB ASN 827 1HB ASN 827 17.581 -6.635 6.079 128 2HB ASN 827 2HB ASN 827 17.297 -6.679 7.819 129 2HD2 ASN 827 1HD2 ASN 827 17.941 -8.837 5.594 130 1HD2 ASN 827 2HD2 ASN 827 16.851 -10.082 5.969 131 HA ALA 828 HA ALA 828 13.113 -5.079 9.875 132 1HB ALA 828 1HB ALA 828 11.361 -4.515 7.522 133 2HB ALA 828 2HB ALA 828 10.567 -4.859 9.058 134 3HB ALA 828 3HB ALA 828 11.697 -3.511 8.932 135 HA GLU 829 HA GLU 829 11.116 -9.183 9.377 136 1HB GLU 829 1HB GLU 829 8.794 -7.968 7.846 137 2HB GLU 829 2HB GLU 829 8.713 -9.501 8.714 138 1HG GLU 829 1HG GLU 829 9.833 -7.624 10.518 139 2HG GLU 829 2HG GLU 829 8.457 -6.825 9.759 140 HA GLU 830 HA GLU 830 13.612 -10.097 5.279 141 1HB GLU 830 1HB GLU 830 12.445 -11.829 6.990 142 2HB GLU 830 2HB GLU 830 11.370 -12.034 5.607 143 1HG GLU 830 1HG GLU 830 13.002 -12.975 4.300 144 2HG GLU 830 2HG GLU 830 14.284 -11.999 5.018 145 HA GLU 831 HA GLU 831 9.530 -7.458 3.570 146 1HB GLU 831 1HB GLU 831 12.035 -8.059 2.482 147 2HB GLU 831 2HB GLU 831 10.897 -8.840 1.384 148 1HG GLU 831 1HG GLU 831 10.128 -6.114 2.235 149 2HG GLU 831 2HG GLU 831 11.583 -6.200 1.241 150 1HA GLY 832 1HA GLY 832 7.244 -11.089 2.374 151 2HA GLY 832 2HA GLY 832 6.299 -9.895 1.483 152 HA GLN 833 HA GLN 833 8.015 -11.163 -2.413 153 1HB GLN 833 1HB GLN 833 8.321 -13.183 -1.013 154 2HB GLN 833 2HB GLN 833 6.631 -13.619 -1.286 155 1HG GLN 833 1HG GLN 833 7.029 -13.777 -3.695 156 2HG GLN 833 2HG GLN 833 8.704 -13.270 -3.469 157 2HE2 GLN 833 1HE2 GLN 833 7.458 -15.937 -4.430 158 1HE2 GLN 833 2HE2 GLN 833 8.212 -17.109 -3.461 159 HA GLU 834 HA GLU 834 4.491 -11.201 -5.076 160 1HB GLU 834 1HB GLU 834 3.771 -10.014 -2.651 161 2HB GLU 834 2HB GLU 834 3.348 -8.790 -3.849 162 1HG GLU 834 1HG GLU 834 1.958 -10.335 -5.056 163 2HG GLU 834 2HG GLU 834 2.540 -11.695 -4.094 164 HA ASN 835 HA ASN 835 6.578 -8.018 -7.506 165 1HB ASN 835 1HB ASN 835 4.638 -9.032 -9.578 166 2HB ASN 835 2HB ASN 835 6.242 -8.365 -9.810 167 2HD2 ASN 835 1HD2 ASN 835 5.099 -11.066 -10.672 168 1HD2 ASN 835 2HD2 ASN 835 6.190 -12.203 -10.043 169 HA VAL 836 HA VAL 836 2.923 -5.567 -7.326 170 HB VAL 836 HB VAL 836 3.939 -5.645 -5.115 171 1HG1 VAL 836 1HG1 VAL 836 5.925 -3.849 -6.442 172 2HG1 VAL 836 2HG1 VAL 836 5.647 -3.676 -4.717 173 3HG1 VAL 836 3HG1 VAL 836 6.193 -5.217 -5.369 174 1HG2 VAL 836 1HG2 VAL 836 3.258 -2.845 -6.034 175 2HG2 VAL 836 2HG2 VAL 836 2.210 -3.994 -5.201 176 3HG2 VAL 836 3HG2 VAL 836 3.561 -3.251 -4.345 177 HA GLU 837 HA GLU 837 4.225 -2.093 -9.839 178 1HB GLU 837 1HB GLU 837 2.205 -3.787 -11.073 179 2HB GLU 837 2HB GLU 837 1.931 -2.094 -11.459 180 1HG GLU 837 1HG GLU 837 4.629 -2.250 -11.793 181 2HG GLU 837 2HG GLU 837 4.149 -3.879 -12.270 182 HA ILE 838 HA ILE 838 0.815 0.438 -8.326 183 HB ILE 838 HB ILE 838 3.501 1.803 -8.494 184 1HG1 ILE 838 1HG1 ILE 838 2.448 -0.257 -6.899 185 2HG1 ILE 838 2HG1 ILE 838 3.964 0.596 -6.650 186 1HG2 ILE 838 1HG2 ILE 838 1.017 2.825 -7.121 187 2HG2 ILE 838 2HG2 ILE 838 2.643 3.372 -6.717 188 3HG2 ILE 838 3HG2 ILE 838 1.996 3.649 -8.334 189 1HD1 ILE 838 1HD1 ILE 838 1.326 1.650 -5.604 190 2HD1 ILE 838 2HD1 ILE 838 2.357 0.572 -4.664 191 3HD1 ILE 838 3HD1 ILE 838 2.952 2.154 -5.158 192 HA LEU 839 HA LEU 839 -0.105 3.974 -11.046 193 1HB LEU 839 1HB LEU 839 -1.440 1.354 -11.444 194 2HB LEU 839 2HB LEU 839 -2.292 2.735 -12.134 195 HG LEU 839 HG LEU 839 0.336 3.219 -12.860 196 1HD1 LEU 839 1HD1 LEU 839 0.410 0.613 -12.039 197 2HD1 LEU 839 2HD1 LEU 839 0.011 0.417 -13.745 198 3HD1 LEU 839 3HD1 LEU 839 1.471 1.286 -13.277 199 1HD2 LEU 839 1HD2 LEU 839 -1.852 3.332 -14.188 200 2HD2 LEU 839 2HD2 LEU 839 -0.433 2.797 -15.087 201 3HD2 LEU 839 3HD2 LEU 839 -1.619 1.617 -14.527 202 HA PRO 840 HA PRO 840 -3.376 6.220 -9.106 203 1HB PRO 840 1HB PRO 840 -3.918 7.725 -10.704 204 2HB PRO 840 2HB PRO 840 -5.038 6.565 -11.424 205 1HG PRO 840 1HG PRO 840 -2.526 7.456 -12.473 206 2HG PRO 840 2HG PRO 840 -3.608 6.240 -13.159 207 1HD PRO 840 1HD PRO 840 -2.069 4.635 -12.645 208 2HD PRO 840 2HD PRO 840 -1.046 5.843 -11.829 209 HA SER 841 HA SER 841 -6.254 2.961 -8.166 210 1HB SER 841 1HB SER 841 -7.012 3.733 -6.185 211 2HB SER 841 2HB SER 841 -6.631 5.383 -6.657 212 HG SER 841 HG SER 841 -9.007 3.913 -7.148 213 1HA GLY 842 1HA GLY 842 -10.227 3.248 -10.274 214 2HA GLY 842 2HA GLY 842 -9.012 3.542 -11.515 215 HA GLU 843 HA GLU 843 -7.571 -1.121 -11.912 216 1HB GLU 843 1HB GLU 843 -9.737 -0.801 -10.276 217 2HB GLU 843 2HB GLU 843 -10.527 -1.319 -11.765 218 1HG GLU 843 1HG GLU 843 -8.243 -2.976 -11.435 219 2HG GLU 843 2HG GLU 843 -9.052 -2.908 -9.869 220 HA ARG 844 HA ARG 844 -8.515 0.370 -16.137 221 1HB ARG 844 1HB ARG 844 -6.106 -0.262 -16.151 222 2HB ARG 844 2HB ARG 844 -6.582 -1.956 -16.270 223 1HG ARG 844 1HG ARG 844 -7.040 -1.784 -18.481 224 2HG ARG 844 2HG ARG 844 -7.903 -0.262 -18.266 225 1HD ARG 844 1HD ARG 844 -5.374 0.604 -17.824 226 2HD ARG 844 2HD ARG 844 -5.048 -0.726 -18.953 227 HE ARG 844 HE ARG 844 -7.225 0.578 -20.075 228 1HH1 ARG 844 1HH1 ARG 844 -6.803 3.192 -19.484 229 2HH1 ARG 844 2HH1 ARG 844 -5.438 3.731 -20.404 230 1HH2 ARG 844 1HH2 ARG 844 -4.281 0.529 -21.063 231 2HH2 ARG 844 2HH2 ARG 844 -4.012 2.224 -21.298 232 HA PRO 845 HA PRO 845 -11.786 -2.755 -16.296 233 1HB PRO 845 1HB PRO 845 -12.908 -1.282 -18.500 234 2HB PRO 845 2HB PRO 845 -13.482 -1.342 -16.831 235 1HG PRO 845 1HG PRO 845 -12.237 0.857 -18.162 236 2HG PRO 845 2HG PRO 845 -12.744 0.766 -16.473 237 1HD PRO 845 1HD PRO 845 -10.556 0.742 -15.837 238 2HD PRO 845 2HD PRO 845 -10.045 0.725 -17.543 239 HA GLN 846 HA GLN 846 -10.372 -5.124 -19.753 240 1HB GLN 846 1HB GLN 846 -9.698 -2.890 -20.597 241 2HB GLN 846 2HB GLN 846 -8.138 -3.071 -19.795 242 1HG GLN 846 1HG GLN 846 -7.330 -4.239 -21.540 243 2HG GLN 846 2HG GLN 846 -8.650 -5.401 -21.411 244 2HE2 GLN 846 1HE2 GLN 846 -8.471 -1.921 -22.389 245 1HE2 GLN 846 2HE2 GLN 846 -9.334 -2.138 -23.834 246 HA ALA 847 HA ALA 847 -6.453 -6.806 -17.920 247 1HB ALA 847 2HB ALA 847 -5.439 -4.450 -16.332 248 2HB ALA 847 1HB ALA 847 -5.318 -4.452 -18.091 249 3HB ALA 847 3HB ALA 847 -4.511 -5.707 -17.150 250 HA ASN 848 HA ASN 848 -8.041 -6.215 -13.423 251 1HB ASN 848 1HB ASN 848 -10.421 -5.709 -12.950 252 2HB ASN 848 2HB ASN 848 -9.689 -4.463 -13.962 253 2HD2 ASN 848 1HD2 ASN 848 -12.485 -6.205 -13.694 254 1HD2 ASN 848 2HD2 ASN 848 -12.952 -6.260 -15.325 255 HA GLN 849 HA GLN 849 -9.973 -10.243 -13.661 256 1HB GLN 849 1HB GLN 849 -7.617 -11.743 -13.517 257 2HB GLN 849 2HB GLN 849 -8.394 -11.179 -14.984 258 1HG GLN 849 1HG GLN 849 -7.051 -9.068 -14.823 259 2HG GLN 849 2HG GLN 849 -6.069 -10.511 -15.044 260 2HE2 GLN 849 1HE2 GLN 849 -4.957 -8.151 -13.878 261 1HE2 GLN 849 2HE2 GLN 849 -4.615 -8.459 -12.248 262 HA LYS 850 HA LYS 850 -8.017 -11.280 -9.296 263 1HB LYS 850 1HB LYS 850 -9.712 -13.014 -8.712 264 2HB LYS 850 2HB LYS 850 -10.381 -11.776 -9.774 265 1HG LYS 850 1HG LYS 850 -11.116 -13.663 -10.889 266 2HG LYS 850 2HG LYS 850 -9.544 -13.468 -11.664 267 1HD LYS 850 1HD LYS 850 -8.587 -15.222 -10.484 268 2HD LYS 850 2HD LYS 850 -9.701 -15.053 -9.128 269 1HE LYS 850 1HE LYS 850 -10.719 -15.905 -11.841 270 2HE LYS 850 2HE LYS 850 -10.046 -17.092 -10.705 271 1HZ LYS 850 1HZ LYS 850 -11.529 -16.141 -8.987 272 2HZ LYS 850 2HZ LYS 850 -12.259 -15.178 -10.181 273 3HZ LYS 850 3HZ LYS 850 -12.376 -16.871 -10.261 274 HA ARG 851 HA ARG 851 -6.123 -15.454 -9.080 275 1HB ARG 851 1HB ARG 851 -4.650 -13.005 -9.453 276 2HB ARG 851 2HB ARG 851 -3.692 -14.131 -8.491 277 1HG ARG 851 1HG ARG 851 -5.050 -14.852 -11.105 278 2HG ARG 851 2HG ARG 851 -3.351 -14.418 -10.957 279 1HD ARG 851 1HD ARG 851 -2.789 -16.431 -10.010 280 2HD ARG 851 2HD ARG 851 -4.312 -16.543 -9.109 281 HE ARG 851 HE ARG 851 -5.254 -16.836 -11.605 282 1HH1 ARG 851 1HH1 ARG 851 -2.053 -17.485 -11.643 283 2HH1 ARG 851 2HH1 ARG 851 -2.176 -19.184 -11.953 284 1HH2 ARG 851 1HH2 ARG 851 -5.590 -19.316 -11.355 285 2HH2 ARG 851 2HH2 ARG 851 -4.178 -20.221 -11.790 286 HA ILE 852 HA ILE 852 -5.360 -15.128 -4.551 287 HB ILE 852 HB ILE 852 -3.297 -16.023 -4.165 288 1HG1 ILE 852 1HG1 ILE 852 -2.337 -13.861 -3.423 289 2HG1 ILE 852 2HG1 ILE 852 -1.173 -14.805 -4.342 290 1HG2 ILE 852 1HG2 ILE 852 -3.653 -16.432 -6.571 291 2HG2 ILE 852 2HG2 ILE 852 -2.776 -14.950 -6.950 292 3HG2 ILE 852 3HG2 ILE 852 -1.937 -16.300 -6.186 293 1HD1 ILE 852 1HD1 ILE 852 -2.518 -13.292 -6.280 294 2HD1 ILE 852 2HD1 ILE 852 -2.280 -12.180 -4.933 295 3HD1 ILE 852 3HD1 ILE 852 -0.898 -12.989 -5.657 296 HA THR 853 HA THR 853 -3.447 -10.816 -3.158 297 HB THR 853 HB THR 853 -4.465 -8.768 -4.252 298 HG1 THR 853 HG1 THR 853 -5.841 -10.731 -5.502 299 1HG2 THR 853 1HG2 THR 853 -2.212 -9.743 -4.752 300 2HG2 THR 853 2HG2 THR 853 -2.947 -10.625 -6.084 301 3HG2 THR 853 3HG2 THR 853 -2.924 -8.863 -6.106 302 HA THR 854 HA THR 854 -7.082 -11.692 -0.756 303 HB THR 854 HB THR 854 -5.203 -11.747 0.860 304 HG1 THR 854 HG1 THR 854 -6.472 -11.301 2.519 305 1HG2 THR 854 1HG2 THR 854 -4.477 -9.350 -0.041 306 2HG2 THR 854 2HG2 THR 854 -5.458 -8.806 1.319 307 3HG2 THR 854 3HG2 THR 854 -4.079 -9.868 1.596 308 HA PRO 855 HA PRO 855 -9.174 -7.984 -2.169 309 1HB PRO 855 1HB PRO 855 -11.298 -8.815 -2.091 310 2HB PRO 855 2HB PRO 855 -11.333 -8.565 -0.342 311 1HG PRO 855 1HG PRO 855 -11.234 -11.055 -1.727 312 2HG PRO 855 2HG PRO 855 -11.112 -10.801 0.017 313 1HD PRO 855 1HD PRO 855 -8.936 -11.519 -0.114 314 2HD PRO 855 2HD PRO 855 -8.987 -11.502 -1.896 315 HA TYR 856 HA TYR 856 -8.053 -5.086 0.988 316 1HB TYR 856 1HB TYR 856 -8.674 -6.969 2.421 317 2HB TYR 856 2HB TYR 856 -7.100 -7.703 2.183 318 HD1 TYR 856 HD1 TYR 856 -5.029 -6.209 2.931 319 HD2 TYR 856 HD2 TYR 856 -9.064 -5.628 4.277 320 HE1 TYR 856 HE1 TYR 856 -4.192 -5.004 4.914 321 HE2 TYR 856 HE2 TYR 856 -8.226 -4.421 6.262 322 HH TYR 856 HH TYR 856 -6.063 -4.387 7.612 323 HA MET 857 HA MET 857 -3.964 -4.904 -0.997 324 1HB MET 857 1HB MET 857 -5.018 -2.665 -1.386 325 2HB MET 857 2HB MET 857 -4.552 -2.206 0.245 326 1HG MET 857 1HG MET 857 -2.215 -3.232 -0.986 327 2HG MET 857 2HG MET 857 -2.544 -1.562 -0.546 328 1HE MET 857 3HE MET 857 -4.814 -0.610 -2.125 329 2HE MET 857 1HE MET 857 -3.292 0.267 -2.059 330 3HE MET 857 2HE MET 857 -4.093 0.020 -3.609 331 HA THR 858 HA THR 858 -1.832 -4.711 2.960 332 HB THR 858 HB THR 858 -0.107 -6.470 2.744 333 HG1 THR 858 HG1 THR 858 0.695 -5.751 0.706 334 1HG2 THR 858 1HG2 THR 858 -2.636 -6.863 1.124 335 2HG2 THR 858 2HG2 THR 858 -1.652 -8.164 1.798 336 3HG2 THR 858 3HG2 THR 858 -2.486 -7.040 2.872 337 HA LYS 859 HA LYS 859 0.870 -1.393 3.618 338 1HB LYS 859 1HB LYS 859 2.717 -2.055 5.112 339 2HB LYS 859 2HB LYS 859 1.194 -2.783 5.622 340 1HG LYS 859 1HG LYS 859 1.796 -4.892 4.549 341 2HG LYS 859 2HG LYS 859 3.277 -4.176 3.913 342 1HD LYS 859 1HD LYS 859 3.407 -3.627 6.641 343 2HD LYS 859 2HD LYS 859 2.737 -5.257 6.576 344 1HE LYS 859 1HE LYS 859 4.625 -5.806 4.915 345 2HE LYS 859 2HE LYS 859 5.365 -4.279 5.436 346 1HZ LYS 859 1HZ LYS 859 5.084 -5.036 7.754 347 2HZ LYS 859 2HZ LYS 859 4.547 -6.540 7.183 348 3HZ LYS 859 3HZ LYS 859 6.137 -6.031 6.865 349 HA TYR 860 HA TYR 860 4.641 -2.859 1.085 350 1HB TYR 860 1HB TYR 860 4.503 -5.268 0.962 351 2HB TYR 860 2HB TYR 860 3.189 -5.187 -0.204 352 HD1 TYR 860 HD1 TYR 860 5.780 -2.630 -0.391 353 HD2 TYR 860 HD2 TYR 860 4.654 -6.519 -1.850 354 HE1 TYR 860 HE1 TYR 860 7.404 -2.391 -2.219 355 HE2 TYR 860 HE2 TYR 860 6.298 -6.269 -3.681 356 HH TYR 860 HH TYR 860 8.613 -4.800 -3.900 357 HA GLU 861 HA GLU 861 2.010 -2.083 -2.978 358 1HB GLU 861 1HB GLU 861 -0.407 -2.337 -1.159 359 2HB GLU 861 2HB GLU 861 -0.491 -1.545 -2.734 360 1HG GLU 861 1HG GLU 861 0.753 -3.817 -3.469 361 2HG GLU 861 2HG GLU 861 -1.004 -3.673 -3.426 362 HA ARG 862 HA ARG 862 1.064 1.841 -0.235 363 1HB ARG 862 1HB ARG 862 0.073 1.015 1.754 364 2HB ARG 862 2HB ARG 862 1.472 0.019 2.136 365 1HG ARG 862 1HG ARG 862 2.038 2.915 1.927 366 2HG ARG 862 2HG ARG 862 0.999 2.464 3.274 367 1HD ARG 862 1HD ARG 862 2.714 0.672 3.860 368 2HD ARG 862 2HD ARG 862 3.791 1.447 2.683 369 HE ARG 862 HE ARG 862 2.818 3.535 4.273 370 1HH1 ARG 862 1HH1 ARG 862 3.494 0.615 5.693 371 2HH1 ARG 862 2HH1 ARG 862 4.840 1.162 6.633 372 1HH2 ARG 862 1HH2 ARG 862 5.021 4.250 5.065 373 2HH2 ARG 862 2HH2 ARG 862 5.706 3.221 6.278 374 HA ALA 863 HA ALA 863 5.621 1.573 1.223 375 1HB ALA 863 2HB ALA 863 6.543 -1.123 0.569 376 2HB ALA 863 3HB ALA 863 6.725 -0.219 2.072 377 3HB ALA 863 1HB ALA 863 5.248 -1.131 1.767 378 HA ARG 864 HA ARG 864 6.624 0.562 -3.268 379 1HB ARG 864 1HB ARG 864 4.399 -1.202 -3.243 380 2HB ARG 864 2HB ARG 864 4.117 -0.103 -4.590 381 1HG ARG 864 1HG ARG 864 5.392 -1.970 -5.417 382 2HG ARG 864 2HG ARG 864 6.568 -1.813 -4.114 383 1HD ARG 864 1HD ARG 864 6.270 0.699 -5.579 384 2HD ARG 864 2HD ARG 864 7.736 -0.261 -5.300 385 HE ARG 864 HE ARG 864 5.756 -1.013 -7.417 386 1HH1 ARG 864 1HH1 ARG 864 8.371 -2.492 -6.460 387 2HH1 ARG 864 2HH1 ARG 864 9.402 -2.136 -7.805 388 1HH2 ARG 864 1HH2 ARG 864 7.330 0.336 -9.079 389 2HH2 ARG 864 2HH2 ARG 864 8.812 -0.535 -9.288 390 HA VAL 865 HA VAL 865 2.741 3.642 -4.144 391 HB VAL 865 HB VAL 865 2.254 2.455 -1.501 392 1HG1 VAL 865 1HG1 VAL 865 1.828 5.352 -1.945 393 2HG1 VAL 865 2HG1 VAL 865 0.644 4.437 -1.013 394 3HG1 VAL 865 3HG1 VAL 865 2.325 4.492 -0.488 395 1HG2 VAL 865 1HG2 VAL 865 0.980 2.705 -3.963 396 2HG2 VAL 865 2HG2 VAL 865 0.433 1.833 -2.531 397 3HG2 VAL 865 3HG2 VAL 865 -0.041 3.515 -2.777 398 HA LEU 866 HA LEU 866 4.862 6.365 -0.689 399 1HB LEU 866 1HB LEU 866 5.608 5.500 1.311 400 2HB LEU 866 2HB LEU 866 5.022 3.959 0.727 401 HG LEU 866 HG LEU 866 7.344 3.696 -0.388 402 1HD1 LEU 866 1HD1 LEU 866 7.947 6.141 0.032 403 2HD1 LEU 866 2HD1 LEU 866 8.105 5.718 1.734 404 3HD1 LEU 866 3HD1 LEU 866 9.158 4.967 0.537 405 1HD2 LEU 866 1HD2 LEU 866 6.378 3.192 2.274 406 2HD2 LEU 866 2HD2 LEU 866 7.507 2.236 1.313 407 3HD2 LEU 866 3HD2 LEU 866 8.106 3.534 2.344 408 1HA GLY 867 1HA GLY 867 8.872 5.050 -2.838 409 2HA GLY 867 2HA GLY 867 8.333 3.558 -3.609 410 HA THR 868 HA THR 868 6.924 5.893 -6.963 411 HB THR 868 HB THR 868 5.059 3.936 -6.760 412 HG1 THR 868 HG1 THR 868 5.165 4.142 -8.840 413 1HG2 THR 868 1HG2 THR 868 3.661 6.618 -6.971 414 2HG2 THR 868 2HG2 THR 868 2.935 5.124 -7.537 415 3HG2 THR 868 3HG2 THR 868 3.317 5.321 -5.828 416 HA ARG 869 HA ARG 869 4.209 9.161 -5.010 417 1HB ARG 869 1HB ARG 869 4.469 7.763 -2.319 418 2HB ARG 869 2HB ARG 869 3.738 9.355 -2.507 419 1HG ARG 869 1HG ARG 869 2.801 6.826 -3.893 420 2HG ARG 869 2HG ARG 869 2.014 7.580 -2.507 421 1HD ARG 869 1HD ARG 869 2.181 9.706 -4.233 422 2HD ARG 869 2HD ARG 869 0.771 8.633 -4.130 423 HE ARG 869 HE ARG 869 2.928 8.486 -6.178 424 1HH1 ARG 869 1HH1 ARG 869 1.135 6.170 -4.667 425 2HH1 ARG 869 2HH1 ARG 869 0.237 5.669 -6.060 426 1HH2 ARG 869 1HH2 ARG 869 1.302 8.313 -8.031 427 2HH2 ARG 869 2HH2 ARG 869 0.331 6.881 -7.964 428 HA ALA 870 HA ALA 870 8.117 10.115 -2.111 429 1HB ALA 870 3HB ALA 870 8.772 7.970 -1.336 430 2HB ALA 870 2HB ALA 870 10.116 8.492 -2.354 431 3HB ALA 870 1HB ALA 870 8.930 7.345 -2.978 432 HA LEU 871 HA LEU 871 10.241 10.506 -6.220 433 1HB LEU 871 1HB LEU 871 9.051 9.275 -8.504 434 2HB LEU 871 2HB LEU 871 10.620 8.931 -7.793 435 HG LEU 871 HG LEU 871 8.226 7.694 -6.509 436 1HD1 LEU 871 1HD1 LEU 871 9.215 7.150 -9.267 437 2HD1 LEU 871 2HD1 LEU 871 8.765 5.774 -8.260 438 3HD1 LEU 871 3HD1 LEU 871 7.581 7.031 -8.616 439 1HD2 LEU 871 1HD2 LEU 871 11.132 7.047 -7.002 440 2HD2 LEU 871 2HD2 LEU 871 10.288 7.189 -5.461 441 3HD2 LEU 871 3HD2 LEU 871 10.003 5.791 -6.497 442 HA GLN 872 HA GLN 872 6.205 12.092 -8.518 443 1HB GLN 872 1HB GLN 872 4.981 10.712 -6.264 444 2HB GLN 872 2HB GLN 872 4.402 12.374 -6.353 445 1HG GLN 872 1HG GLN 872 4.224 11.730 -8.964 446 2HG GLN 872 2HG GLN 872 2.908 11.427 -7.829 447 2HE2 GLN 872 1HE2 GLN 872 5.757 9.854 -9.348 448 1HE2 GLN 872 2HE2 GLN 872 5.158 8.273 -9.197 449 HA ILE 873 HA ILE 873 6.496 15.416 -4.974 450 HB ILE 873 HB ILE 873 7.429 14.765 -2.645 451 1HG1 ILE 873 1HG1 ILE 873 6.321 12.146 -2.629 452 2HG1 ILE 873 2HG1 ILE 873 7.418 12.196 -3.999 453 1HG2 ILE 873 1HG2 ILE 873 4.800 14.283 -3.909 454 2HG2 ILE 873 2HG2 ILE 873 5.009 13.744 -2.249 455 3HG2 ILE 873 3HG2 ILE 873 5.249 15.439 -2.658 456 1HD1 ILE 873 1HD1 ILE 873 8.874 13.465 -2.047 457 2HD1 ILE 873 2HD1 ILE 873 8.016 12.226 -1.137 458 3HD1 ILE 873 3HD1 ILE 873 9.035 11.773 -2.495 459 HA ALA 874 HA ALA 874 11.121 14.276 -4.283 460 1HB ALA 874 1HB ALA 874 10.720 12.058 -6.269 461 2HB ALA 874 3HB ALA 874 11.291 11.924 -4.608 462 3HB ALA 874 2HB ALA 874 12.325 12.641 -5.841 463 HA MET 875 HA MET 875 11.066 16.292 -8.452 464 1HB MET 875 1HB MET 875 8.962 14.599 -9.183 465 2HB MET 875 2HB MET 875 8.268 16.211 -9.357 466 1HG MET 875 1HG MET 875 10.623 16.683 -10.534 467 2HG MET 875 2HG MET 875 10.528 14.949 -10.843 468 1HE MET 875 1HE MET 875 10.013 18.203 -12.041 469 2HE MET 875 2HE MET 875 10.585 17.069 -13.261 470 3HE MET 875 3HE MET 875 9.077 17.960 -13.513 471 HA CYS 876 HA CYS 876 8.179 19.172 -6.095 472 1HB CYS 876 1HB CYS 876 7.430 19.603 -8.421 473 2HB CYS 876 2HB CYS 876 6.042 18.545 -8.180 474 HG CYS 876 HG CYS 876 5.028 20.260 -6.537 475 HA ALA 877 HA ALA 877 4.889 16.023 -4.488 476 1HB ALA 877 3HB ALA 877 4.843 17.964 -3.267 477 2HB ALA 877 1HB ALA 877 4.042 18.871 -4.550 478 3HB ALA 877 2HB ALA 877 3.124 17.721 -3.576 479 HA PRO 878 HA PRO 878 1.330 15.732 -7.789 480 1HB PRO 878 1HB PRO 878 2.411 13.187 -8.553 481 2HB PRO 878 2HB PRO 878 2.252 14.631 -9.557 482 1HG PRO 878 1HG PRO 878 4.504 14.822 -9.549 483 2HG PRO 878 2HG PRO 878 4.646 13.487 -8.413 484 1HD PRO 878 1HD PRO 878 5.256 14.992 -6.823 485 2HD PRO 878 2HD PRO 878 4.870 16.341 -7.911 486 HA VAL 879 HA VAL 879 1.743 11.733 -4.755 487 HB VAL 879 HB VAL 879 3.254 13.924 -3.504 488 1HG1 VAL 879 1HG1 VAL 879 1.490 13.432 -1.742 489 2HG1 VAL 879 2HG1 VAL 879 2.265 11.863 -1.576 490 3HG1 VAL 879 3HG1 VAL 879 3.169 13.335 -1.255 491 1HG2 VAL 879 1HG2 VAL 879 3.813 11.444 -4.536 492 2HG2 VAL 879 2HG2 VAL 879 4.914 12.410 -3.579 493 3HG2 VAL 879 3HG2 VAL 879 3.938 11.176 -2.804 494 HA MET 880 HA MET 880 -2.147 13.011 -3.127 495 1HB MET 880 1HB MET 880 -3.037 11.406 -1.515 496 2HB MET 880 2HB MET 880 -1.409 11.014 -0.965 497 1HG MET 880 1HG MET 880 -0.851 10.130 -3.188 498 2HG MET 880 2HG MET 880 -2.283 9.318 -2.562 499 1HE MET 880 1HE MET 880 -0.526 11.010 -5.024 500 2HE MET 880 2HE MET 880 -1.360 9.796 -6.004 501 3HE MET 880 3HE MET 880 -1.611 11.511 -6.318 502 HA VAL 881 HA VAL 881 -1.275 16.077 -0.059 503 HB VAL 881 HB VAL 881 0.609 15.832 1.649 504 1HG1 VAL 881 1HG1 VAL 881 -1.722 14.557 1.561 505 2HG1 VAL 881 2HG1 VAL 881 -0.688 13.145 1.343 506 3HG1 VAL 881 3HG1 VAL 881 -0.522 14.149 2.782 507 1HG2 VAL 881 1HG2 VAL 881 2.094 14.670 -0.129 508 2HG2 VAL 881 2HG2 VAL 881 2.132 14.039 1.518 509 3HG2 VAL 881 3HG2 VAL 881 1.189 13.211 0.277 510 HA GLU 882 HA GLU 882 2.223 18.419 -1.739 511 1HB GLU 882 1HB GLU 882 -0.450 19.715 -1.447 512 2HB GLU 882 2HB GLU 882 0.888 20.725 -1.993 513 1HG GLU 882 1HG GLU 882 1.092 19.615 -3.988 514 2HG GLU 882 2HG GLU 882 0.637 18.061 -3.288 515 HA LEU 883 HA LEU 883 3.264 20.288 2.413 516 1HB LEU 883 1HB LEU 883 4.782 18.364 2.459 517 2HB LEU 883 2HB LEU 883 5.756 19.074 1.174 518 HG LEU 883 HG LEU 883 5.642 21.106 3.059 519 1HD1 LEU 883 1HD1 LEU 883 4.673 19.109 4.512 520 2HD1 LEU 883 2HD1 LEU 883 6.375 18.670 4.641 521 3HD1 LEU 883 3HD1 LEU 883 5.826 20.248 5.206 522 1HD2 LEU 883 1HD2 LEU 883 7.633 19.000 2.288 523 2HD2 LEU 883 2HD2 LEU 883 7.707 20.746 2.053 524 3HD2 LEU 883 3HD2 LEU 883 8.010 20.057 3.648 525 HA GLU 884 HA GLU 884 5.158 23.461 -0.435 526 1HB GLU 884 1HB GLU 884 6.773 22.888 1.842 527 2HB GLU 884 2HB GLU 884 7.795 23.706 0.662 528 1HG GLU 884 1HG GLU 884 6.209 25.545 0.489 529 2HG GLU 884 2HG GLU 884 5.071 24.706 1.544 530 1HA GLY 885 1HA GLY 885 7.658 20.522 -3.593 531 2HA GLY 885 2HA GLY 885 8.431 22.093 -3.301 532 HA GLU 886 HA GLU 886 11.130 19.006 -1.172 533 1HB GLU 886 1HB GLU 886 8.934 19.159 0.493 534 2HB GLU 886 2HB GLU 886 9.346 17.445 0.556 535 1HG GLU 886 1HG GLU 886 11.750 18.154 0.982 536 2HG GLU 886 2HG GLU 886 11.141 19.795 1.196 537 HA THR 887 HA THR 887 10.496 14.529 -2.018 538 HB THR 887 HB THR 887 12.026 15.740 -3.422 539 HG1 THR 887 HG1 THR 887 13.513 14.006 -3.840 540 1HG2 THR 887 1HG2 THR 887 13.987 15.310 -1.168 541 2HG2 THR 887 2HG2 THR 887 14.487 15.791 -2.789 542 3HG2 THR 887 3HG2 THR 887 13.441 16.847 -1.838 543 HA ASP 888 HA ASP 888 13.004 14.012 2.266 544 1HB ASP 888 1HB ASP 888 11.072 15.084 3.253 545 2HB ASP 888 2HB ASP 888 9.992 13.933 2.503 546 HA PRO 889 HA PRO 889 13.413 9.804 1.012 547 1HB PRO 889 1HB PRO 889 13.108 8.729 3.673 548 2HB PRO 889 2HB PRO 889 14.584 8.943 2.736 549 1HG PRO 889 1HG PRO 889 15.167 10.579 4.200 550 2HG PRO 889 2HG PRO 889 13.562 10.569 4.941 551 1HD PRO 889 1HD PRO 889 13.277 12.618 3.933 552 2HD PRO 889 2HD PRO 889 14.641 12.350 2.820 553 HA LEU 890 HA LEU 890 8.754 9.574 1.308 554 1HB LEU 890 1HB LEU 890 8.078 7.608 2.687 555 2HB LEU 890 2HB LEU 890 9.703 7.439 2.060 556 HG LEU 890 HG LEU 890 9.414 6.701 4.448 557 1HD1 LEU 890 1HD1 LEU 890 11.588 7.546 3.422 558 2HD1 LEU 890 2HD1 LEU 890 11.293 9.043 4.309 559 3HD1 LEU 890 3HD1 LEU 890 11.489 7.525 5.181 560 1HD2 LEU 890 1HD2 LEU 890 7.838 8.642 5.005 561 2HD2 LEU 890 2HD2 LEU 890 9.056 8.232 6.208 562 3HD2 LEU 890 3HD2 LEU 890 9.292 9.628 5.160 563 HA LEU 891 HA LEU 891 7.469 11.903 5.471 564 1HB LEU 891 1HB LEU 891 8.571 13.913 5.334 565 2HB LEU 891 2HB LEU 891 8.600 13.862 3.582 566 HG LEU 891 HG LEU 891 7.241 15.737 4.596 567 1HD1 LEU 891 1HD1 LEU 891 6.798 14.359 2.279 568 2HD1 LEU 891 2HD1 LEU 891 5.216 14.254 3.053 569 3HD1 LEU 891 3HD1 LEU 891 5.943 15.828 2.740 570 1HD2 LEU 891 1HD2 LEU 891 6.163 13.662 6.126 571 2HD2 LEU 891 2HD2 LEU 891 5.591 15.329 6.071 572 3HD2 LEU 891 3HD2 LEU 891 4.870 14.114 5.016 573 HA ILE 892 HA ILE 892 4.168 12.806 2.083 574 HB ILE 892 HB ILE 892 6.508 12.392 0.326 575 1HG1 ILE 892 1HG1 ILE 892 4.333 14.135 -0.526 576 2HG1 ILE 892 2HG1 ILE 892 4.915 14.493 1.097 577 1HG2 ILE 892 1HG2 ILE 892 3.749 11.510 -0.413 578 2HG2 ILE 892 2HG2 ILE 892 4.781 12.260 -1.619 579 3HG2 ILE 892 3HG2 ILE 892 5.305 10.787 -0.820 580 1HD1 ILE 892 1HD1 ILE 892 6.911 13.900 -1.012 581 2HD1 ILE 892 2HD1 ILE 892 6.135 15.479 -1.040 582 3HD1 ILE 892 3HD1 ILE 892 7.046 14.965 0.376 583 HA ALA 893 HA ALA 893 4.300 8.262 0.654 584 1HB ALA 893 1HB ALA 893 7.168 8.343 1.096 585 2HB ALA 893 3HB ALA 893 6.249 7.339 -0.016 586 3HB ALA 893 2HB ALA 893 6.477 6.824 1.652 587 HA MET 894 HA MET 894 4.439 7.346 5.344 588 1HB MET 894 1HB MET 894 6.428 8.276 6.193 589 2HB MET 894 2HB MET 894 6.075 9.870 5.530 590 1HG MET 894 1HG MET 894 4.355 10.223 7.239 591 2HG MET 894 2HG MET 894 4.631 8.604 7.880 592 1HE MET 894 1HE MET 894 6.049 11.702 6.687 593 2HE MET 894 2HE MET 894 6.352 12.485 8.235 594 3HE MET 894 3HE MET 894 7.697 11.808 7.322 595 HA LYS 895 HA LYS 895 1.800 11.453 6.311 596 1HB LYS 895 1HB LYS 895 3.153 13.148 5.265 597 2HB LYS 895 2HB LYS 895 2.968 12.403 3.680 598 1HG LYS 895 1HG LYS 895 0.346 12.871 4.490 599 2HG LYS 895 2HG LYS 895 1.269 13.839 3.343 600 1HD LYS 895 1HD LYS 895 1.566 14.324 6.297 601 2HD LYS 895 2HD LYS 895 0.193 15.010 5.429 602 1HE LYS 895 1HE LYS 895 3.145 15.522 4.967 603 2HE LYS 895 2HE LYS 895 1.915 15.942 3.758 604 1HZ LYS 895 3HZ LYS 895 0.705 17.150 5.487 605 2HZ LYS 895 1HZ LYS 895 1.933 16.804 6.603 606 3HZ LYS 895 2HZ LYS 895 2.261 17.793 5.261 607 HA GLU 896 HA GLU 896 -0.588 10.095 2.278 608 1HB GLU 896 1HB GLU 896 1.980 9.127 1.367 609 2HB GLU 896 2HB GLU 896 0.787 7.849 1.222 610 1HG GLU 896 1HG GLU 896 -0.518 9.045 -0.284 611 2HG GLU 896 2HG GLU 896 0.063 10.605 0.299 612 HA LEU 897 HA LEU 897 -0.707 5.831 4.238 613 1HB LEU 897 1HB LEU 897 1.687 5.137 4.147 614 2HB LEU 897 2HB LEU 897 1.953 5.974 5.677 615 HG LEU 897 HG LEU 897 1.290 3.333 5.507 616 1HD1 LEU 897 1HD1 LEU 897 1.881 5.006 7.478 617 2HD1 LEU 897 2HD1 LEU 897 0.148 4.903 7.785 618 3HD1 LEU 897 3HD1 LEU 897 1.137 3.443 7.815 619 1HD2 LEU 897 1HD2 LEU 897 -1.005 4.169 4.577 620 2HD2 LEU 897 2HD2 LEU 897 -1.026 2.970 5.864 621 3HD2 LEU 897 3HD2 LEU 897 -1.329 4.660 6.237 622 HA LYS 898 HA LYS 898 -0.364 7.711 8.820 623 1HB LYS 898 1HB LYS 898 0.212 9.974 9.262 624 2HB LYS 898 2HB LYS 898 0.091 10.406 7.560 625 1HG LYS 898 1HG LYS 898 2.092 8.351 8.101 626 2HG LYS 898 2HG LYS 898 2.184 9.815 7.132 627 1HD LYS 898 1HD LYS 898 3.361 10.803 8.752 628 2HD LYS 898 2HD LYS 898 1.946 10.686 9.795 629 1HE LYS 898 1HE LYS 898 2.901 8.133 9.984 630 2HE LYS 898 2HE LYS 898 4.413 9.043 9.799 631 1HZ LYS 898 1HZ LYS 898 2.230 9.735 11.693 632 2HZ LYS 898 2HZ LYS 898 3.679 8.959 12.125 633 3HZ LYS 898 3HZ LYS 898 3.707 10.550 11.529 634 HA ALA 899 HA ALA 899 -3.669 10.365 6.780 635 1HB ALA 899 2HB ALA 899 -3.653 10.958 4.293 636 2HB ALA 899 3HB ALA 899 -2.227 11.468 5.198 637 3HB ALA 899 1HB ALA 899 -2.154 10.036 4.176 638 HA ARG 900 HA ARG 900 -3.680 5.532 4.432 639 1HB ARG 900 1HB ARG 900 -4.551 6.263 6.975 640 2HB ARG 900 2HB ARG 900 -4.910 4.729 6.193 641 1HG ARG 900 1HG ARG 900 -6.665 7.143 5.742 642 2HG ARG 900 2HG ARG 900 -7.053 5.440 5.509 643 1HD ARG 900 1HD ARG 900 -6.800 5.115 8.003 644 2HD ARG 900 2HD ARG 900 -6.660 6.877 8.153 645 HE ARG 900 HE ARG 900 -8.910 6.769 6.723 646 1HH1 ARG 900 1HH1 ARG 900 -9.506 3.960 7.078 647 2HH1 ARG 900 2HH1 ARG 900 -10.374 3.900 8.576 648 1HH2 ARG 900 1HH2 ARG 900 -9.320 7.036 9.618 649 2HH2 ARG 900 2HH2 ARG 900 -10.269 5.642 10.014 650 HA LYS 901 HA LYS 901 -6.707 8.026 2.188 651 1HB LYS 901 1HB LYS 901 -5.899 10.121 3.260 652 2HB LYS 901 2HB LYS 901 -4.615 10.205 2.053 653 1HG LYS 901 1HG LYS 901 -6.958 9.858 0.557 654 2HG LYS 901 2HG LYS 901 -7.409 10.997 1.826 655 1HD LYS 901 1HD LYS 901 -4.925 11.927 1.059 656 2HD LYS 901 2HD LYS 901 -5.607 11.369 -0.468 657 1HE LYS 901 1HE LYS 901 -7.766 12.663 0.415 658 2HE LYS 901 2HE LYS 901 -6.451 13.551 -0.381 659 1HZ LYS 901 1HZ LYS 901 -5.429 13.734 1.895 660 2HZ LYS 901 2HZ LYS 901 -6.860 14.625 1.686 661 3HZ LYS 901 3HZ LYS 901 -6.895 13.157 2.533 662 HA ILE 902 HA ILE 902 -2.960 7.933 -1.210 663 HB ILE 902 HB ILE 902 -2.639 5.249 0.167 664 1HG1 ILE 902 1HG1 ILE 902 -0.319 7.025 -0.046 665 2HG1 ILE 902 2HG1 ILE 902 -1.622 7.722 0.916 666 1HG2 ILE 902 1HG2 ILE 902 -2.148 5.882 -2.496 667 2HG2 ILE 902 2HG2 ILE 902 -0.574 6.098 -1.731 668 3HG2 ILE 902 3HG2 ILE 902 -1.414 4.552 -1.603 669 1HD1 ILE 902 1HD1 ILE 902 -0.826 4.862 1.366 670 2HD1 ILE 902 2HD1 ILE 902 0.143 6.154 2.072 671 3HD1 ILE 902 3HD1 ILE 902 -1.563 6.001 2.491 672 HA PRO 903 HA PRO 903 -6.690 5.799 -2.899 673 1HB PRO 903 1HB PRO 903 -6.822 7.890 -4.868 674 2HB PRO 903 2HB PRO 903 -7.885 7.662 -3.476 675 1HG PRO 903 1HG PRO 903 -6.101 9.794 -3.821 676 2HG PRO 903 2HG PRO 903 -6.861 9.328 -2.293 677 1HD PRO 903 1HD PRO 903 -4.682 8.990 -1.578 678 2HD PRO 903 2HD PRO 903 -4.075 8.815 -3.242 679 HA ILE 904 HA ILE 904 -4.732 4.628 -6.669 680 HB ILE 904 HB ILE 904 -2.693 5.207 -4.744 681 1HG1 ILE 904 1HG1 ILE 904 -2.005 5.367 -7.587 682 2HG1 ILE 904 2HG1 ILE 904 -3.582 6.064 -7.225 683 1HG2 ILE 904 1HG2 ILE 904 -2.085 3.042 -6.761 684 2HG2 ILE 904 2HG2 ILE 904 -0.841 4.049 -6.025 685 3HG2 ILE 904 3HG2 ILE 904 -1.832 2.997 -5.017 686 1HD1 ILE 904 1HD1 ILE 904 -1.388 6.752 -5.344 687 2HD1 ILE 904 2HD1 ILE 904 -1.290 7.462 -6.954 688 3HD1 ILE 904 3HD1 ILE 904 -2.708 7.752 -5.948 689 HA ILE 905 HA ILE 905 -4.996 0.264 -6.731 690 HB ILE 905 HB ILE 905 -6.057 1.140 -8.792 691 1HG1 ILE 905 1HG1 ILE 905 -4.597 -0.996 -10.086 692 2HG1 ILE 905 2HG1 ILE 905 -4.905 -1.411 -8.401 693 1HG2 ILE 905 1HG2 ILE 905 -4.014 2.404 -9.565 694 2HG2 ILE 905 2HG2 ILE 905 -3.308 0.863 -10.041 695 3HG2 ILE 905 3HG2 ILE 905 -4.777 1.441 -10.826 696 1HD1 ILE 905 1HD1 ILE 905 -7.094 -0.247 -10.082 697 2HD1 ILE 905 2HD1 ILE 905 -6.727 -1.966 -10.185 698 3HD1 ILE 905 3HD1 ILE 905 -7.226 -1.255 -8.649 699 HA ILE 906 HA ILE 906 -0.778 -1.008 -7.917 700 HB ILE 906 HB ILE 906 -1.701 -1.693 -5.155 701 1HG1 ILE 906 1HG1 ILE 906 0.576 -0.173 -6.429 702 2HG1 ILE 906 2HG1 ILE 906 0.533 -0.507 -4.700 703 1HG2 ILE 906 1HG2 ILE 906 0.537 -3.077 -6.592 704 2HG2 ILE 906 2HG2 ILE 906 0.786 -2.614 -4.910 705 3HG2 ILE 906 3HG2 ILE 906 -0.538 -3.696 -5.338 706 1HD1 ILE 906 1HD1 ILE 906 -2.025 0.458 -5.298 707 2HD1 ILE 906 2HD1 ILE 906 -0.733 1.341 -4.484 708 3HD1 ILE 906 3HD1 ILE 906 -0.927 1.477 -6.230 709 HA ARG 907 HA ARG 907 -1.724 -5.151 -9.217 710 1HB ARG 907 1HB ARG 907 0.700 -4.100 -10.621 711 2HB ARG 907 2HB ARG 907 0.104 -5.718 -10.953 712 1HG ARG 907 1HG ARG 907 -0.852 -4.101 -12.536 713 2HG ARG 907 2HG ARG 907 -2.100 -4.797 -11.508 714 1HD ARG 907 1HD ARG 907 -2.397 -2.812 -10.289 715 2HD ARG 907 2HD ARG 907 -0.783 -2.203 -10.710 716 HE ARG 907 HE ARG 907 -3.174 -2.006 -12.385 717 1HH1 ARG 907 1HH1 ARG 907 0.260 -2.441 -12.470 718 2HH1 ARG 907 2HH1 ARG 907 0.466 -1.507 -13.912 719 1HH2 ARG 907 1HH2 ARG 907 -2.884 -0.665 -14.180 720 2HH2 ARG 907 2HH2 ARG 907 -1.306 -0.505 -14.878 721 HA ARG 908 HA ARG 908 1.273 -7.187 -6.623 722 1HB ARG 908 1HB ARG 908 -0.925 -8.941 -5.732 723 2HB ARG 908 2HB ARG 908 0.225 -8.041 -4.770 724 1HG ARG 908 1HG ARG 908 -1.154 -5.957 -5.233 725 2HG ARG 908 2HG ARG 908 -2.370 -7.006 -5.961 726 1HD ARG 908 1HD ARG 908 -2.885 -6.531 -3.514 727 2HD ARG 908 2HD ARG 908 -2.589 -8.261 -3.800 728 HE ARG 908 HE ARG 908 -0.154 -6.754 -3.192 729 1HH1 ARG 908 1HH1 ARG 908 -2.962 -7.575 -1.494 730 2HH1 ARG 908 2HH1 ARG 908 -2.145 -8.434 -0.231 731 1HH2 ARG 908 1HH2 ARG 908 0.961 -8.272 -1.761 732 2HH2 ARG 908 2HH2 ARG 908 0.074 -8.828 -0.382 733 HA TYR 909 HA TYR 909 0.873 -10.507 -9.682 734 1HB TYR 909 1HB TYR 909 3.762 -9.855 -10.083 735 2HB TYR 909 2HB TYR 909 2.639 -10.543 -11.222 736 HD1 TYR 909 HD1 TYR 909 3.818 -7.378 -9.678 737 HD2 TYR 909 HD2 TYR 909 1.171 -9.175 -12.521 738 HE1 TYR 909 HE1 TYR 909 3.499 -5.193 -10.752 739 HE2 TYR 909 HE2 TYR 909 0.832 -6.993 -13.594 740 HH TYR 909 HH TYR 909 1.011 -4.619 -13.035 741 HA LEU 910 HA LEU 910 3.752 -12.976 -7.241 742 1HB LEU 910 1HB LEU 910 1.911 -14.733 -8.874 743 2HB LEU 910 2HB LEU 910 2.643 -15.206 -7.339 744 HG LEU 910 HG LEU 910 0.681 -12.944 -7.818 745 1HD1 LEU 910 1HD1 LEU 910 0.371 -15.725 -7.226 746 2HD1 LEU 910 2HD1 LEU 910 -0.122 -14.804 -5.812 747 3HD1 LEU 910 3HD1 LEU 910 -0.880 -14.494 -7.371 748 1HD2 LEU 910 1HD2 LEU 910 2.660 -13.221 -5.781 749 2HD2 LEU 910 2HD2 LEU 910 1.372 -12.024 -5.888 750 3HD2 LEU 910 3HD2 LEU 910 1.092 -13.543 -5.044 751 HA PRO 911 HA PRO 911 7.091 -14.104 -10.044 752 1HB PRO 911 1HB PRO 911 8.581 -14.843 -7.696 753 2HB PRO 911 2HB PRO 911 8.787 -13.398 -8.691 754 1HG PRO 911 1HG PRO 911 7.927 -12.133 -7.021 755 2HG PRO 911 2HG PRO 911 7.688 -13.580 -6.039 756 1HD PRO 911 1HD PRO 911 5.434 -13.418 -6.363 757 2HD PRO 911 2HD PRO 911 5.676 -11.991 -7.392 758 HA ASP 912 HA ASP 912 6.481 -18.415 -7.903 759 1HB ASP 912 1HB ASP 912 4.064 -17.097 -6.775 760 2HB ASP 912 2HB ASP 912 3.912 -18.822 -7.105 761 1HA GLY 913 1HA GLY 913 3.853 -17.471 -12.053 762 2HA GLY 913 2HA GLY 913 3.476 -19.036 -11.331 763 HA SER 914 HA SER 914 -0.279 -16.111 -11.644 764 1HB SER 914 1HB SER 914 -0.795 -15.727 -8.927 765 2HB SER 914 2HB SER 914 -1.047 -17.220 -9.821 766 HG SER 914 HG SER 914 0.416 -17.988 -8.526 767 HA TYR 915 HA TYR 915 -0.100 -11.958 -9.441 768 1HB TYR 915 1HB TYR 915 0.958 -11.309 -11.351 769 2HB TYR 915 2HB TYR 915 0.114 -12.538 -12.279 770 HD1 TYR 915 HD1 TYR 915 -0.568 -9.178 -10.709 771 HD2 TYR 915 HD2 TYR 915 -1.275 -11.845 -14.003 772 HE1 TYR 915 HE1 TYR 915 -1.888 -7.419 -11.852 773 HE2 TYR 915 HE2 TYR 915 -2.596 -10.085 -15.143 774 HH TYR 915 HH TYR 915 -2.629 -6.815 -14.051 775 HA GLU 916 HA GLU 916 -4.271 -10.184 -10.257 776 1HB GLU 916 1HB GLU 916 -3.594 -11.174 -7.748 777 2HB GLU 916 2HB GLU 916 -4.191 -9.548 -7.420 778 1HG GLU 916 1HG GLU 916 -5.735 -11.253 -9.324 779 2HG GLU 916 2HG GLU 916 -5.864 -11.599 -7.600 780 HA ASP 917 HA ASP 917 -3.389 -5.836 -9.579 781 1HB ASP 917 1HB ASP 917 -3.489 -6.236 -11.989 782 2HB ASP 917 2HB ASP 917 -4.178 -4.683 -11.572 783 HA TRP 918 HA TRP 918 -6.609 -2.821 -8.564 784 1HB TRP 918 1HB TRP 918 -8.013 -3.963 -6.833 785 2HB TRP 918 2HB TRP 918 -8.025 -4.727 -8.402 786 HD1 TRP 918 HD1 TRP 918 -4.860 -5.914 -7.135 787 HE1 TRP 918 HE1 TRP 918 -5.153 -8.239 -6.048 788 HE3 TRP 918 HE3 TRP 918 -9.816 -5.776 -6.358 789 HZ2 TRP 918 HZ2 TRP 918 -7.308 -9.778 -4.849 790 HZ3 TRP 918 HZ3 TRP 918 -10.989 -7.549 -5.172 791 HH2 TRP 918 HH2 TRP 918 -9.763 -9.598 -4.419 792 1HA GLY 919 1HA GLY 919 -5.015 -2.581 -4.241 793 2HA GLY 919 2HA GLY 919 -4.773 -1.055 -5.078 794 HA VAL 920 HA VAL 920 -7.953 0.228 -2.343 795 HB VAL 920 HB VAL 920 -6.836 2.664 -3.777 796 1HG1 VAL 920 1HG1 VAL 920 -8.536 2.308 -1.322 797 2HG1 VAL 920 2HG1 VAL 920 -7.377 3.636 -1.388 798 3HG1 VAL 920 3HG1 VAL 920 -8.659 3.525 -2.593 799 1HG2 VAL 920 1HG2 VAL 920 -5.882 0.858 -1.601 800 2HG2 VAL 920 2HG2 VAL 920 -4.958 1.712 -2.837 801 3HG2 VAL 920 3HG2 VAL 920 -5.550 2.580 -1.423 802 HA ASP 921 HA ASP 921 -10.767 1.782 -5.726 803 1HB ASP 921 1HB ASP 921 -9.101 1.896 -7.574 804 2HB ASP 921 2HB ASP 921 -9.314 0.166 -7.842 805 HA GLU 922 HA GLU 922 -12.448 -2.439 -5.508 806 1HB GLU 922 1HB GLU 922 -10.573 -2.951 -7.261 807 2HB GLU 922 2HB GLU 922 -9.940 -4.012 -6.004 808 1HG GLU 922 1HG GLU 922 -11.418 -5.320 -7.439 809 2HG GLU 922 2HG GLU 922 -12.201 -5.111 -5.872 810 HA LEU 923 HA LEU 923 -10.755 -3.569 -1.412 811 1HB LEU 923 1HB LEU 923 -8.444 -4.708 -1.150 812 2HB LEU 923 2HB LEU 923 -9.522 -5.283 -2.403 813 HG LEU 923 HG LEU 923 -8.027 -3.172 -3.553 814 1HD1 LEU 923 1HD1 LEU 923 -6.311 -5.193 -2.092 815 2HD1 LEU 923 2HD1 LEU 923 -5.738 -4.098 -3.350 816 3HD1 LEU 923 3HD1 LEU 923 -6.328 -3.454 -1.822 817 1HD2 LEU 923 1HD2 LEU 923 -8.583 -5.999 -3.839 818 2HD2 LEU 923 2HD2 LEU 923 -8.436 -4.732 -5.061 819 3HD2 LEU 923 3HD2 LEU 923 -6.994 -5.539 -4.449 820 HA ILE 924 HA ILE 924 -8.456 -1.107 1.415 821 HB ILE 924 HB ILE 924 -7.240 -3.770 1.706 822 1HG1 ILE 924 1HG1 ILE 924 -8.036 -3.165 4.091 823 2HG1 ILE 924 2HG1 ILE 924 -8.776 -1.773 3.305 824 1HG2 ILE 924 1HG2 ILE 924 -5.211 -2.356 1.998 825 2HG2 ILE 924 2HG2 ILE 924 -6.054 -1.487 3.280 826 3HG2 ILE 924 3HG2 ILE 924 -5.695 -3.200 3.461 827 1HD1 ILE 924 3HD1 ILE 924 -9.174 -4.651 2.468 828 2HD1 ILE 924 1HD1 ILE 924 -10.341 -3.682 3.366 829 3HD1 ILE 924 2HD1 ILE 924 -9.912 -3.242 1.713 830 HA ILE 925 HA ILE 925 -4.697 0.764 -0.018 831 HB ILE 925 HB ILE 925 -4.330 2.697 1.528 832 1HG1 ILE 925 1HG1 ILE 925 -6.622 1.943 3.235 833 2HG1 ILE 925 2HG1 ILE 925 -5.181 0.957 3.480 834 1HG2 ILE 925 1HG2 ILE 925 -6.849 1.935 0.266 835 2HG2 ILE 925 2HG2 ILE 925 -7.093 3.060 1.602 836 3HG2 ILE 925 3HG2 ILE 925 -6.024 3.494 0.270 837 1HD1 ILE 925 1HD1 ILE 925 -4.845 3.924 3.300 838 2HD1 ILE 925 2HD1 ILE 925 -5.504 3.248 4.790 839 3HD1 ILE 925 3HD1 ILE 925 -3.912 2.745 4.221 840 HA THR 926 HA THR 926 -1.114 -0.275 2.570 841 HB THR 926 HB THR 926 -1.979 1.599 4.792 842 HG1 THR 926 HG1 THR 926 -1.728 2.883 3.097 843 1HG2 THR 926 1HG2 THR 926 -0.244 -0.009 5.467 844 2HG2 THR 926 2HG2 THR 926 0.739 0.462 4.083 845 3HG2 THR 926 3HG2 THR 926 0.416 1.623 5.369 846 HA ASP 927 HA ASP 927 -4.075 -2.745 5.300 847 1HB ASP 927 1HB ASP 927 -2.023 -2.066 6.557 848 2HB ASP 927 2HB ASP 927 -2.985 -0.885 7.445 No H/Q in entry = 848 Start of MODEL 19 1 HA MET 801 HA MET 801 21.595 -20.865 43.444 2 1HB MET 801 1HB MET 801 20.658 -20.409 45.736 3 2HB MET 801 2HB MET 801 19.079 -20.919 45.138 4 1HG MET 801 1HG MET 801 20.451 -23.051 44.344 5 2HG MET 801 2HG MET 801 21.531 -22.554 45.646 6 1HE MET 801 3HE MET 801 21.362 -22.652 47.717 7 2HE MET 801 2HE MET 801 20.072 -23.230 48.781 8 3HE MET 801 1HE MET 801 21.005 -24.374 47.820 9 HA SER 802 HA SER 802 17.991 -22.732 41.230 10 1HB SER 802 1HB SER 802 16.643 -22.590 43.557 11 2HB SER 802 2HB SER 802 15.518 -21.694 42.539 12 HG SER 802 HG SER 802 16.522 -24.322 42.162 13 HA ASP 803 HA ASP 803 16.560 -18.944 39.060 14 1HB ASP 803 1HB ASP 803 19.531 -18.971 38.980 15 2HB ASP 803 2HB ASP 803 18.726 -18.139 37.650 16 HA ASN 804 HA ASN 804 16.734 -21.670 35.399 17 1HB ASN 804 1HB ASN 804 14.458 -22.128 36.978 18 2HB ASN 804 2HB ASN 804 13.821 -21.782 35.371 19 2HD2 ASN 804 1HD2 ASN 804 15.214 -22.990 33.545 20 1HD2 ASN 804 2HD2 ASN 804 15.571 -24.615 33.882 21 HA GLU 805 HA GLU 805 15.169 -18.454 32.697 22 1HB GLU 805 1HB GLU 805 17.832 -18.893 32.603 23 2HB GLU 805 2HB GLU 805 17.403 -19.405 30.971 24 1HG GLU 805 1HG GLU 805 16.133 -17.216 30.740 25 2HG GLU 805 2HG GLU 805 17.886 -17.056 30.845 26 HA ASP 806 HA ASP 806 13.615 -20.833 29.223 27 1HB ASP 806 1HB ASP 806 11.431 -20.560 31.312 28 2HB ASP 806 2HB ASP 806 11.310 -21.594 29.888 29 HA ASN 807 HA ASN 807 11.475 -17.112 27.702 30 1HB ASN 807 1HB ASN 807 12.857 -16.072 25.932 31 2HB ASN 807 2HB ASN 807 13.915 -17.484 25.925 32 2HD2 ASN 807 1HD2 ASN 807 15.748 -16.112 26.616 33 1HD2 ASN 807 2HD2 ASN 807 15.861 -15.564 28.219 34 HA PHE 808 HA PHE 808 10.065 -19.382 24.027 35 1HB PHE 808 1HB PHE 808 9.913 -16.457 23.438 36 2HB PHE 808 2HB PHE 808 9.311 -17.563 22.204 37 HD1 PHE 808 HD1 PHE 808 9.061 -16.792 25.855 38 HD2 PHE 808 HD2 PHE 808 7.180 -18.541 22.413 39 HE1 PHE 808 HE1 PHE 808 6.977 -17.117 27.159 40 HE2 PHE 808 HE2 PHE 808 5.096 -18.866 23.717 41 HZ PHE 808 HZ PHE 808 4.994 -18.154 26.089 42 HA ASP 809 HA ASP 809 13.431 -19.360 20.926 43 1HB ASP 809 1HB ASP 809 12.057 -17.249 20.162 44 2HB ASP 809 2HB ASP 809 13.602 -16.416 20.332 45 1HA GLY 810 1HA GLY 810 17.081 -17.388 23.027 46 2HA GLY 810 2HA GLY 810 16.711 -18.336 24.468 47 HA ASP 811 HA ASP 811 19.240 -21.150 21.918 48 1HB ASP 811 1HB ASP 811 18.074 -19.793 19.589 49 2HB ASP 811 2HB ASP 811 19.571 -20.644 19.208 50 HA ASP 812 HA ASP 812 23.220 -19.246 21.187 51 1HB ASP 812 1HB ASP 812 23.380 -21.995 19.945 52 2HB ASP 812 2HB ASP 812 24.826 -21.010 20.178 53 HA PHE 813 HA PHE 813 23.152 -18.430 16.596 54 1HB PHE 813 1HB PHE 813 21.165 -17.293 15.609 55 2HB PHE 813 2HB PHE 813 20.732 -18.792 16.430 56 HD1 PHE 813 HD1 PHE 813 20.896 -15.087 16.882 57 HD2 PHE 813 HD2 PHE 813 19.189 -18.794 18.222 58 HE1 PHE 813 HE1 PHE 813 19.325 -13.837 18.339 59 HE2 PHE 813 HE2 PHE 813 17.620 -17.544 19.681 60 HZ PHE 813 HZ PHE 813 17.687 -15.066 19.738 61 HA ASP 814 HA ASP 814 23.636 -13.984 17.823 62 1HB ASP 814 1HB ASP 814 22.531 -12.660 19.621 63 2HB ASP 814 2HB ASP 814 21.371 -13.631 18.717 64 HA ASP 815 HA ASP 815 26.686 -14.714 21.061 65 1HB ASP 815 1HB ASP 815 25.520 -17.098 21.119 66 2HB ASP 815 2HB ASP 815 27.025 -17.612 20.358 67 HA VAL 816 HA VAL 816 30.083 -14.350 18.225 68 HB VAL 816 HB VAL 816 29.385 -16.601 17.530 69 1HG1 VAL 816 1HG1 VAL 816 27.141 -15.857 16.651 70 2HG1 VAL 816 2HG1 VAL 816 27.969 -15.244 15.220 71 3HG1 VAL 816 3HG1 VAL 816 27.998 -16.969 15.584 72 1HG2 VAL 816 1HG2 VAL 816 31.275 -15.160 16.340 73 2HG2 VAL 816 2HG2 VAL 816 30.845 -16.760 15.735 74 3HG2 VAL 816 3HG2 VAL 816 30.200 -15.318 14.950 75 HA GLU 817 HA GLU 817 29.075 -11.275 15.114 76 1HB GLU 817 1HB GLU 817 30.496 -10.133 17.520 77 2HB GLU 817 2HB GLU 817 30.079 -9.107 16.147 78 1HG GLU 817 1HG GLU 817 28.113 -8.860 17.289 79 2HG GLU 817 2HG GLU 817 27.717 -10.388 16.500 80 HA GLU 818 HA GLU 818 33.067 -11.418 13.102 81 1HB GLU 818 1HB GLU 818 35.206 -11.718 14.347 82 2HB GLU 818 2HB GLU 818 34.038 -10.769 15.266 83 1HG GLU 818 1HG GLU 818 33.343 -12.920 16.414 84 2HG GLU 818 2HG GLU 818 34.726 -13.694 15.640 85 HA ASP 819 HA ASP 819 34.576 -14.718 10.400 86 1HB ASP 819 1HB ASP 819 35.899 -14.781 12.670 87 2HB ASP 819 2HB ASP 819 34.763 -16.065 13.084 88 HA GLU 820 HA GLU 820 31.516 -17.783 9.099 89 1HB GLU 820 1HB GLU 820 32.789 -18.582 11.335 90 2HB GLU 820 2HB GLU 820 31.222 -18.183 12.039 91 1HG GLU 820 1HG GLU 820 30.364 -19.551 9.894 92 2HG GLU 820 2HG GLU 820 31.934 -20.328 10.098 93 1HA GLY 821 1HA GLY 821 27.880 -15.367 9.556 94 2HA GLY 821 2HA GLY 821 28.711 -14.428 10.796 95 HA LEU 822 HA LEU 822 29.353 -11.843 6.951 96 1HB LEU 822 1HB LEU 822 28.952 -14.250 5.229 97 2HB LEU 822 2HB LEU 822 28.791 -12.672 4.458 98 HG LEU 822 HG LEU 822 31.160 -13.362 6.202 99 1HD1 LEU 822 1HD1 LEU 822 31.001 -14.989 4.324 100 2HD1 LEU 822 2HD1 LEU 822 30.938 -13.642 3.189 101 3HD1 LEU 822 3HD1 LEU 822 32.387 -13.914 4.155 102 1HD2 LEU 822 1HD2 LEU 822 30.430 -10.956 5.466 103 2HD2 LEU 822 2HD2 LEU 822 32.122 -11.423 5.297 104 3HD2 LEU 822 3HD2 LEU 822 31.059 -11.435 3.891 105 HA ASP 823 HA ASP 823 24.845 -11.370 6.308 106 1HB ASP 823 1HB ASP 823 24.594 -14.171 5.176 107 2HB ASP 823 2HB ASP 823 23.330 -12.951 5.018 108 HA ASP 824 HA ASP 824 22.800 -14.129 9.507 109 1HB ASP 824 1HB ASP 824 24.944 -15.715 9.398 110 2HB ASP 824 2HB ASP 824 25.264 -14.988 10.974 111 HA LEU 825 HA LEU 825 24.050 -10.970 12.557 112 1HB LEU 825 1HB LEU 825 26.029 -10.390 11.057 113 2HB LEU 825 2HB LEU 825 25.011 -9.140 10.341 114 HG LEU 825 HG LEU 825 24.624 -8.575 12.952 115 1HD1 LEU 825 1HD1 LEU 825 27.258 -10.009 12.717 116 2HD1 LEU 825 2HD1 LEU 825 27.075 -8.692 13.874 117 3HD1 LEU 825 3HD1 LEU 825 26.046 -10.118 13.993 118 1HD2 LEU 825 1HD2 LEU 825 26.769 -7.698 11.022 119 2HD2 LEU 825 2HD2 LEU 825 25.301 -6.846 11.498 120 3HD2 LEU 825 3HD2 LEU 825 26.652 -6.972 12.624 121 HA GLU 826 HA GLU 826 20.912 -7.861 11.126 122 1HB GLU 826 1HB GLU 826 22.444 -6.634 9.625 123 2HB GLU 826 2HB GLU 826 20.781 -6.506 9.052 124 1HG GLU 826 1HG GLU 826 21.932 -8.871 7.918 125 2HG GLU 826 2HG GLU 826 21.388 -7.416 7.084 126 HA ASN 827 HA ASN 827 18.801 -11.193 8.406 127 1HB ASN 827 1HB ASN 827 18.303 -13.268 9.687 128 2HB ASN 827 2HB ASN 827 20.033 -12.928 9.642 129 2HD2 ASN 827 1HD2 ASN 827 19.159 -14.550 11.715 130 1HD2 ASN 827 2HD2 ASN 827 19.180 -13.699 13.183 131 HA ALA 828 HA ALA 828 15.446 -9.387 10.986 132 1HB ALA 828 2HB ALA 828 15.645 -7.000 9.194 133 2HB ALA 828 3HB ALA 828 15.313 -7.073 10.923 134 3HB ALA 828 1HB ALA 828 16.963 -7.270 10.334 135 HA GLU 829 HA GLU 829 12.506 -9.771 7.626 136 1HB GLU 829 1HB GLU 829 11.163 -8.661 9.391 137 2HB GLU 829 2HB GLU 829 11.396 -7.110 8.586 138 1HG GLU 829 1HG GLU 829 10.408 -8.337 6.494 139 2HG GLU 829 2HG GLU 829 9.785 -9.484 7.681 140 HA GLU 830 HA GLU 830 11.790 -5.373 4.744 141 1HB GLU 830 1HB GLU 830 14.593 -6.419 5.264 142 2HB GLU 830 2HB GLU 830 14.207 -5.138 4.116 143 1HG GLU 830 1HG GLU 830 13.699 -3.612 5.771 144 2HG GLU 830 2HG GLU 830 13.172 -4.857 6.903 145 HA GLU 831 HA GLU 831 12.672 -9.239 2.120 146 1HB GLU 831 1HB GLU 831 11.064 -10.510 4.283 147 2HB GLU 831 2HB GLU 831 10.964 -11.252 2.685 148 1HG GLU 831 1HG GLU 831 13.536 -11.148 2.665 149 2HG GLU 831 2HG GLU 831 13.416 -10.829 4.396 150 1HA GLY 832 1HA GLY 832 8.386 -9.104 0.360 151 2HA GLY 832 2HA GLY 832 9.520 -8.558 -0.877 152 HA GLN 833 HA GLN 833 8.217 -12.266 -2.915 153 1HB GLN 833 1HB GLN 833 7.991 -13.252 -0.650 154 2HB GLN 833 2HB GLN 833 6.856 -14.006 -1.773 155 1HG GLN 833 1HG GLN 833 6.178 -11.689 0.062 156 2HG GLN 833 2HG GLN 833 5.056 -12.576 -0.969 157 2HE2 GLN 833 1HE2 GLN 833 4.412 -14.737 -0.296 158 1HE2 GLN 833 2HE2 GLN 833 4.753 -15.326 1.260 159 HA GLU 834 HA GLU 834 4.645 -11.012 -5.181 160 1HB GLU 834 1HB GLU 834 3.537 -10.715 -3.034 161 2HB GLU 834 2HB GLU 834 4.221 -9.100 -2.857 162 1HG GLU 834 1HG GLU 834 2.676 -8.155 -4.237 163 2HG GLU 834 2HG GLU 834 2.692 -9.521 -5.350 164 HA ASN 835 HA ASN 835 6.646 -7.499 -7.175 165 1HB ASN 835 1HB ASN 835 5.030 -8.578 -9.487 166 2HB ASN 835 2HB ASN 835 6.578 -7.753 -9.517 167 2HD2 ASN 835 1HD2 ASN 835 8.370 -9.085 -8.189 168 1HD2 ASN 835 2HD2 ASN 835 8.419 -10.741 -8.554 169 HA VAL 836 HA VAL 836 2.791 -5.381 -7.547 170 HB VAL 836 HB VAL 836 2.379 -4.666 -5.457 171 1HG1 VAL 836 1HG1 VAL 836 5.274 -5.404 -5.063 172 2HG1 VAL 836 2HG1 VAL 836 4.111 -5.173 -3.762 173 3HG1 VAL 836 3HG1 VAL 836 3.885 -6.482 -4.922 174 1HG2 VAL 836 1HG2 VAL 836 4.828 -2.922 -5.765 175 2HG2 VAL 836 2HG2 VAL 836 3.144 -2.423 -5.883 176 3HG2 VAL 836 3HG2 VAL 836 3.812 -2.917 -4.328 177 HA GLU 837 HA GLU 837 4.230 -1.728 -9.598 178 1HB GLU 837 1HB GLU 837 2.739 -3.434 -11.139 179 2HB GLU 837 2HB GLU 837 1.734 -1.991 -11.156 180 1HG GLU 837 1HG GLU 837 3.283 -1.856 -13.017 181 2HG GLU 837 2HG GLU 837 3.767 -0.667 -11.807 182 HA ILE 838 HA ILE 838 0.620 0.736 -8.382 183 HB ILE 838 HB ILE 838 3.249 1.427 -7.957 184 1HG1 ILE 838 1HG1 ILE 838 0.673 1.943 -6.732 185 2HG1 ILE 838 2HG1 ILE 838 1.818 3.239 -6.399 186 1HG2 ILE 838 1HG2 ILE 838 2.543 3.347 -9.736 187 2HG2 ILE 838 2HG2 ILE 838 2.093 4.126 -8.219 188 3HG2 ILE 838 3HG2 ILE 838 3.746 3.570 -8.475 189 1HD1 ILE 838 2HD1 ILE 838 2.724 0.385 -6.139 190 2HD1 ILE 838 3HD1 ILE 838 3.304 1.817 -5.293 191 3HD1 ILE 838 1HD1 ILE 838 1.761 1.095 -4.848 192 HA LEU 839 HA LEU 839 -0.402 4.179 -11.203 193 1HB LEU 839 1HB LEU 839 -1.457 1.525 -11.484 194 2HB LEU 839 2HB LEU 839 -2.772 2.665 -11.764 195 HG LEU 839 HG LEU 839 -0.755 3.862 -13.162 196 1HD1 LEU 839 1HD1 LEU 839 0.097 1.160 -12.675 197 2HD1 LEU 839 2HD1 LEU 839 -0.245 1.349 -14.394 198 3HD1 LEU 839 3HD1 LEU 839 0.912 2.418 -13.603 199 1HD2 LEU 839 1HD2 LEU 839 -3.104 3.316 -13.885 200 2HD2 LEU 839 2HD2 LEU 839 -1.900 3.047 -15.146 201 3HD2 LEU 839 3HD2 LEU 839 -2.561 1.679 -14.250 202 HA PRO 840 HA PRO 840 -3.416 6.624 -9.115 203 1HB PRO 840 1HB PRO 840 -3.970 8.123 -10.709 204 2HB PRO 840 2HB PRO 840 -5.179 7.004 -11.349 205 1HG PRO 840 1HG PRO 840 -2.682 7.757 -12.540 206 2HG PRO 840 2HG PRO 840 -3.855 6.587 -13.151 207 1HD PRO 840 1HD PRO 840 -2.379 4.912 -12.682 208 2HD PRO 840 2HD PRO 840 -1.251 6.078 -11.947 209 HA SER 841 HA SER 841 -6.271 3.466 -7.868 210 1HB SER 841 1HB SER 841 -8.114 4.812 -6.539 211 2HB SER 841 2HB SER 841 -6.486 4.676 -5.891 212 HG SER 841 HG SER 841 -7.724 6.866 -6.300 213 1HA GLY 842 1HA GLY 842 -10.080 2.466 -9.932 214 2HA GLY 842 2HA GLY 842 -10.008 4.204 -10.202 215 HA GLU 843 HA GLU 843 -8.185 2.354 -13.943 216 1HB GLU 843 1HB GLU 843 -6.179 1.694 -12.154 217 2HB GLU 843 2HB GLU 843 -6.273 0.254 -13.167 218 1HG GLU 843 1HG GLU 843 -6.184 1.798 -15.181 219 2HG GLU 843 2HG GLU 843 -4.703 1.734 -14.223 220 HA ARG 844 HA ARG 844 -10.175 -1.778 -14.106 221 1HB ARG 844 1HB ARG 844 -11.911 -1.580 -12.657 222 2HB ARG 844 2HB ARG 844 -12.271 0.061 -13.179 223 1HG ARG 844 1HG ARG 844 -13.482 -0.719 -15.097 224 2HG ARG 844 2HG ARG 844 -12.882 -2.364 -14.887 225 1HD ARG 844 1HD ARG 844 -14.331 -2.815 -13.125 226 2HD ARG 844 2HD ARG 844 -14.430 -1.111 -12.639 227 HE ARG 844 HE ARG 844 -15.596 -1.976 -15.248 228 1HH1 ARG 844 1HH1 ARG 844 -15.695 0.825 -13.914 229 2HH1 ARG 844 2HH1 ARG 844 -17.339 0.843 -13.368 230 1HH2 ARG 844 1HH2 ARG 844 -17.789 -2.571 -13.768 231 2HH2 ARG 844 2HH2 ARG 844 -18.523 -1.079 -13.285 232 HA PRO 845 HA PRO 845 -12.470 -0.371 -18.118 233 1HB PRO 845 1HB PRO 845 -12.045 2.463 -18.385 234 2HB PRO 845 2HB PRO 845 -13.574 1.611 -18.160 235 1HG PRO 845 1HG PRO 845 -12.225 3.272 -16.274 236 2HG PRO 845 2HG PRO 845 -13.703 2.339 -16.021 237 1HD PRO 845 1HD PRO 845 -12.546 0.950 -14.619 238 2HD PRO 845 2HD PRO 845 -11.025 1.790 -14.994 239 HA GLN 846 HA GLN 846 -8.651 -0.304 -20.347 240 1HB GLN 846 1HB GLN 846 -6.653 0.657 -19.197 241 2HB GLN 846 2HB GLN 846 -8.123 1.561 -18.846 242 1HG GLN 846 1HG GLN 846 -8.233 -0.219 -16.826 243 2HG GLN 846 2HG GLN 846 -7.380 1.317 -16.688 244 2HE2 GLN 846 1HE2 GLN 846 -6.463 -0.719 -15.059 245 1HE2 GLN 846 2HE2 GLN 846 -4.991 -1.334 -15.638 246 HA ALA 847 HA ALA 847 -6.910 -4.227 -18.799 247 1HB ALA 847 2HB ALA 847 -6.289 -3.133 -16.036 248 2HB ALA 847 1HB ALA 847 -5.383 -2.737 -17.496 249 3HB ALA 847 3HB ALA 847 -5.389 -4.391 -16.883 250 HA ASN 848 HA ASN 848 -10.626 -5.590 -16.106 251 1HB ASN 848 1HB ASN 848 -10.861 -6.724 -18.918 252 2HB ASN 848 2HB ASN 848 -11.992 -7.057 -17.606 253 2HD2 ASN 848 1HD2 ASN 848 -13.710 -5.604 -17.381 254 1HD2 ASN 848 2HD2 ASN 848 -13.777 -4.069 -18.103 255 HA GLN 849 HA GLN 849 -8.240 -9.377 -15.822 256 1HB GLN 849 1HB GLN 849 -6.625 -7.303 -15.624 257 2HB GLN 849 2HB GLN 849 -6.633 -7.701 -13.910 258 1HG GLN 849 1HG GLN 849 -6.223 -10.168 -15.099 259 2HG GLN 849 2HG GLN 849 -5.310 -9.074 -16.140 260 2HE2 GLN 849 1HE2 GLN 849 -4.497 -7.133 -14.281 261 1HE2 GLN 849 2HE2 GLN 849 -3.475 -7.820 -13.122 262 HA LYS 850 HA LYS 850 -8.114 -10.063 -10.978 263 1HB LYS 850 1HB LYS 850 -10.040 -11.151 -12.927 264 2HB LYS 850 2HB LYS 850 -9.816 -12.186 -11.517 265 1HG LYS 850 1HG LYS 850 -10.070 -9.310 -10.894 266 2HG LYS 850 2HG LYS 850 -11.518 -10.040 -11.589 267 1HD LYS 850 1HD LYS 850 -11.161 -11.936 -9.875 268 2HD LYS 850 2HD LYS 850 -10.052 -10.826 -9.070 269 1HE LYS 850 1HE LYS 850 -12.059 -9.124 -9.267 270 2HE LYS 850 2HE LYS 850 -12.104 -10.364 -7.998 271 1HZ LYS 850 1HZ LYS 850 -13.218 -10.719 -10.735 272 2HZ LYS 850 2HZ LYS 850 -13.389 -11.777 -9.420 273 3HZ LYS 850 3HZ LYS 850 -14.152 -10.259 -9.394 274 HA ARG 851 HA ARG 851 -6.695 -14.454 -10.992 275 1HB ARG 851 1HB ARG 851 -4.959 -12.151 -10.706 276 2HB ARG 851 2HB ARG 851 -4.310 -13.533 -9.826 277 1HG ARG 851 1HG ARG 851 -5.381 -14.214 -12.484 278 2HG ARG 851 2HG ARG 851 -4.006 -13.111 -12.530 279 1HD ARG 851 1HD ARG 851 -2.545 -14.677 -11.651 280 2HD ARG 851 2HD ARG 851 -3.816 -15.482 -10.709 281 HE ARG 851 HE ARG 851 -4.306 -16.804 -12.609 282 1HH1 ARG 851 1HH1 ARG 851 -5.055 -15.047 -14.677 283 2HH1 ARG 851 2HH1 ARG 851 -3.726 -15.039 -15.788 284 1HH2 ARG 851 1HH2 ARG 851 -1.468 -16.352 -13.508 285 2HH2 ARG 851 2HH2 ARG 851 -1.696 -15.779 -15.127 286 HA ILE 852 HA ILE 852 -6.767 -14.637 -6.374 287 HB ILE 852 HB ILE 852 -4.513 -15.756 -5.614 288 1HG1 ILE 852 1HG1 ILE 852 -2.908 -16.040 -7.419 289 2HG1 ILE 852 2HG1 ILE 852 -3.920 -15.118 -8.526 290 1HG2 ILE 852 1HG2 ILE 852 -6.637 -16.627 -6.908 291 2HG2 ILE 852 2HG2 ILE 852 -5.543 -16.639 -8.292 292 3HG2 ILE 852 3HG2 ILE 852 -5.173 -17.609 -6.867 293 1HD1 ILE 852 1HD1 ILE 852 -2.676 -13.989 -5.999 294 2HD1 ILE 852 2HD1 ILE 852 -2.018 -13.781 -7.622 295 3HD1 ILE 852 3HD1 ILE 852 -3.577 -13.095 -7.216 296 HA THR 853 HA THR 853 -3.534 -11.586 -4.211 297 HB THR 853 HB THR 853 -3.972 -9.150 -4.629 298 HG1 THR 853 HG1 THR 853 -5.564 -10.267 -6.683 299 1HG2 THR 853 1HG2 THR 853 -3.049 -10.970 -6.844 300 2HG2 THR 853 2HG2 THR 853 -2.964 -9.217 -6.994 301 3HG2 THR 853 3HG2 THR 853 -2.073 -10.038 -5.715 302 HA THR 854 HA THR 854 -6.952 -12.083 -1.485 303 HB THR 854 HB THR 854 -4.980 -12.272 -0.022 304 HG1 THR 854 HG1 THR 854 -6.232 -11.933 1.612 305 1HG2 THR 854 1HG2 THR 854 -4.333 -9.766 -0.995 306 2HG2 THR 854 2HG2 THR 854 -4.840 -9.422 0.658 307 3HG2 THR 854 3HG2 THR 854 -3.537 -10.571 0.357 308 HA PRO 855 HA PRO 855 -8.894 -8.226 -2.763 309 1HB PRO 855 1HB PRO 855 -11.052 -8.968 -2.704 310 2HB PRO 855 2HB PRO 855 -11.058 -8.812 -0.943 311 1HG PRO 855 1HG PRO 855 -11.088 -11.223 -2.459 312 2HG PRO 855 2HG PRO 855 -10.923 -11.071 -0.707 313 1HD PRO 855 1HD PRO 855 -8.791 -11.885 -0.927 314 2HD PRO 855 2HD PRO 855 -8.865 -11.746 -2.703 315 HA TYR 856 HA TYR 856 -7.693 -5.556 0.552 316 1HB TYR 856 1HB TYR 856 -8.237 -7.533 1.878 317 2HB TYR 856 2HB TYR 856 -6.681 -8.249 1.503 318 HD1 TYR 856 HD1 TYR 856 -4.566 -6.808 2.247 319 HD2 TYR 856 HD2 TYR 856 -8.518 -6.351 3.860 320 HE1 TYR 856 HE1 TYR 856 -3.620 -5.752 4.264 321 HE2 TYR 856 HE2 TYR 856 -7.570 -5.292 5.880 322 HH TYR 856 HH TYR 856 -4.367 -5.475 6.722 323 HA MET 857 HA MET 857 -3.672 -5.163 -1.499 324 1HB MET 857 1HB MET 857 -4.715 -2.898 -1.715 325 2HB MET 857 2HB MET 857 -4.238 -2.557 -0.055 326 1HG MET 857 1HG MET 857 -1.840 -3.134 -0.812 327 2HG MET 857 2HG MET 857 -2.453 -2.993 -2.456 328 1HE MET 857 1HE MET 857 -3.479 -1.170 -3.454 329 2HE MET 857 2HE MET 857 -4.615 -0.594 -2.241 330 3HE MET 857 3HE MET 857 -3.461 0.525 -2.960 331 HA THR 858 HA THR 858 -1.460 -5.290 2.415 332 HB THR 858 HB THR 858 0.338 -6.974 2.007 333 HG1 THR 858 HG1 THR 858 1.169 -6.881 0.086 334 1HG2 THR 858 1HG2 THR 858 -2.232 -7.332 2.120 335 2HG2 THR 858 2HG2 THR 858 -2.117 -7.603 0.381 336 3HG2 THR 858 3HG2 THR 858 -1.237 -8.649 1.496 337 HA LYS 859 HA LYS 859 1.133 -1.948 3.342 338 1HB LYS 859 1HB LYS 859 1.458 -3.463 5.242 339 2HB LYS 859 2HB LYS 859 2.987 -2.705 4.794 340 1HG LYS 859 1HG LYS 859 2.158 -5.401 3.702 341 2HG LYS 859 2HG LYS 859 3.769 -4.682 3.727 342 1HD LYS 859 1HD LYS 859 3.574 -4.714 6.285 343 2HD LYS 859 2HD LYS 859 2.183 -5.774 6.056 344 1HE LYS 859 1HE LYS 859 3.808 -7.158 4.526 345 2HE LYS 859 2HE LYS 859 5.079 -6.303 5.423 346 1HZ LYS 859 1HZ LYS 859 2.802 -7.489 6.872 347 2HZ LYS 859 2HZ LYS 859 4.096 -8.478 6.399 348 3HZ LYS 859 3HZ LYS 859 4.374 -7.156 7.428 349 HA TYR 860 HA TYR 860 4.982 -3.109 0.794 350 1HB TYR 860 1HB TYR 860 4.990 -5.519 0.618 351 2HB TYR 860 2HB TYR 860 3.690 -5.490 -0.565 352 HD1 TYR 860 HD1 TYR 860 6.048 -2.745 -0.756 353 HD2 TYR 860 HD2 TYR 860 5.337 -6.765 -2.107 354 HE1 TYR 860 HE1 TYR 860 7.668 -2.398 -2.581 355 HE2 TYR 860 HE2 TYR 860 6.972 -6.410 -3.936 356 HH TYR 860 HH TYR 860 7.897 -4.401 -5.225 357 HA GLU 861 HA GLU 861 2.234 -2.395 -3.254 358 1HB GLU 861 1HB GLU 861 -0.194 -2.181 -1.441 359 2HB GLU 861 2HB GLU 861 -0.177 -2.144 -3.200 360 1HG GLU 861 1HG GLU 861 0.282 -4.517 -1.379 361 2HG GLU 861 2HG GLU 861 -0.963 -4.317 -2.607 362 HA ARG 862 HA ARG 862 1.347 1.516 -0.474 363 1HB ARG 862 1HB ARG 862 0.342 0.639 1.496 364 2HB ARG 862 2HB ARG 862 1.769 -0.311 1.893 365 1HG ARG 862 1HG ARG 862 2.166 2.631 1.688 366 2HG ARG 862 2HG ARG 862 1.248 2.062 3.079 367 1HD ARG 862 1HD ARG 862 3.208 0.306 3.300 368 2HD ARG 862 2HD ARG 862 4.111 1.514 2.364 369 HE ARG 862 HE ARG 862 2.772 2.980 4.332 370 1HH1 ARG 862 1HH1 ARG 862 5.756 1.696 3.813 371 2HH1 ARG 862 2HH1 ARG 862 6.191 1.498 5.477 372 1HH2 ARG 862 1HH2 ARG 862 3.000 2.155 6.664 373 2HH2 ARG 862 2HH2 ARG 862 4.631 1.757 7.091 374 HA ALA 863 HA ALA 863 5.883 1.269 1.076 375 1HB ALA 863 2HB ALA 863 6.834 -1.404 0.351 376 2HB ALA 863 3HB ALA 863 7.018 -0.528 1.870 377 3HB ALA 863 1HB ALA 863 5.545 -1.443 1.554 378 HA ARG 864 HA ARG 864 7.005 0.480 -3.392 379 1HB ARG 864 1HB ARG 864 4.789 -1.340 -3.546 380 2HB ARG 864 2HB ARG 864 4.669 -0.242 -4.922 381 1HG ARG 864 1HG ARG 864 7.422 -1.092 -4.471 382 2HG ARG 864 2HG ARG 864 6.352 -2.469 -4.729 383 1HD ARG 864 1HD ARG 864 5.430 -1.156 -6.756 384 2HD ARG 864 2HD ARG 864 6.870 -0.134 -6.579 385 HE ARG 864 HE ARG 864 7.042 -3.109 -6.897 386 1HH1 ARG 864 1HH1 ARG 864 9.634 -2.434 -6.285 387 2HH1 ARG 864 2HH1 ARG 864 10.344 -1.782 -7.722 388 1HH2 ARG 864 1HH2 ARG 864 7.299 -1.163 -9.264 389 2HH2 ARG 864 2HH2 ARG 864 9.022 -1.062 -9.410 390 HA VAL 865 HA VAL 865 3.087 3.445 -4.290 391 HB VAL 865 HB VAL 865 2.498 2.163 -1.719 392 1HG1 VAL 865 1HG1 VAL 865 2.115 5.083 -2.018 393 2HG1 VAL 865 2HG1 VAL 865 0.855 4.138 -1.223 394 3HG1 VAL 865 3HG1 VAL 865 2.497 4.132 -0.582 395 1HG2 VAL 865 1HG2 VAL 865 1.193 2.882 -4.189 396 2HG2 VAL 865 2HG2 VAL 865 0.933 1.507 -3.115 397 3HG2 VAL 865 3HG2 VAL 865 0.166 3.054 -2.765 398 HA LEU 866 HA LEU 866 4.955 6.178 -0.667 399 1HB LEU 866 1HB LEU 866 5.152 5.002 1.304 400 2HB LEU 866 2HB LEU 866 5.612 3.522 0.474 401 HG LEU 866 HG LEU 866 7.619 5.739 0.527 402 1HD1 LEU 866 1HD1 LEU 866 6.551 4.324 2.920 403 2HD1 LEU 866 2HD1 LEU 866 8.304 4.473 2.801 404 3HD1 LEU 866 3HD1 LEU 866 7.293 5.919 2.794 405 1HD2 LEU 866 1HD2 LEU 866 7.498 2.788 0.282 406 2HD2 LEU 866 2HD2 LEU 866 8.612 3.931 -0.467 407 3HD2 LEU 866 3HD2 LEU 866 8.871 3.409 1.196 408 1HA GLY 867 1HA GLY 867 9.156 5.107 -2.535 409 2HA GLY 867 2HA GLY 867 8.784 3.584 -3.347 410 HA THR 868 HA THR 868 7.439 5.844 -6.773 411 HB THR 868 HB THR 868 5.701 3.747 -6.649 412 HG1 THR 868 HG1 THR 868 6.913 4.433 -8.428 413 1HG2 THR 868 1HG2 THR 868 4.089 5.945 -6.080 414 2HG2 THR 868 2HG2 THR 868 3.904 5.749 -7.820 415 3HG2 THR 868 3HG2 THR 868 3.526 4.413 -6.733 416 HA ARG 869 HA ARG 869 4.330 8.884 -4.994 417 1HB ARG 869 1HB ARG 869 4.629 7.536 -2.278 418 2HB ARG 869 2HB ARG 869 3.786 9.068 -2.499 419 1HG ARG 869 1HG ARG 869 3.070 6.519 -3.971 420 2HG ARG 869 2HG ARG 869 2.258 7.073 -2.508 421 1HD ARG 869 1HD ARG 869 2.052 9.335 -3.946 422 2HD ARG 869 2HD ARG 869 2.112 8.168 -5.282 423 HE ARG 869 HE ARG 869 -0.158 8.536 -3.645 424 1HH1 ARG 869 1HH1 ARG 869 1.476 6.215 -5.498 425 2HH1 ARG 869 2HH1 ARG 869 0.485 4.885 -5.000 426 1HH2 ARG 869 1HH2 ARG 869 -1.247 6.716 -2.621 427 2HH2 ARG 869 2HH2 ARG 869 -1.058 5.169 -3.377 428 HA ALA 870 HA ALA 870 8.023 10.183 -1.944 429 1HB ALA 870 3HB ALA 870 8.775 8.085 -1.099 430 2HB ALA 870 2HB ALA 870 10.139 8.715 -2.022 431 3HB ALA 870 1HB ALA 870 9.101 7.473 -2.721 432 HA LEU 871 HA LEU 871 10.300 10.675 -5.956 433 1HB LEU 871 1HB LEU 871 9.379 9.280 -8.261 434 2HB LEU 871 2HB LEU 871 10.924 9.097 -7.444 435 HG LEU 871 HG LEU 871 8.574 7.674 -6.276 436 1HD1 LEU 871 1HD1 LEU 871 9.819 7.127 -8.940 437 2HD1 LEU 871 2HD1 LEU 871 9.325 5.770 -7.926 438 3HD1 LEU 871 3HD1 LEU 871 8.136 6.967 -8.438 439 1HD2 LEU 871 1HD2 LEU 871 11.544 7.210 -6.630 440 2HD2 LEU 871 2HD2 LEU 871 10.657 7.438 -5.123 441 3HD2 LEU 871 3HD2 LEU 871 10.463 5.946 -6.042 442 HA GLN 872 HA GLN 872 6.244 11.764 -8.496 443 1HB GLN 872 1HB GLN 872 5.068 10.374 -6.204 444 2HB GLN 872 2HB GLN 872 4.276 11.922 -6.495 445 1HG GLN 872 1HG GLN 872 3.984 11.269 -8.899 446 2HG GLN 872 2HG GLN 872 3.146 10.183 -7.793 447 2HE2 GLN 872 1HE2 GLN 872 3.377 8.088 -8.598 448 1HE2 GLN 872 2HE2 GLN 872 4.822 7.432 -9.200 449 HA ILE 873 HA ILE 873 6.060 15.240 -5.088 450 HB ILE 873 HB ILE 873 7.090 14.768 -2.725 451 1HG1 ILE 873 1HG1 ILE 873 6.121 12.067 -2.691 452 2HG1 ILE 873 2HG1 ILE 873 7.300 12.198 -3.977 453 1HG2 ILE 873 1HG2 ILE 873 4.446 14.004 -3.866 454 2HG2 ILE 873 2HG2 ILE 873 4.770 13.696 -2.163 455 3HG2 ILE 873 3HG2 ILE 873 4.862 15.336 -2.788 456 1HD1 ILE 873 1HD1 ILE 873 8.259 13.611 -1.674 457 2HD1 ILE 873 2HD1 ILE 873 7.814 11.965 -1.228 458 3HD1 ILE 873 3HD1 ILE 873 8.975 12.247 -2.518 459 HA ALA 874 HA ALA 874 10.796 14.683 -4.334 460 1HB ALA 874 1HB ALA 874 10.715 12.231 -6.099 461 2HB ALA 874 3HB ALA 874 11.055 12.265 -4.370 462 3HB ALA 874 2HB ALA 874 12.199 12.970 -5.508 463 HA MET 875 HA MET 875 10.577 16.097 -8.748 464 1HB MET 875 1HB MET 875 8.469 14.215 -9.143 465 2HB MET 875 2HB MET 875 7.849 15.772 -9.695 466 1HG MET 875 1HG MET 875 8.911 15.064 -11.626 467 2HG MET 875 2HG MET 875 10.239 15.925 -10.849 468 1HE MET 875 2HE MET 875 8.522 13.103 -11.947 469 2HE MET 875 1HE MET 875 9.798 11.961 -12.361 470 3HE MET 875 3HE MET 875 8.922 11.780 -10.843 471 HA CYS 876 HA CYS 876 7.536 19.007 -6.721 472 1HB CYS 876 1HB CYS 876 5.546 17.828 -8.682 473 2HB CYS 876 2HB CYS 876 5.167 19.290 -7.770 474 HG CYS 876 HG CYS 876 7.854 19.623 -9.085 475 HA ALA 877 HA ALA 877 4.582 15.814 -4.517 476 1HB ALA 877 3HB ALA 877 4.751 17.710 -3.270 477 2HB ALA 877 1HB ALA 877 3.929 18.699 -4.478 478 3HB ALA 877 2HB ALA 877 2.995 17.634 -3.425 479 HA PRO 878 HA PRO 878 0.678 15.358 -7.138 480 1HB PRO 878 1HB PRO 878 1.551 12.708 -7.804 481 2HB PRO 878 2HB PRO 878 1.361 14.084 -8.897 482 1HG PRO 878 1HG PRO 878 3.784 12.870 -8.114 483 2HG PRO 878 2HG PRO 878 3.603 14.358 -9.030 484 1HD PRO 878 1HD PRO 878 4.536 15.434 -7.266 485 2HD PRO 878 2HD PRO 878 4.396 13.993 -6.235 486 HA VAL 879 HA VAL 879 1.148 11.578 -3.874 487 HB VAL 879 HB VAL 879 2.866 13.761 -2.795 488 1HG1 VAL 879 1HG1 VAL 879 1.334 13.226 -0.883 489 2HG1 VAL 879 2HG1 VAL 879 1.939 11.574 -0.941 490 3HG1 VAL 879 3HG1 VAL 879 3.024 12.903 -0.575 491 1HG2 VAL 879 1HG2 VAL 879 3.256 11.260 -3.971 492 2HG2 VAL 879 2HG2 VAL 879 4.490 12.260 -3.234 493 3HG2 VAL 879 3HG2 VAL 879 3.683 11.026 -2.283 494 HA MET 880 HA MET 880 -2.456 13.286 -1.985 495 1HB MET 880 1HB MET 880 -1.820 10.741 -1.081 496 2HB MET 880 2HB MET 880 -2.245 11.592 0.403 497 1HG MET 880 1HG MET 880 -3.954 11.527 -2.103 498 2HG MET 880 2HG MET 880 -4.224 10.531 -0.672 499 1HE MET 880 1HE MET 880 -6.490 11.987 -1.678 500 2HE MET 880 2HE MET 880 -6.614 11.333 -0.048 501 3HE MET 880 3HE MET 880 -7.144 12.982 -0.370 502 HA VAL 881 HA VAL 881 -1.000 16.115 1.115 503 HB VAL 881 HB VAL 881 0.956 15.650 2.619 504 1HG1 VAL 881 1HG1 VAL 881 -1.311 14.371 2.681 505 2HG1 VAL 881 2HG1 VAL 881 -0.410 13.023 1.990 506 3HG1 VAL 881 3HG1 VAL 881 0.043 13.673 3.563 507 1HG2 VAL 881 1HG2 VAL 881 2.128 14.577 0.402 508 2HG2 VAL 881 2HG2 VAL 881 2.654 14.232 2.049 509 3HG2 VAL 881 3HG2 VAL 881 1.573 13.115 1.216 510 HA GLU 882 HA GLU 882 2.201 18.455 -0.999 511 1HB GLU 882 1HB GLU 882 -0.047 19.920 0.262 512 2HB GLU 882 2HB GLU 882 1.279 20.918 -0.336 513 1HG GLU 882 1HG GLU 882 0.886 20.369 -2.528 514 2HG GLU 882 2HG GLU 882 0.342 18.738 -2.131 515 HA LEU 883 HA LEU 883 4.638 19.279 2.929 516 1HB LEU 883 1HB LEU 883 5.573 17.073 2.353 517 2HB LEU 883 2HB LEU 883 6.394 17.773 0.960 518 HG LEU 883 HG LEU 883 7.477 19.390 2.680 519 1HD1 LEU 883 1HD1 LEU 883 6.117 17.363 4.404 520 2HD1 LEU 883 2HD1 LEU 883 7.719 17.916 4.895 521 3HD1 LEU 883 3HD1 LEU 883 6.404 19.077 4.703 522 1HD2 LEU 883 1HD2 LEU 883 8.082 16.465 2.307 523 2HD2 LEU 883 2HD2 LEU 883 8.938 17.865 1.661 524 3HD2 LEU 883 3HD2 LEU 883 9.097 17.445 3.366 525 HA GLU 884 HA GLU 884 6.563 22.375 0.041 526 1HB GLU 884 1HB GLU 884 8.545 20.981 1.542 527 2HB GLU 884 2HB GLU 884 9.356 21.757 0.184 528 1HG GLU 884 1HG GLU 884 7.370 23.243 1.909 529 2HG GLU 884 2HG GLU 884 9.084 23.163 2.319 530 1HA GLY 885 1HA GLY 885 6.988 19.819 -4.151 531 2HA GLY 885 2HA GLY 885 8.366 20.896 -3.897 532 HA GLU 886 HA GLU 886 9.910 16.521 -2.066 533 1HB GLU 886 1HB GLU 886 10.497 16.707 -4.347 534 2HB GLU 886 2HB GLU 886 11.352 18.227 -4.094 535 1HG GLU 886 1HG GLU 886 13.029 16.918 -2.694 536 2HG GLU 886 2HG GLU 886 12.241 15.451 -3.271 537 HA THR 887 HA THR 887 13.538 17.591 0.350 538 HB THR 887 HB THR 887 10.923 17.901 1.866 539 HG1 THR 887 HG1 THR 887 12.829 19.811 0.998 540 1HG2 THR 887 1HG2 THR 887 13.710 17.987 2.868 541 2HG2 THR 887 2HG2 THR 887 12.701 19.358 3.328 542 3HG2 THR 887 3HG2 THR 887 12.205 17.718 3.746 543 HA ASP 888 HA ASP 888 12.739 13.971 3.163 544 1HB ASP 888 1HB ASP 888 10.333 14.951 3.610 545 2HB ASP 888 2HB ASP 888 9.843 13.470 2.791 546 HA PRO 889 HA PRO 889 12.973 10.794 0.060 547 1HB PRO 889 1HB PRO 889 13.311 8.737 2.040 548 2HB PRO 889 2HB PRO 889 14.561 9.531 1.077 549 1HG PRO 889 1HG PRO 889 14.136 9.801 3.869 550 2HG PRO 889 2HG PRO 889 15.260 10.727 2.870 551 1HD PRO 889 1HD PRO 889 13.986 12.572 3.288 552 2HD PRO 889 2HD PRO 889 12.710 11.584 4.041 553 HA LEU 890 HA LEU 890 8.624 9.495 0.978 554 1HB LEU 890 1HB LEU 890 10.147 7.616 1.633 555 2HB LEU 890 2HB LEU 890 8.502 7.399 2.202 556 HG LEU 890 HG LEU 890 10.302 6.826 3.887 557 1HD1 LEU 890 1HD1 LEU 890 11.751 8.821 3.249 558 2HD1 LEU 890 2HD1 LEU 890 10.628 9.811 4.180 559 3HD1 LEU 890 3HD1 LEU 890 11.545 8.534 4.975 560 1HD2 LEU 890 1HD2 LEU 890 7.837 7.818 4.293 561 2HD2 LEU 890 2HD2 LEU 890 8.921 7.403 5.617 562 3HD2 LEU 890 3HD2 LEU 890 8.777 9.078 5.090 563 HA LEU 891 HA LEU 891 7.443 11.281 5.478 564 1HB LEU 891 1HB LEU 891 8.606 13.286 5.611 565 2HB LEU 891 2HB LEU 891 8.492 13.552 3.884 566 HG LEU 891 HG LEU 891 7.257 15.223 5.263 567 1HD1 LEU 891 1HD1 LEU 891 6.556 14.272 2.843 568 2HD1 LEU 891 2HD1 LEU 891 5.088 13.891 3.737 569 3HD1 LEU 891 3HD1 LEU 891 5.667 15.550 3.662 570 1HD2 LEU 891 1HD2 LEU 891 6.525 13.621 7.015 571 2HD2 LEU 891 2HD2 LEU 891 5.196 14.588 6.381 572 3HD2 LEU 891 3HD2 LEU 891 5.397 12.918 5.866 573 HA ILE 892 HA ILE 892 4.143 12.828 2.253 574 HB ILE 892 HB ILE 892 6.505 12.686 0.598 575 1HG1 ILE 892 1HG1 ILE 892 4.048 13.994 -0.367 576 2HG1 ILE 892 2HG1 ILE 892 4.642 14.516 1.212 577 1HG2 ILE 892 1HG2 ILE 892 4.035 11.342 -0.426 578 2HG2 ILE 892 2HG2 ILE 892 5.088 12.232 -1.509 579 3HG2 ILE 892 3HG2 ILE 892 5.723 10.870 -0.604 580 1HD1 ILE 892 1HD1 ILE 892 6.584 14.116 -0.988 581 2HD1 ILE 892 2HD1 ILE 892 5.597 15.573 -1.000 582 3HD1 ILE 892 3HD1 ILE 892 6.651 15.228 0.371 583 HA ALA 893 HA ALA 893 4.096 8.335 0.588 584 1HB ALA 893 3HB ALA 893 6.082 7.527 -0.184 585 2HB ALA 893 1HB ALA 893 6.989 8.268 1.132 586 3HB ALA 893 2HB ALA 893 6.156 6.743 1.391 587 HA MET 894 HA MET 894 4.418 7.302 5.268 588 1HB MET 894 1HB MET 894 6.521 8.540 5.702 589 2HB MET 894 2HB MET 894 5.628 10.054 5.728 590 1HG MET 894 1HG MET 894 4.514 9.504 7.738 591 2HG MET 894 2HG MET 894 4.931 7.796 7.600 592 1HE MET 894 2HE MET 894 6.371 11.098 7.137 593 2HE MET 894 1HE MET 894 7.325 11.429 8.578 594 3HE MET 894 3HE MET 894 8.093 10.694 7.175 595 HA LYS 895 HA LYS 895 1.438 11.015 6.300 596 1HB LYS 895 1HB LYS 895 1.025 13.008 5.136 597 2HB LYS 895 2HB LYS 895 1.574 12.338 3.603 598 1HG LYS 895 1HG LYS 895 3.619 12.458 5.702 599 2HG LYS 895 2HG LYS 895 3.717 12.867 3.991 600 1HD LYS 895 1HD LYS 895 2.178 14.890 4.675 601 2HD LYS 895 2HD LYS 895 3.914 14.984 4.968 602 1HE LYS 895 1HE LYS 895 1.707 14.391 6.956 603 2HE LYS 895 2HE LYS 895 3.406 14.006 7.300 604 1HZ LYS 895 1HZ LYS 895 3.983 16.298 6.721 605 2HZ LYS 895 2HZ LYS 895 2.342 16.661 6.486 606 3HZ LYS 895 3HZ LYS 895 2.906 16.244 8.034 607 HA GLU 896 HA GLU 896 -0.742 9.600 2.163 608 1HB GLU 896 1HB GLU 896 1.862 8.916 1.273 609 2HB GLU 896 2HB GLU 896 0.942 7.414 1.285 610 1HG GLU 896 1HG GLU 896 -0.505 8.122 -0.349 611 2HG GLU 896 2HG GLU 896 -0.431 9.807 0.169 612 HA LEU 897 HA LEU 897 -0.877 5.374 4.155 613 1HB LEU 897 1HB LEU 897 1.422 4.528 3.955 614 2HB LEU 897 2HB LEU 897 1.904 5.472 5.362 615 HG LEU 897 HG LEU 897 1.160 2.854 5.493 616 1HD1 LEU 897 1HD1 LEU 897 2.088 4.577 7.229 617 2HD1 LEU 897 2HD1 LEU 897 0.405 4.699 7.742 618 3HD1 LEU 897 3HD1 LEU 897 1.237 3.145 7.809 619 1HD2 LEU 897 1HD2 LEU 897 -1.255 3.878 4.874 620 2HD2 LEU 897 2HD2 LEU 897 -1.079 2.527 5.986 621 3HD2 LEU 897 3HD2 LEU 897 -1.291 4.156 6.613 622 HA LYS 898 HA LYS 898 -0.173 7.281 8.670 623 1HB LYS 898 1HB LYS 898 1.730 8.725 8.092 624 2HB LYS 898 2HB LYS 898 0.668 9.713 7.098 625 1HG LYS 898 1HG LYS 898 1.110 10.733 9.341 626 2HG LYS 898 2HG LYS 898 -0.599 10.423 9.040 627 1HD LYS 898 1HD LYS 898 -0.040 9.692 11.296 628 2HD LYS 898 2HD LYS 898 -0.394 8.280 10.302 629 1HE LYS 898 1HE LYS 898 2.373 8.750 9.967 630 2HE LYS 898 2HE LYS 898 2.057 8.924 11.705 631 1HZ LYS 898 1HZ LYS 898 0.724 6.862 11.572 632 2HZ LYS 898 2HZ LYS 898 1.226 6.663 9.964 633 3HZ LYS 898 3HZ LYS 898 2.368 6.609 11.221 634 HA ALA 899 HA ALA 899 -3.671 9.934 6.978 635 1HB ALA 899 2HB ALA 899 -4.039 10.706 4.659 636 2HB ALA 899 3HB ALA 899 -2.367 10.999 5.129 637 3HB ALA 899 1HB ALA 899 -2.762 9.632 4.087 638 HA ARG 900 HA ARG 900 -3.640 5.085 4.814 639 1HB ARG 900 1HB ARG 900 -4.924 4.367 6.576 640 2HB ARG 900 2HB ARG 900 -4.615 5.962 7.252 641 1HG ARG 900 1HG ARG 900 -6.719 6.648 5.800 642 2HG ARG 900 2HG ARG 900 -7.077 4.926 5.885 643 1HD ARG 900 1HD ARG 900 -6.342 6.364 8.418 644 2HD ARG 900 2HD ARG 900 -7.987 6.533 7.775 645 HE ARG 900 HE ARG 900 -6.926 3.780 7.902 646 1HH1 ARG 900 1HH1 ARG 900 -7.825 5.885 10.287 647 2HH1 ARG 900 2HH1 ARG 900 -9.219 5.005 10.818 648 1HH2 ARG 900 1HH2 ARG 900 -9.172 2.797 8.145 649 2HH2 ARG 900 2HH2 ARG 900 -9.980 3.257 9.606 650 HA LYS 901 HA LYS 901 -6.764 7.175 2.283 651 1HB LYS 901 1HB LYS 901 -6.141 9.147 0.908 652 2HB LYS 901 2HB LYS 901 -4.496 9.037 1.531 653 1HG LYS 901 1HG LYS 901 -7.019 9.654 3.091 654 2HG LYS 901 2HG LYS 901 -5.466 9.302 3.854 655 1HD LYS 901 1HD LYS 901 -4.427 11.197 2.814 656 2HD LYS 901 2HD LYS 901 -5.825 11.467 1.774 657 1HE LYS 901 1HE LYS 901 -7.166 11.764 3.978 658 2HE LYS 901 2HE LYS 901 -5.578 11.965 4.744 659 1HZ LYS 901 1HZ LYS 901 -6.521 13.459 2.353 660 2HZ LYS 901 2HZ LYS 901 -6.475 14.086 3.932 661 3HZ LYS 901 3HZ LYS 901 -5.032 13.669 3.143 662 HA ILE 902 HA ILE 902 -2.410 6.014 -0.646 663 HB ILE 902 HB ILE 902 -4.077 3.820 0.620 664 1HG1 ILE 902 1HG1 ILE 902 -1.398 5.057 1.163 665 2HG1 ILE 902 2HG1 ILE 902 -1.629 3.342 1.504 666 1HG2 ILE 902 1HG2 ILE 902 -2.043 3.831 -1.563 667 2HG2 ILE 902 2HG2 ILE 902 -1.935 2.535 -0.372 668 3HG2 ILE 902 3HG2 ILE 902 -3.411 2.747 -1.312 669 1HD1 ILE 902 1HD1 ILE 902 -3.916 4.657 2.514 670 2HD1 ILE 902 2HD1 ILE 902 -2.611 3.921 3.442 671 3HD1 ILE 902 3HD1 ILE 902 -2.534 5.630 3.014 672 HA PRO 903 HA PRO 903 -6.559 6.140 -2.997 673 1HB PRO 903 1HB PRO 903 -5.705 8.516 -4.367 674 2HB PRO 903 2HB PRO 903 -7.039 8.337 -3.227 675 1HG PRO 903 1HG PRO 903 -4.609 9.739 -2.801 676 2HG PRO 903 2HG PRO 903 -5.868 9.410 -1.608 677 1HD PRO 903 1HD PRO 903 -4.380 8.069 -0.526 678 2HD PRO 903 2HD PRO 903 -3.220 8.180 -1.868 679 HA ILE 904 HA ILE 904 -4.559 4.882 -6.656 680 HB ILE 904 HB ILE 904 -2.379 5.402 -4.862 681 1HG1 ILE 904 1HG1 ILE 904 -2.027 5.642 -7.786 682 2HG1 ILE 904 2HG1 ILE 904 -3.460 6.435 -7.143 683 1HG2 ILE 904 1HG2 ILE 904 -1.988 3.237 -6.919 684 2HG2 ILE 904 2HG2 ILE 904 -0.670 4.318 -6.478 685 3HG2 ILE 904 3HG2 ILE 904 -1.416 3.294 -5.253 686 1HD1 ILE 904 2HD1 ILE 904 -1.840 7.391 -5.337 687 2HD1 ILE 904 3HD1 ILE 904 -0.569 6.953 -6.479 688 3HD1 ILE 904 1HD1 ILE 904 -1.818 8.106 -6.949 689 HA ILE 905 HA ILE 905 -4.915 0.527 -6.834 690 HB ILE 905 HB ILE 905 -6.016 1.503 -8.837 691 1HG1 ILE 905 1HG1 ILE 905 -4.664 -0.596 -10.278 692 2HG1 ILE 905 2HG1 ILE 905 -4.878 -1.085 -8.599 693 1HG2 ILE 905 1HG2 ILE 905 -3.198 1.405 -9.957 694 2HG2 ILE 905 2HG2 ILE 905 -4.637 1.610 -10.954 695 3HG2 ILE 905 3HG2 ILE 905 -4.217 2.828 -9.755 696 1HD1 ILE 905 1HD1 ILE 905 -7.150 0.173 -10.106 697 2HD1 ILE 905 2HD1 ILE 905 -6.808 -1.546 -10.289 698 3HD1 ILE 905 3HD1 ILE 905 -7.209 -0.887 -8.700 699 HA ILE 906 HA ILE 906 -0.711 -0.712 -8.107 700 HB ILE 906 HB ILE 906 -1.742 -1.602 -5.445 701 1HG1 ILE 906 1HG1 ILE 906 0.527 0.055 -6.522 702 2HG1 ILE 906 2HG1 ILE 906 0.483 -0.438 -4.830 703 1HG2 ILE 906 1HG2 ILE 906 0.699 -2.754 -6.794 704 2HG2 ILE 906 2HG2 ILE 906 0.604 -2.611 -5.039 705 3HG2 ILE 906 3HG2 ILE 906 -0.569 -3.601 -5.909 706 1HD1 ILE 906 1HD1 ILE 906 -2.087 0.494 -5.270 707 2HD1 ILE 906 2HD1 ILE 906 -0.788 1.414 -4.509 708 3HD1 ILE 906 3HD1 ILE 906 -1.102 1.590 -6.232 709 HA ARG 907 HA ARG 907 -1.611 -4.776 -9.707 710 1HB ARG 907 1HB ARG 907 0.940 -3.761 -10.888 711 2HB ARG 907 2HB ARG 907 0.321 -5.349 -11.319 712 1HG ARG 907 1HG ARG 907 -0.480 -3.603 -12.882 713 2HG ARG 907 2HG ARG 907 -1.800 -4.373 -12.007 714 1HD ARG 907 1HD ARG 907 -2.206 -2.480 -10.671 715 2HD ARG 907 2HD ARG 907 -0.577 -1.827 -10.933 716 HE ARG 907 HE ARG 907 -2.825 -1.324 -12.638 717 1HH1 ARG 907 1HH1 ARG 907 0.518 -1.049 -12.386 718 2HH1 ARG 907 2HH1 ARG 907 0.801 -0.837 -14.081 719 1HH2 ARG 907 1HH2 ARG 907 -2.469 -1.540 -14.989 720 2HH2 ARG 907 2HH2 ARG 907 -0.888 -1.114 -15.554 721 HA ARG 908 HA ARG 908 0.909 -6.963 -6.767 722 1HB ARG 908 1HB ARG 908 -2.001 -7.713 -6.791 723 2HB ARG 908 2HB ARG 908 -0.873 -8.841 -6.051 724 1HG ARG 908 1HG ARG 908 -0.055 -6.964 -4.598 725 2HG ARG 908 2HG ARG 908 -1.348 -5.959 -5.257 726 1HD ARG 908 1HD ARG 908 -2.950 -6.989 -3.953 727 2HD ARG 908 2HD ARG 908 -2.286 -8.604 -4.305 728 HE ARG 908 HE ARG 908 -0.918 -6.757 -2.384 729 1HH1 ARG 908 1HH1 ARG 908 -3.061 -9.330 -2.495 730 2HH1 ARG 908 2HH1 ARG 908 -2.146 -10.370 -1.455 731 1HH2 ARG 908 1HH2 ARG 908 0.634 -8.301 -1.389 732 2HH2 ARG 908 2HH2 ARG 908 -0.056 -9.788 -0.829 733 HA TYR 909 HA TYR 909 1.110 -10.243 -9.919 734 1HB TYR 909 1HB TYR 909 4.002 -9.544 -10.116 735 2HB TYR 909 2HB TYR 909 2.941 -10.204 -11.340 736 HD1 TYR 909 HD1 TYR 909 4.044 -7.090 -9.671 737 HD2 TYR 909 HD2 TYR 909 1.598 -8.773 -12.755 738 HE1 TYR 909 HE1 TYR 909 3.833 -4.875 -10.690 739 HE2 TYR 909 HE2 TYR 909 1.386 -6.557 -13.792 740 HH TYR 909 HH TYR 909 2.732 -4.406 -13.825 741 HA LEU 910 HA LEU 910 3.774 -12.455 -7.069 742 1HB LEU 910 1HB LEU 910 2.434 -14.508 -6.702 743 2HB LEU 910 2HB LEU 910 1.685 -14.265 -8.284 744 HG LEU 910 HG LEU 910 0.689 -12.183 -7.576 745 1HD1 LEU 910 1HD1 LEU 910 -0.363 -14.417 -6.977 746 2HD1 LEU 910 2HD1 LEU 910 0.256 -14.170 -5.346 747 3HD1 LEU 910 3HD1 LEU 910 -0.907 -13.035 -6.029 748 1HD2 LEU 910 1HD2 LEU 910 2.747 -12.165 -5.646 749 2HD2 LEU 910 2HD2 LEU 910 1.472 -10.967 -5.856 750 3HD2 LEU 910 3HD2 LEU 910 1.245 -12.310 -4.740 751 HA PRO 911 HA PRO 911 6.830 -14.408 -9.738 752 1HB PRO 911 1HB PRO 911 8.396 -14.778 -7.351 753 2HB PRO 911 2HB PRO 911 8.660 -13.597 -8.637 754 1HG PRO 911 1HG PRO 911 8.014 -11.940 -7.237 755 2HG PRO 911 2HG PRO 911 7.709 -13.122 -5.964 756 1HD PRO 911 1HD PRO 911 5.465 -12.804 -6.225 757 2HD PRO 911 2HD PRO 911 5.771 -11.662 -7.553 758 HA ASP 912 HA ASP 912 5.972 -18.070 -6.642 759 1HB ASP 912 1HB ASP 912 3.685 -16.337 -5.865 760 2HB ASP 912 2HB ASP 912 3.363 -18.070 -5.839 761 1HA GLY 913 1HA GLY 913 3.509 -17.815 -10.970 762 2HA GLY 913 2HA GLY 913 2.948 -19.133 -9.942 763 HA SER 914 HA SER 914 -0.426 -15.932 -11.052 764 1HB SER 914 1HB SER 914 -1.216 -15.140 -8.582 765 2HB SER 914 2HB SER 914 -1.253 -16.818 -9.103 766 HG SER 914 HG SER 914 0.006 -17.061 -7.422 767 HA TYR 915 HA TYR 915 -0.055 -11.502 -9.441 768 1HB TYR 915 1HB TYR 915 1.266 -11.449 -11.332 769 2HB TYR 915 2HB TYR 915 0.154 -12.454 -12.252 770 HD1 TYR 915 HD1 TYR 915 -0.249 -9.078 -10.603 771 HD2 TYR 915 HD2 TYR 915 -0.417 -11.377 -14.231 772 HE1 TYR 915 HE1 TYR 915 -1.043 -7.083 -11.836 773 HE2 TYR 915 HE2 TYR 915 -1.210 -9.380 -15.460 774 HH TYR 915 HH TYR 915 -2.269 -7.277 -15.058 775 HA GLU 916 HA GLU 916 -4.027 -9.704 -10.903 776 1HB GLU 916 1HB GLU 916 -3.950 -10.890 -8.424 777 2HB GLU 916 2HB GLU 916 -4.501 -9.259 -8.048 778 1HG GLU 916 1HG GLU 916 -5.805 -10.425 -10.409 779 2HG GLU 916 2HG GLU 916 -6.120 -11.305 -8.914 780 HA ASP 917 HA ASP 917 -3.243 -5.391 -10.102 781 1HB ASP 917 1HB ASP 917 -4.234 -4.166 -12.003 782 2HB ASP 917 2HB ASP 917 -3.374 -5.603 -12.506 783 HA TRP 918 HA TRP 918 -6.478 -2.487 -8.830 784 1HB TRP 918 1HB TRP 918 -7.897 -3.721 -7.194 785 2HB TRP 918 2HB TRP 918 -7.897 -4.395 -8.802 786 HD1 TRP 918 HD1 TRP 918 -4.769 -5.717 -7.587 787 HE1 TRP 918 HE1 TRP 918 -5.125 -8.090 -6.607 788 HE3 TRP 918 HE3 TRP 918 -9.713 -5.484 -6.832 789 HZ2 TRP 918 HZ2 TRP 918 -7.345 -9.622 -5.503 790 HZ3 TRP 918 HZ3 TRP 918 -10.951 -7.285 -5.745 791 HH2 TRP 918 HH2 TRP 918 -9.790 -9.397 -5.085 792 1HA GLY 919 1HA GLY 919 -4.770 -2.418 -4.578 793 2HA GLY 919 2HA GLY 919 -4.641 -0.820 -5.295 794 HA VAL 920 HA VAL 920 -7.704 0.072 -2.289 795 HB VAL 920 HB VAL 920 -6.722 2.677 -3.500 796 1HG1 VAL 920 1HG1 VAL 920 -8.316 2.009 -1.040 797 2HG1 VAL 920 2HG1 VAL 920 -7.180 3.359 -0.988 798 3HG1 VAL 920 3HG1 VAL 920 -8.504 3.365 -2.154 799 1HG2 VAL 920 1HG2 VAL 920 -5.651 0.689 -1.544 800 2HG2 VAL 920 2HG2 VAL 920 -4.797 1.644 -2.755 801 3HG2 VAL 920 3HG2 VAL 920 -5.317 2.394 -1.250 802 HA ASP 921 HA ASP 921 -10.732 1.890 -5.315 803 1HB ASP 921 1HB ASP 921 -9.172 2.237 -7.236 804 2HB ASP 921 2HB ASP 921 -9.420 0.551 -7.696 805 HA GLU 922 HA GLU 922 -12.321 -2.358 -5.514 806 1HB GLU 922 1HB GLU 922 -10.495 -2.628 -7.369 807 2HB GLU 922 2HB GLU 922 -9.815 -3.822 -6.265 808 1HG GLU 922 1HG GLU 922 -12.061 -4.955 -6.197 809 2HG GLU 922 2HG GLU 922 -11.330 -4.965 -7.802 810 HA LEU 923 HA LEU 923 -10.508 -3.877 -1.601 811 1HB LEU 923 1HB LEU 923 -8.186 -5.002 -1.529 812 2HB LEU 923 2HB LEU 923 -9.286 -5.452 -2.815 813 HG LEU 923 HG LEU 923 -7.859 -3.211 -3.773 814 1HD1 LEU 923 1HD1 LEU 923 -6.050 -5.325 -2.575 815 2HD1 LEU 923 2HD1 LEU 923 -5.542 -4.053 -3.687 816 3HD1 LEU 923 3HD1 LEU 923 -6.130 -3.636 -2.080 817 1HD2 LEU 923 1HD2 LEU 923 -8.386 -5.993 -4.331 818 2HD2 LEU 923 2HD2 LEU 923 -8.222 -4.619 -5.428 819 3HD2 LEU 923 3HD2 LEU 923 -6.789 -5.490 -4.883 820 HA ILE 924 HA ILE 924 -8.155 -1.645 1.353 821 HB ILE 924 HB ILE 924 -6.875 -4.297 1.362 822 1HG1 ILE 924 1HG1 ILE 924 -7.631 -3.911 3.818 823 2HG1 ILE 924 2HG1 ILE 924 -8.457 -2.508 3.141 824 1HG2 ILE 924 1HG2 ILE 924 -4.867 -2.930 1.744 825 2HG2 ILE 924 2HG2 ILE 924 -5.695 -2.101 3.059 826 3HG2 ILE 924 3HG2 ILE 924 -5.342 -3.819 3.185 827 1HD1 ILE 924 3HD1 ILE 924 -8.707 -5.334 2.098 828 2HD1 ILE 924 1HD1 ILE 924 -9.911 -4.506 3.085 829 3HD1 ILE 924 2HD1 ILE 924 -9.539 -3.916 1.465 830 HA ILE 925 HA ILE 925 -4.481 0.386 -0.051 831 HB ILE 925 HB ILE 925 -4.124 2.217 1.615 832 1HG1 ILE 925 1HG1 ILE 925 -6.348 1.271 3.322 833 2HG1 ILE 925 2HG1 ILE 925 -4.859 0.339 3.469 834 1HG2 ILE 925 1HG2 ILE 925 -6.621 1.500 0.323 835 2HG2 ILE 925 2HG2 ILE 925 -6.923 2.439 1.785 836 3HG2 ILE 925 3HG2 ILE 925 -5.887 3.092 0.516 837 1HD1 ILE 925 1HD1 ILE 925 -4.932 3.360 3.619 838 2HD1 ILE 925 2HD1 ILE 925 -5.043 2.324 5.042 839 3HD1 ILE 925 3HD1 ILE 925 -3.591 2.295 4.042 840 HA THR 926 HA THR 926 -0.809 -0.772 2.323 841 HB THR 926 HB THR 926 -1.584 0.987 4.667 842 HG1 THR 926 HG1 THR 926 -0.572 2.596 3.595 843 1HG2 THR 926 1HG2 THR 926 0.216 -0.628 5.153 844 2HG2 THR 926 2HG2 THR 926 1.111 -0.054 3.751 845 3HG2 THR 926 3HG2 THR 926 0.835 1.021 5.117 846 HA ASP 927 HA ASP 927 -3.658 -3.448 4.976 847 1HB ASP 927 1HB ASP 927 -2.905 -3.336 7.364 848 2HB ASP 927 2HB ASP 927 -1.615 -2.922 6.238 No H/Q in entry = 848 Start of MODEL 20 1 HA MET 801 HA MET 801 45.575 20.574 23.826 2 1HB MET 801 1HB MET 801 44.490 21.083 21.118 3 2HB MET 801 2HB MET 801 45.165 19.471 21.359 4 1HG MET 801 1HG MET 801 43.636 18.935 23.041 5 2HG MET 801 2HG MET 801 43.317 20.626 23.427 6 1HE MET 801 2HE MET 801 41.571 21.619 23.109 7 2HE MET 801 3HE MET 801 40.313 21.494 21.872 8 3HE MET 801 1HE MET 801 40.396 20.308 23.172 9 HA SER 802 HA SER 802 49.139 19.230 21.074 10 1HB SER 802 1HB SER 802 49.935 20.338 23.030 11 2HB SER 802 2HB SER 802 49.345 19.059 24.087 12 HG SER 802 HG SER 802 51.518 19.011 22.270 13 HA ASP 803 HA ASP 803 49.668 14.745 22.089 14 1HB ASP 803 1HB ASP 803 49.543 15.290 25.049 15 2HB ASP 803 2HB ASP 803 49.655 13.635 24.450 16 HA ASN 804 HA ASN 804 45.587 12.970 22.752 17 1HB ASN 804 1HB ASN 804 45.448 15.642 21.583 18 2HB ASN 804 2HB ASN 804 44.106 14.629 21.049 19 2HD2 ASN 804 1HD2 ASN 804 45.542 16.222 23.843 20 1HD2 ASN 804 2HD2 ASN 804 44.284 15.867 24.925 21 HA GLU 805 HA GLU 805 46.014 11.007 18.604 22 1HB GLU 805 1HB GLU 805 47.597 9.690 20.218 23 2HB GLU 805 2HB GLU 805 46.209 8.626 20.440 24 1HG GLU 805 1HG GLU 805 46.202 7.947 18.200 25 2HG GLU 805 2HG GLU 805 47.095 9.371 17.666 26 HA ASP 806 HA ASP 806 41.825 9.489 19.178 27 1HB ASP 806 1HB ASP 806 41.890 11.599 17.001 28 2HB ASP 806 2HB ASP 806 40.400 10.875 17.608 29 HA ASN 807 HA ASN 807 41.819 6.879 15.532 30 1HB ASN 807 1HB ASN 807 44.289 7.033 15.731 31 2HB ASN 807 2HB ASN 807 43.790 5.396 15.309 32 2HD2 ASN 807 1HD2 ASN 807 45.199 4.014 16.417 33 1HD2 ASN 807 2HD2 ASN 807 45.603 4.156 18.060 34 HA PHE 808 HA PHE 808 40.854 3.108 18.159 35 1HB PHE 808 1HB PHE 808 39.513 1.785 16.524 36 2HB PHE 808 2HB PHE 808 39.403 3.518 16.219 37 HD1 PHE 808 HD1 PHE 808 40.777 4.553 14.387 38 HD2 PHE 808 HD2 PHE 808 40.504 0.300 14.931 39 HE1 PHE 808 HE1 PHE 808 41.638 4.203 12.089 40 HE2 PHE 808 HE2 PHE 808 41.365 -0.050 12.632 41 HZ PHE 808 HZ PHE 808 41.932 1.902 11.211 42 HA ASP 809 HA ASP 809 43.260 -0.641 16.594 43 1HB ASP 809 1HB ASP 809 43.481 0.305 18.977 44 2HB ASP 809 2HB ASP 809 42.423 -1.016 19.476 45 1HA GLY 810 1HA GLY 810 41.637 -4.589 15.237 46 2HA GLY 810 2HA GLY 810 40.814 -4.369 16.782 47 HA ASP 811 HA ASP 811 37.580 -3.665 13.674 48 1HB ASP 811 1HB ASP 811 39.398 -1.605 13.253 49 2HB ASP 811 2HB ASP 811 38.826 -1.970 11.626 50 HA ASP 812 HA ASP 812 37.818 -5.864 9.789 51 1HB ASP 812 1HB ASP 812 35.345 -4.829 10.365 52 2HB ASP 812 2HB ASP 812 35.535 -4.349 8.679 53 HA PHE 813 HA PHE 813 39.108 -2.688 6.709 54 1HB PHE 813 1HB PHE 813 40.337 -1.543 9.167 55 2HB PHE 813 2HB PHE 813 41.106 -1.118 7.639 56 HD1 PHE 813 HD1 PHE 813 37.570 -1.620 8.808 57 HD2 PHE 813 HD2 PHE 813 40.382 0.918 6.783 58 HE1 PHE 813 HE1 PHE 813 35.764 0.020 8.356 59 HE2 PHE 813 HE2 PHE 813 38.577 2.558 6.331 60 HZ PHE 813 HZ PHE 813 36.269 2.109 7.117 61 HA ASP 814 HA ASP 814 42.539 -5.426 5.846 62 1HB ASP 814 1HB ASP 814 44.313 -5.781 7.560 63 2HB ASP 814 2HB ASP 814 43.604 -4.170 7.676 64 HA ASP 815 HA ASP 815 41.402 -9.643 6.685 65 1HB ASP 815 1HB ASP 815 39.535 -10.213 8.238 66 2HB ASP 815 2HB ASP 815 40.540 -8.906 8.862 67 HA VAL 816 HA VAL 816 38.161 -10.198 3.620 68 HB VAL 816 HB VAL 816 38.384 -8.858 1.523 69 1HG1 VAL 816 3HG1 VAL 816 37.295 -7.898 3.521 70 2HG1 VAL 816 1HG1 VAL 816 38.856 -7.303 4.083 71 3HG1 VAL 816 2HG1 VAL 816 38.147 -6.655 2.604 72 1HG2 VAL 816 1HG2 VAL 816 41.111 -8.834 2.267 73 2HG2 VAL 816 2HG2 VAL 816 40.378 -8.012 0.890 74 3HG2 VAL 816 3HG2 VAL 816 40.556 -7.168 2.427 75 HA GLU 817 HA GLU 817 40.790 -13.013 1.281 76 1HB GLU 817 1HB GLU 817 42.032 -14.681 2.665 77 2HB GLU 817 2HB GLU 817 42.288 -13.027 3.220 78 1HG GLU 817 1HG GLU 817 39.974 -14.407 4.442 79 2HG GLU 817 2HG GLU 817 41.548 -15.083 4.858 80 HA GLU 818 HA GLU 818 37.450 -16.048 1.508 81 1HB GLU 818 1HB GLU 818 36.780 -14.961 4.245 82 2HB GLU 818 2HB GLU 818 35.882 -16.317 3.565 83 1HG GLU 818 1HG GLU 818 37.705 -17.743 3.636 84 2HG GLU 818 2HG GLU 818 38.871 -16.427 3.496 85 HA ASP 819 HA ASP 819 33.954 -13.946 -0.218 86 1HB ASP 819 1HB ASP 819 33.790 -16.881 -0.506 87 2HB ASP 819 2HB ASP 819 32.246 -16.050 -0.692 88 HA GLU 820 HA GLU 820 30.972 -14.119 3.124 89 1HB GLU 820 1HB GLU 820 30.963 -11.367 1.843 90 2HB GLU 820 2HB GLU 820 30.213 -11.736 3.397 91 1HG GLU 820 1HG GLU 820 32.469 -12.609 4.161 92 2HG GLU 820 2HG GLU 820 33.148 -11.931 2.680 93 1HA GLY 821 1HA GLY 821 27.754 -13.780 -0.636 94 2HA GLY 821 2HA GLY 821 26.984 -13.251 0.861 95 HA LEU 822 HA LEU 822 26.920 -9.464 -1.719 96 1HB LEU 822 1HB LEU 822 29.828 -9.774 -1.905 97 2HB LEU 822 2HB LEU 822 29.186 -8.700 -3.148 98 HG LEU 822 HG LEU 822 28.485 -8.451 -0.212 99 1HD1 LEU 822 1HD1 LEU 822 30.680 -7.184 -1.856 100 2HD1 LEU 822 2HD1 LEU 822 30.042 -6.407 -0.406 101 3HD1 LEU 822 3HD1 LEU 822 30.812 -7.991 -0.292 102 1HD2 LEU 822 1HD2 LEU 822 27.560 -7.221 -2.670 103 2HD2 LEU 822 2HD2 LEU 822 26.948 -7.013 -1.029 104 3HD2 LEU 822 3HD2 LEU 822 28.273 -6.006 -1.609 105 HA ASP 823 HA ASP 823 27.329 -10.730 -6.245 106 1HB ASP 823 1HB ASP 823 29.565 -11.789 -6.124 107 2HB ASP 823 2HB ASP 823 28.813 -13.310 -5.642 108 HA ASP 824 HA ASP 824 24.180 -14.003 -5.603 109 1HB ASP 824 1HB ASP 824 26.268 -15.565 -4.892 110 2HB ASP 824 2HB ASP 824 25.236 -15.806 -3.481 111 HA LEU 825 HA LEU 825 22.122 -12.806 -1.814 112 1HB LEU 825 1HB LEU 825 24.779 -12.434 -1.048 113 2HB LEU 825 2HB LEU 825 23.983 -10.950 -0.522 114 HG LEU 825 HG LEU 825 22.531 -13.484 0.029 115 1HD1 LEU 825 1HD1 LEU 825 25.079 -13.790 0.534 116 2HD1 LEU 825 2HD1 LEU 825 24.773 -12.682 1.871 117 3HD1 LEU 825 3HD1 LEU 825 23.908 -14.216 1.782 118 1HD2 LEU 825 1HD2 LEU 825 22.125 -10.906 0.691 119 2HD2 LEU 825 2HD2 LEU 825 21.612 -12.234 1.733 120 3HD2 LEU 825 3HD2 LEU 825 23.122 -11.385 2.064 121 HA GLU 826 HA GLU 826 23.317 -7.587 -2.693 122 1HB GLU 826 1HB GLU 826 22.111 -9.296 -4.471 123 2HB GLU 826 2HB GLU 826 20.713 -8.477 -3.775 124 1HG GLU 826 1HG GLU 826 21.632 -6.304 -4.338 125 2HG GLU 826 2HG GLU 826 23.141 -7.039 -4.880 126 HA ASN 827 HA ASN 827 20.088 -6.994 0.368 127 1HB ASN 827 1HB ASN 827 22.833 -6.263 1.252 128 2HB ASN 827 2HB ASN 827 21.507 -5.568 2.186 129 2HD2 ASN 827 1HD2 ASN 827 22.029 -6.984 4.031 130 1HD2 ASN 827 2HD2 ASN 827 21.638 -8.635 3.992 131 HA ALA 828 HA ALA 828 19.857 -2.628 -1.159 132 1HB ALA 828 1HB ALA 828 18.143 -4.361 -2.933 133 2HB ALA 828 3HB ALA 828 19.499 -3.327 -3.382 134 3HB ALA 828 2HB ALA 828 17.948 -2.608 -2.948 135 HA GLU 829 HA GLU 829 15.805 -2.555 0.994 136 1HB GLU 829 1HB GLU 829 13.685 -2.032 -0.197 137 2HB GLU 829 2HB GLU 829 15.083 -1.364 -1.039 138 1HG GLU 829 1HG GLU 829 15.077 -3.222 -2.616 139 2HG GLU 829 2HG GLU 829 13.769 -4.008 -1.731 140 HA GLU 830 HA GLU 830 15.789 -7.529 1.222 141 1HB GLU 830 1HB GLU 830 14.638 -5.622 2.824 142 2HB GLU 830 2HB GLU 830 13.214 -6.463 2.209 143 1HG GLU 830 1HG GLU 830 14.194 -8.623 2.914 144 2HG GLU 830 2HG GLU 830 15.598 -7.770 3.555 145 HA GLU 831 HA GLU 831 12.988 -6.398 -3.015 146 1HB GLU 831 1HB GLU 831 14.658 -8.499 -2.437 147 2HB GLU 831 2HB GLU 831 13.074 -9.268 -2.325 148 1HG GLU 831 1HG GLU 831 12.524 -8.216 -4.569 149 2HG GLU 831 2HG GLU 831 14.226 -7.763 -4.684 150 1HA GLY 832 1HA GLY 832 9.460 -8.480 -0.733 151 2HA GLY 832 2HA GLY 832 8.787 -7.689 -2.160 152 HA GLN 833 HA GLN 833 8.172 -12.135 -2.911 153 1HB GLN 833 1HB GLN 833 6.746 -13.443 -1.342 154 2HB GLN 833 2HB GLN 833 8.027 -12.583 -0.486 155 1HG GLN 833 1HG GLN 833 6.531 -10.888 0.264 156 2HG GLN 833 2HG GLN 833 5.271 -11.398 -0.862 157 2HE2 GLN 833 1HE2 GLN 833 5.062 -14.110 -0.479 158 1HE2 GLN 833 2HE2 GLN 833 4.683 -14.471 1.137 159 HA GLU 834 HA GLU 834 4.641 -11.009 -5.311 160 1HB GLU 834 1HB GLU 834 3.702 -10.435 -3.064 161 2HB GLU 834 2HB GLU 834 4.201 -8.763 -3.305 162 1HG GLU 834 1HG GLU 834 2.407 -8.315 -4.599 163 2HG GLU 834 2HG GLU 834 2.649 -9.771 -5.560 164 HA ASN 835 HA ASN 835 6.782 -7.792 -7.688 165 1HB ASN 835 1HB ASN 835 4.815 -8.768 -9.760 166 2HB ASN 835 2HB ASN 835 6.412 -8.078 -9.999 167 2HD2 ASN 835 1HD2 ASN 835 5.361 -10.748 -10.958 168 1HD2 ASN 835 2HD2 ASN 835 6.446 -11.892 -10.333 169 HA VAL 836 HA VAL 836 3.160 -5.303 -7.511 170 HB VAL 836 HB VAL 836 4.999 -5.225 -5.396 171 1HG1 VAL 836 1HG1 VAL 836 4.125 -2.417 -6.120 172 2HG1 VAL 836 2HG1 VAL 836 4.895 -2.892 -4.607 173 3HG1 VAL 836 3HG1 VAL 836 5.783 -3.018 -6.124 174 1HG2 VAL 836 1HG2 VAL 836 2.403 -5.493 -5.554 175 2HG2 VAL 836 2HG2 VAL 836 3.128 -4.850 -4.080 176 3HG2 VAL 836 3HG2 VAL 836 2.399 -3.755 -5.255 177 HA GLU 837 HA GLU 837 4.496 -1.773 -9.910 178 1HB GLU 837 1HB GLU 837 2.777 -3.373 -11.272 179 2HB GLU 837 2HB GLU 837 1.754 -1.958 -11.051 180 1HG GLU 837 1HG GLU 837 3.693 -0.570 -11.930 181 2HG GLU 837 2HG GLU 837 2.928 -1.629 -13.116 182 HA ILE 838 HA ILE 838 1.349 0.833 -7.984 183 HB ILE 838 HB ILE 838 3.881 2.366 -8.675 184 1HG1 ILE 838 1HG1 ILE 838 4.210 0.184 -7.521 185 2HG1 ILE 838 2HG1 ILE 838 4.712 1.544 -6.529 186 1HG2 ILE 838 1HG2 ILE 838 1.579 3.089 -6.972 187 2HG2 ILE 838 2HG2 ILE 838 3.168 3.329 -6.252 188 3HG2 ILE 838 3HG2 ILE 838 2.766 4.120 -7.772 189 1HD1 ILE 838 1HD1 ILE 838 2.018 1.226 -5.897 190 2HD1 ILE 838 2HD1 ILE 838 2.621 -0.424 -6.030 191 3HD1 ILE 838 3HD1 ILE 838 3.383 0.704 -4.915 192 HA LEU 839 HA LEU 839 0.014 4.426 -10.432 193 1HB LEU 839 1HB LEU 839 -0.827 1.808 -11.103 194 2HB LEU 839 2HB LEU 839 -2.287 2.796 -11.103 195 HG LEU 839 HG LEU 839 -0.296 4.362 -12.364 196 1HD1 LEU 839 1HD1 LEU 839 -0.184 1.442 -13.086 197 2HD1 LEU 839 2HD1 LEU 839 0.108 2.669 -14.320 198 3HD1 LEU 839 3HD1 LEU 839 1.143 2.590 -12.893 199 1HD2 LEU 839 1HD2 LEU 839 -2.750 4.274 -12.832 200 2HD2 LEU 839 2HD2 LEU 839 -1.775 4.152 -14.297 201 3HD2 LEU 839 3HD2 LEU 839 -2.516 2.708 -13.608 202 HA PRO 840 HA PRO 840 -3.013 6.397 -7.875 203 1HB PRO 840 1HB PRO 840 -3.286 8.313 -9.061 204 2HB PRO 840 2HB PRO 840 -4.466 7.503 -10.095 205 1HG PRO 840 1HG PRO 840 -1.806 8.327 -10.772 206 2HG PRO 840 2HG PRO 840 -2.966 7.479 -11.797 207 1HD PRO 840 1HD PRO 840 -1.682 5.599 -11.662 208 2HD PRO 840 2HD PRO 840 -0.558 6.431 -10.560 209 HA SER 841 HA SER 841 -6.367 3.478 -7.440 210 1HB SER 841 1HB SER 841 -8.208 4.512 -6.514 211 2HB SER 841 2HB SER 841 -7.074 5.850 -6.373 212 HG SER 841 HG SER 841 -8.037 6.856 -7.998 213 1HA GLY 842 1HA GLY 842 -7.640 3.559 -11.661 214 2HA GLY 842 2HA GLY 842 -7.516 1.834 -11.338 215 HA GLU 843 HA GLU 843 -11.958 1.661 -10.051 216 1HB GLU 843 1HB GLU 843 -11.096 2.122 -12.812 217 2HB GLU 843 2HB GLU 843 -12.545 1.121 -12.747 218 1HG GLU 843 1HG GLU 843 -12.472 3.510 -10.966 219 2HG GLU 843 2HG GLU 843 -12.672 3.800 -12.694 220 HA ARG 844 HA ARG 844 -11.514 -2.792 -9.751 221 1HB ARG 844 1HB ARG 844 -12.534 -2.773 -7.717 222 2HB ARG 844 2HB ARG 844 -13.769 -1.644 -8.250 223 1HG ARG 844 1HG ARG 844 -14.935 -3.459 -9.442 224 2HG ARG 844 2HG ARG 844 -13.679 -4.596 -8.952 225 1HD ARG 844 1HD ARG 844 -14.554 -4.823 -6.858 226 2HD ARG 844 2HD ARG 844 -14.862 -3.081 -6.708 227 HE ARG 844 HE ARG 844 -16.625 -4.933 -8.270 228 1HH1 ARG 844 1HH1 ARG 844 -16.232 -1.693 -7.912 229 2HH1 ARG 844 2HH1 ARG 844 -17.781 -1.367 -7.210 230 1HH2 ARG 844 1HH2 ARG 844 -18.548 -4.710 -6.700 231 2HH2 ARG 844 2HH2 ARG 844 -19.093 -3.075 -6.524 232 HA PRO 845 HA PRO 845 -15.411 -3.615 -12.490 233 1HB PRO 845 1HB PRO 845 -16.463 -1.046 -13.247 234 2HB PRO 845 2HB PRO 845 -17.244 -2.291 -12.269 235 1HG PRO 845 1HG PRO 845 -16.249 0.237 -11.387 236 2HG PRO 845 2HG PRO 845 -16.958 -1.046 -10.401 237 1HD PRO 845 1HD PRO 845 -14.901 -1.444 -9.489 238 2HD PRO 845 2HD PRO 845 -14.153 -0.249 -10.572 239 HA GLN 846 HA GLN 846 -13.081 -2.714 -16.159 240 1HB GLN 846 1HB GLN 846 -12.979 -0.467 -15.093 241 2HB GLN 846 2HB GLN 846 -11.434 -0.907 -14.368 242 1HG GLN 846 1HG GLN 846 -10.321 -0.436 -16.269 243 2HG GLN 846 2HG GLN 846 -11.421 -1.430 -17.226 244 2HE2 GLN 846 1HE2 GLN 846 -11.801 1.660 -15.379 245 1HE2 GLN 846 2HE2 GLN 846 -12.546 2.495 -16.656 246 HA ALA 847 HA ALA 847 -8.846 -4.408 -15.219 247 1HB ALA 847 1HB ALA 847 -8.728 -2.751 -13.057 248 2HB ALA 847 2HB ALA 847 -8.513 -4.316 -12.272 249 3HB ALA 847 3HB ALA 847 -7.401 -3.806 -13.542 250 HA ASN 848 HA ASN 848 -11.138 -7.885 -12.866 251 1HB ASN 848 1HB ASN 848 -13.240 -7.100 -13.960 252 2HB ASN 848 2HB ASN 848 -12.679 -7.798 -15.479 253 2HD2 ASN 848 1HD2 ASN 848 -13.932 -9.662 -15.775 254 1HD2 ASN 848 2HD2 ASN 848 -14.170 -10.860 -14.596 255 HA GLN 849 HA GLN 849 -8.565 -10.185 -15.837 256 1HB GLN 849 1HB GLN 849 -7.151 -8.076 -15.709 257 2HB GLN 849 2HB GLN 849 -6.226 -9.566 -15.892 258 1HG GLN 849 1HG GLN 849 -6.790 -8.228 -13.231 259 2HG GLN 849 2HG GLN 849 -5.732 -9.608 -13.514 260 2HE2 GLN 849 1HE2 GLN 849 -3.962 -8.266 -12.570 261 1HE2 GLN 849 2HE2 GLN 849 -3.206 -7.081 -13.505 262 HA LYS 850 HA LYS 850 -7.596 -12.751 -12.103 263 1HB LYS 850 1HB LYS 850 -5.364 -10.783 -11.622 264 2HB LYS 850 2HB LYS 850 -5.395 -12.365 -10.848 265 1HG LYS 850 1HG LYS 850 -5.548 -11.912 -13.841 266 2HG LYS 850 2HG LYS 850 -4.091 -12.380 -12.970 267 1HD LYS 850 1HD LYS 850 -5.508 -14.348 -12.061 268 2HD LYS 850 2HD LYS 850 -6.624 -13.966 -13.374 269 1HE LYS 850 1HE LYS 850 -4.244 -13.965 -14.723 270 2HE LYS 850 2HE LYS 850 -3.944 -15.216 -13.499 271 1HZ LYS 850 1HZ LYS 850 -6.400 -15.049 -15.165 272 2HZ LYS 850 2HZ LYS 850 -5.092 -16.081 -15.497 273 3HZ LYS 850 3HZ LYS 850 -5.994 -16.288 -14.076 274 HA ARG 851 HA ARG 851 -8.074 -10.909 -7.802 275 1HB ARG 851 1HB ARG 851 -9.643 -12.689 -7.042 276 2HB ARG 851 2HB ARG 851 -9.864 -12.291 -8.745 277 1HG ARG 851 1HG ARG 851 -8.571 -14.235 -9.422 278 2HG ARG 851 2HG ARG 851 -8.172 -14.598 -7.742 279 1HD ARG 851 1HD ARG 851 -10.372 -15.285 -7.236 280 2HD ARG 851 2HD ARG 851 -11.055 -14.432 -8.635 281 HE ARG 851 HE ARG 851 -9.771 -17.061 -8.700 282 1HH1 ARG 851 1HH1 ARG 851 -8.285 -16.842 -10.778 283 2HH1 ARG 851 2HH1 ARG 851 -9.220 -16.425 -12.176 284 1HH2 ARG 851 1HH2 ARG 851 -11.973 -15.372 -10.349 285 2HH2 ARG 851 2HH2 ARG 851 -11.307 -15.590 -11.933 286 HA ILE 852 HA ILE 852 -5.678 -14.970 -5.903 287 HB ILE 852 HB ILE 852 -3.218 -15.053 -6.652 288 1HG1 ILE 852 1HG1 ILE 852 -4.402 -13.168 -8.689 289 2HG1 ILE 852 2HG1 ILE 852 -3.086 -14.249 -9.134 290 1HG2 ILE 852 1HG2 ILE 852 -5.327 -16.479 -7.411 291 2HG2 ILE 852 2HG2 ILE 852 -5.014 -15.690 -8.958 292 3HG2 ILE 852 3HG2 ILE 852 -3.763 -16.679 -8.203 293 1HD1 ILE 852 1HD1 ILE 852 -2.436 -13.044 -6.624 294 2HD1 ILE 852 2HD1 ILE 852 -1.614 -12.851 -8.173 295 3HD1 ILE 852 3HD1 ILE 852 -2.935 -11.775 -7.736 296 HA THR 853 HA THR 853 -2.956 -11.210 -4.456 297 HB THR 853 HB THR 853 -4.014 -8.843 -4.991 298 HG1 THR 853 HG1 THR 853 -5.716 -10.181 -6.163 299 1HG2 THR 853 1HG2 THR 853 -1.772 -9.765 -5.722 300 2HG2 THR 853 2HG2 THR 853 -2.562 -10.323 -7.189 301 3HG2 THR 853 3HG2 THR 853 -2.494 -8.604 -6.833 302 HA THR 854 HA THR 854 -6.084 -12.131 -1.362 303 HB THR 854 HB THR 854 -3.873 -10.334 -0.351 304 HG1 THR 854 HG1 THR 854 -4.661 -13.015 0.096 305 1HG2 THR 854 1HG2 THR 854 -6.494 -10.636 0.787 306 2HG2 THR 854 2HG2 THR 854 -5.321 -11.440 1.828 307 3HG2 THR 854 3HG2 THR 854 -5.115 -9.737 1.421 308 HA PRO 855 HA PRO 855 -8.633 -8.603 -2.591 309 1HB PRO 855 1HB PRO 855 -10.650 -9.667 -2.469 310 2HB PRO 855 2HB PRO 855 -10.621 -9.510 -0.709 311 1HG PRO 855 1HG PRO 855 -10.314 -11.897 -2.252 312 2HG PRO 855 2HG PRO 855 -10.190 -11.730 -0.498 313 1HD PRO 855 1HD PRO 855 -7.951 -12.161 -0.664 314 2HD PRO 855 2HD PRO 855 -8.050 -12.154 -2.443 315 HA TYR 856 HA TYR 856 -7.619 -5.837 0.726 316 1HB TYR 856 1HB TYR 856 -8.070 -7.768 2.114 317 2HB TYR 856 2HB TYR 856 -6.530 -8.489 1.697 318 HD1 TYR 856 HD1 TYR 856 -4.385 -7.016 2.379 319 HD2 TYR 856 HD2 TYR 856 -8.291 -6.628 4.122 320 HE1 TYR 856 HE1 TYR 856 -3.387 -5.984 4.382 321 HE2 TYR 856 HE2 TYR 856 -7.288 -5.591 6.127 322 HH TYR 856 HH TYR 856 -4.598 -5.835 7.171 323 HA MET 857 HA MET 857 -3.641 -5.145 -1.280 324 1HB MET 857 1HB MET 857 -4.747 -2.933 -1.391 325 2HB MET 857 2HB MET 857 -4.379 -2.675 0.308 326 1HG MET 857 1HG MET 857 -1.921 -3.370 -0.903 327 2HG MET 857 2HG MET 857 -2.395 -1.791 -0.293 328 1HE MET 857 1HE MET 857 -4.636 -0.874 -1.818 329 2HE MET 857 2HE MET 857 -3.231 0.176 -1.701 330 3HE MET 857 3HE MET 857 -4.024 -0.055 -3.257 331 HA THR 858 HA THR 858 -1.346 -5.438 2.552 332 HB THR 858 HB THR 858 0.480 -7.046 2.068 333 HG1 THR 858 HG1 THR 858 -0.279 -6.531 -0.618 334 1HG2 THR 858 1HG2 THR 858 -2.151 -7.449 0.622 335 2HG2 THR 858 2HG2 THR 858 -1.041 -8.745 1.066 336 3HG2 THR 858 3HG2 THR 858 -1.830 -7.791 2.322 337 HA LYS 859 HA LYS 859 0.952 -1.816 3.283 338 1HB LYS 859 1HB LYS 859 1.330 -3.175 5.282 339 2HB LYS 859 2HB LYS 859 2.832 -2.393 4.793 340 1HG LYS 859 1HG LYS 859 2.064 -5.222 4.017 341 2HG LYS 859 2HG LYS 859 3.620 -4.435 3.748 342 1HD LYS 859 1HD LYS 859 4.236 -4.579 5.978 343 2HD LYS 859 2HD LYS 859 2.566 -4.579 6.546 344 1HE LYS 859 1HE LYS 859 2.315 -6.858 6.232 345 2HE LYS 859 2HE LYS 859 3.460 -6.899 4.877 346 1HZ LYS 859 1HZ LYS 859 4.220 -6.331 7.693 347 2HZ LYS 859 2HZ LYS 859 4.381 -7.850 6.955 348 3HZ LYS 859 3HZ LYS 859 5.273 -6.526 6.373 349 HA TYR 860 HA TYR 860 4.956 -3.000 0.903 350 1HB TYR 860 1HB TYR 860 5.073 -5.362 0.795 351 2HB TYR 860 2HB TYR 860 3.658 -5.483 -0.239 352 HD1 TYR 860 HD1 TYR 860 6.302 -2.910 -0.553 353 HD2 TYR 860 HD2 TYR 860 4.729 -6.569 -2.176 354 HE1 TYR 860 HE1 TYR 860 7.706 -2.608 -2.560 355 HE2 TYR 860 HE2 TYR 860 6.141 -6.253 -4.182 356 HH TYR 860 HH TYR 860 8.721 -4.435 -4.364 357 HA GLU 861 HA GLU 861 2.389 -2.515 -3.269 358 1HB GLU 861 1HB GLU 861 -0.086 -2.688 -1.507 359 2HB GLU 861 2HB GLU 861 -0.111 -2.170 -3.191 360 1HG GLU 861 1HG GLU 861 0.775 -4.345 -3.896 361 2HG GLU 861 2HG GLU 861 0.862 -4.868 -2.212 362 HA ARG 862 HA ARG 862 1.083 1.481 -0.975 363 1HB ARG 862 1HB ARG 862 0.668 -0.225 1.397 364 2HB ARG 862 2HB ARG 862 1.207 1.417 1.755 365 1HG ARG 862 1HG ARG 862 -1.097 0.798 -0.114 366 2HG ARG 862 2HG ARG 862 -1.313 1.152 1.596 367 1HD ARG 862 1HD ARG 862 0.400 3.169 0.480 368 2HD ARG 862 2HD ARG 862 -1.236 3.367 1.137 369 HE ARG 862 HE ARG 862 -0.791 2.399 -1.668 370 1HH1 ARG 862 1HH1 ARG 862 -3.571 2.631 -0.573 371 2HH1 ARG 862 2HH1 ARG 862 -4.061 4.188 -1.149 372 1HH2 ARG 862 1HH2 ARG 862 -0.835 5.222 -1.890 373 2HH2 ARG 862 2HH2 ARG 862 -2.512 5.656 -1.892 374 HA ALA 863 HA ALA 863 5.294 1.487 1.271 375 1HB ALA 863 2HB ALA 863 6.052 -1.386 0.776 376 2HB ALA 863 3HB ALA 863 6.672 -0.285 2.006 377 3HB ALA 863 1HB ALA 863 5.046 -0.948 2.156 378 HA ARG 864 HA ARG 864 7.242 0.507 -2.897 379 1HB ARG 864 1HB ARG 864 5.197 -1.396 -3.341 380 2HB ARG 864 2HB ARG 864 5.091 -0.278 -4.704 381 1HG ARG 864 1HG ARG 864 7.824 -1.135 -3.902 382 2HG ARG 864 2HG ARG 864 6.813 -2.352 -4.668 383 1HD ARG 864 1HD ARG 864 6.315 -0.540 -6.460 384 2HD ARG 864 2HD ARG 864 7.742 0.285 -5.800 385 HE ARG 864 HE ARG 864 8.093 -2.583 -6.395 386 1HH1 ARG 864 1HH1 ARG 864 10.598 -1.777 -6.509 387 2HH1 ARG 864 2HH1 ARG 864 10.896 -1.020 -8.038 388 1HH2 ARG 864 1HH2 ARG 864 7.537 -0.533 -8.750 389 2HH2 ARG 864 2HH2 ARG 864 9.163 -0.317 -9.307 390 HA VAL 865 HA VAL 865 3.437 3.276 -4.623 391 HB VAL 865 HB VAL 865 2.498 2.089 -2.082 392 1HG1 VAL 865 1HG1 VAL 865 1.968 4.933 -2.713 393 2HG1 VAL 865 2HG1 VAL 865 0.661 3.950 -2.060 394 3HG1 VAL 865 3HG1 VAL 865 2.156 4.137 -1.150 395 1HG2 VAL 865 1HG2 VAL 865 1.396 2.803 -4.731 396 2HG2 VAL 865 2HG2 VAL 865 1.491 1.235 -3.935 397 3HG2 VAL 865 3HG2 VAL 865 0.315 2.426 -3.389 398 HA LEU 866 HA LEU 866 4.541 6.323 -0.997 399 1HB LEU 866 1HB LEU 866 5.058 5.765 1.187 400 2HB LEU 866 2HB LEU 866 4.391 4.216 0.710 401 HG LEU 866 HG LEU 866 6.784 3.561 0.037 402 1HD1 LEU 866 1HD1 LEU 866 7.422 6.157 0.398 403 2HD1 LEU 866 2HD1 LEU 866 7.733 5.570 2.027 404 3HD1 LEU 866 3HD1 LEU 866 8.584 4.862 0.656 405 1HD2 LEU 866 1HD2 LEU 866 5.377 3.183 2.288 406 2HD2 LEU 866 2HD2 LEU 866 7.032 2.600 2.109 407 3HD2 LEU 866 3HD2 LEU 866 6.718 4.111 2.961 408 1HA GLY 867 1HA GLY 867 8.983 5.130 -2.161 409 2HA GLY 867 2HA GLY 867 8.672 3.601 -2.989 410 HA THR 868 HA THR 868 7.609 5.893 -6.625 411 HB THR 868 HB THR 868 5.719 5.200 -7.851 412 HG1 THR 868 HG1 THR 868 3.919 5.634 -6.841 413 1HG2 THR 868 1HG2 THR 868 7.243 3.497 -6.473 414 2HG2 THR 868 2HG2 THR 868 5.651 3.052 -5.858 415 3HG2 THR 868 3HG2 THR 868 5.979 2.984 -7.589 416 HA ARG 869 HA ARG 869 4.385 8.964 -5.051 417 1HB ARG 869 1HB ARG 869 4.637 7.819 -2.231 418 2HB ARG 869 2HB ARG 869 3.591 9.160 -2.700 419 1HG ARG 869 1HG ARG 869 3.302 6.606 -4.217 420 2HG ARG 869 2HG ARG 869 2.679 6.646 -2.569 421 1HD ARG 869 1HD ARG 869 0.896 7.896 -3.205 422 2HD ARG 869 2HD ARG 869 1.942 9.058 -4.044 423 HE ARG 869 HE ARG 869 1.152 6.435 -5.265 424 1HH1 ARG 869 1HH1 ARG 869 3.207 7.657 -6.840 425 2HH1 ARG 869 2HH1 ARG 869 2.364 8.733 -7.904 426 1HH2 ARG 869 1HH2 ARG 869 -0.542 8.754 -6.012 427 2HH2 ARG 869 2HH2 ARG 869 0.242 9.354 -7.436 428 HA ALA 870 HA ALA 870 8.062 10.148 -1.913 429 1HB ALA 870 3HB ALA 870 8.602 8.009 -0.993 430 2HB ALA 870 2HB ALA 870 10.057 8.559 -1.823 431 3HB ALA 870 1HB ALA 870 9.007 7.363 -2.582 432 HA LEU 871 HA LEU 871 10.480 10.424 -5.819 433 1HB LEU 871 1HB LEU 871 9.891 8.811 -8.075 434 2HB LEU 871 2HB LEU 871 11.336 8.759 -7.080 435 HG LEU 871 HG LEU 871 8.943 7.297 -6.076 436 1HD1 LEU 871 1HD1 LEU 871 10.634 6.433 -8.427 437 2HD1 LEU 871 2HD1 LEU 871 9.635 5.328 -7.483 438 3HD1 LEU 871 3HD1 LEU 871 8.883 6.639 -8.392 439 1HD2 LEU 871 1HD2 LEU 871 11.949 6.957 -6.111 440 2HD2 LEU 871 2HD2 LEU 871 10.906 7.212 -4.713 441 3HD2 LEU 871 3HD2 LEU 871 10.875 5.668 -5.567 442 HA GLN 872 HA GLN 872 6.834 11.226 -8.858 443 1HB GLN 872 1HB GLN 872 5.362 9.315 -7.683 444 2HB GLN 872 2HB GLN 872 4.647 10.712 -6.883 445 1HG GLN 872 1HG GLN 872 4.465 11.716 -9.270 446 2HG GLN 872 2HG GLN 872 3.328 10.442 -8.829 447 2HE2 GLN 872 1HE2 GLN 872 5.681 11.353 -11.141 448 1HE2 GLN 872 2HE2 GLN 872 5.864 9.844 -11.896 449 HA ILE 873 HA ILE 873 5.712 14.325 -5.336 450 HB ILE 873 HB ILE 873 5.810 13.864 -2.918 451 1HG1 ILE 873 1HG1 ILE 873 7.557 11.682 -3.919 452 2HG1 ILE 873 2HG1 ILE 873 6.468 11.228 -2.617 453 1HG2 ILE 873 1HG2 ILE 873 4.685 11.704 -4.714 454 2HG2 ILE 873 2HG2 ILE 873 4.428 11.683 -2.974 455 3HG2 ILE 873 3HG2 ILE 873 3.824 13.027 -3.940 456 1HD1 ILE 873 1HD1 ILE 873 7.499 13.657 -1.780 457 2HD1 ILE 873 2HD1 ILE 873 8.007 12.063 -1.222 458 3HD1 ILE 873 3HD1 ILE 873 8.876 12.855 -2.537 459 HA ALA 874 HA ALA 874 10.335 14.408 -3.932 460 1HB ALA 874 1HB ALA 874 10.704 12.000 -5.683 461 2HB ALA 874 3HB ALA 874 11.228 12.239 -4.017 462 3HB ALA 874 2HB ALA 874 12.079 13.042 -5.336 463 HA MET 875 HA MET 875 10.462 15.988 -8.379 464 1HB MET 875 1HB MET 875 8.714 13.945 -9.094 465 2HB MET 875 2HB MET 875 7.740 15.389 -9.377 466 1HG MET 875 1HG MET 875 10.573 15.183 -10.397 467 2HG MET 875 2HG MET 875 9.213 14.554 -11.328 468 1HE MET 875 1HE MET 875 7.583 15.620 -12.419 469 2HE MET 875 2HE MET 875 6.782 16.528 -11.141 470 3HE MET 875 3HE MET 875 7.283 17.342 -12.629 471 HA CYS 876 HA CYS 876 7.132 18.552 -6.399 472 1HB CYS 876 1HB CYS 876 6.144 18.558 -8.664 473 2HB CYS 876 2HB CYS 876 5.059 17.244 -8.217 474 HG CYS 876 HG CYS 876 3.511 19.031 -7.478 475 HA ALA 877 HA ALA 877 4.520 14.918 -4.351 476 1HB ALA 877 3HB ALA 877 4.869 16.516 -2.840 477 2HB ALA 877 2HB ALA 877 3.112 16.667 -2.884 478 3HB ALA 877 1HB ALA 877 4.114 17.766 -3.832 479 HA PRO 878 HA PRO 878 0.348 14.443 -6.489 480 1HB PRO 878 1HB PRO 878 0.829 11.653 -6.035 481 2HB PRO 878 2HB PRO 878 0.784 12.497 -7.586 482 1HG PRO 878 1HG PRO 878 3.003 12.086 -7.762 483 2HG PRO 878 2HG PRO 878 3.087 11.518 -6.093 484 1HD PRO 878 1HD PRO 878 4.238 13.433 -5.660 485 2HD PRO 878 2HD PRO 878 3.758 14.173 -7.196 486 HA VAL 879 HA VAL 879 0.599 12.285 -1.908 487 HB VAL 879 HB VAL 879 1.554 15.012 -1.037 488 1HG1 VAL 879 1HG1 VAL 879 0.925 13.259 0.642 489 2HG1 VAL 879 2HG1 VAL 879 2.233 12.257 0.016 490 3HG1 VAL 879 3HG1 VAL 879 2.594 13.799 0.782 491 1HG2 VAL 879 1HG2 VAL 879 3.319 12.827 -2.098 492 2HG2 VAL 879 2HG2 VAL 879 3.151 14.450 -2.756 493 3HG2 VAL 879 3HG2 VAL 879 3.888 14.209 -1.190 494 HA MET 880 HA MET 880 -2.970 14.795 -1.094 495 1HB MET 880 1HB MET 880 -2.637 12.481 0.750 496 2HB MET 880 2HB MET 880 -3.879 13.657 1.188 497 1HG MET 880 1HG MET 880 -3.649 12.438 -1.573 498 2HG MET 880 2HG MET 880 -4.692 11.785 -0.310 499 1HE MET 880 1HE MET 880 -6.147 12.131 -2.589 500 2HE MET 880 2HE MET 880 -7.106 12.129 -1.110 501 3HE MET 880 3HE MET 880 -7.443 13.315 -2.369 502 HA VAL 881 HA VAL 881 -1.302 17.383 2.213 503 HB VAL 881 HB VAL 881 0.714 16.853 3.619 504 1HG1 VAL 881 1HG1 VAL 881 -1.671 15.574 3.600 505 2HG1 VAL 881 2HG1 VAL 881 -0.616 14.202 3.262 506 3HG1 VAL 881 3HG1 VAL 881 -0.385 15.151 4.730 507 1HG2 VAL 881 1HG2 VAL 881 1.624 15.587 1.318 508 2HG2 VAL 881 2HG2 VAL 881 2.340 15.423 2.922 509 3HG2 VAL 881 3HG2 VAL 881 1.165 14.237 2.356 510 HA GLU 882 HA GLU 882 1.796 19.515 -0.214 511 1HB GLU 882 1HB GLU 882 -0.073 21.184 1.384 512 2HB GLU 882 2HB GLU 882 1.243 22.037 0.577 513 1HG GLU 882 1HG GLU 882 0.606 20.870 -1.556 514 2HG GLU 882 2HG GLU 882 -0.800 20.213 -0.719 515 HA LEU 883 HA LEU 883 4.767 20.059 3.399 516 1HB LEU 883 1HB LEU 883 5.233 17.677 2.927 517 2HB LEU 883 2HB LEU 883 6.023 18.132 1.419 518 HG LEU 883 HG LEU 883 7.615 19.545 2.769 519 1HD1 LEU 883 1HD1 LEU 883 6.035 18.248 4.985 520 2HD1 LEU 883 2HD1 LEU 883 7.707 18.745 5.242 521 3HD1 LEU 883 3HD1 LEU 883 6.490 19.941 4.801 522 1HD2 LEU 883 1HD2 LEU 883 7.899 17.035 2.045 523 2HD2 LEU 883 2HD2 LEU 883 9.042 17.735 3.192 524 3HD2 LEU 883 3HD2 LEU 883 7.729 16.709 3.770 525 HA GLU 884 HA GLU 884 6.834 22.503 0.011 526 1HB GLU 884 1HB GLU 884 8.712 20.958 1.501 527 2HB GLU 884 2HB GLU 884 9.495 21.440 -0.003 528 1HG GLU 884 1HG GLU 884 8.343 23.782 0.599 529 2HG GLU 884 2HG GLU 884 8.481 23.135 2.234 530 1HA GLY 885 1HA GLY 885 6.450 19.252 -3.789 531 2HA GLY 885 2HA GLY 885 7.770 20.420 -3.916 532 HA GLU 886 HA GLU 886 9.560 16.217 -1.670 533 1HB GLU 886 1HB GLU 886 9.988 16.262 -4.005 534 2HB GLU 886 2HB GLU 886 10.866 17.787 -3.898 535 1HG GLU 886 1HG GLU 886 12.024 15.665 -2.224 536 2HG GLU 886 2HG GLU 886 12.033 15.274 -3.942 537 HA THR 887 HA THR 887 13.319 17.533 0.374 538 HB THR 887 HB THR 887 11.021 17.668 2.367 539 HG1 THR 887 HG1 THR 887 12.085 19.658 0.651 540 1HG2 THR 887 1HG2 THR 887 13.870 18.509 2.396 541 2HG2 THR 887 2HG2 THR 887 12.707 19.650 3.073 542 3HG2 THR 887 3HG2 THR 887 12.827 18.017 3.730 543 HA ASP 888 HA ASP 888 12.840 13.872 3.262 544 1HB ASP 888 1HB ASP 888 10.416 14.741 3.857 545 2HB ASP 888 2HB ASP 888 9.934 13.275 3.007 546 HA PRO 889 HA PRO 889 13.071 10.789 0.080 547 1HB PRO 889 1HB PRO 889 13.326 8.630 1.964 548 2HB PRO 889 2HB PRO 889 14.608 9.441 1.061 549 1HG PRO 889 1HG PRO 889 14.131 9.593 3.854 550 2HG PRO 889 2HG PRO 889 15.300 10.532 2.921 551 1HD PRO 889 1HD PRO 889 14.065 12.394 3.379 552 2HD PRO 889 2HD PRO 889 12.763 11.407 4.089 553 HA LEU 890 HA LEU 890 8.644 9.590 0.776 554 1HB LEU 890 1HB LEU 890 8.461 7.415 1.814 555 2HB LEU 890 2HB LEU 890 10.139 7.637 1.356 556 HG LEU 890 HG LEU 890 10.213 6.713 3.540 557 1HD1 LEU 890 1HD1 LEU 890 11.635 8.770 3.216 558 2HD1 LEU 890 2HD1 LEU 890 10.383 9.689 4.051 559 3HD1 LEU 890 3HD1 LEU 890 11.244 8.404 4.896 560 1HD2 LEU 890 1HD2 LEU 890 7.671 7.625 3.832 561 2HD2 LEU 890 2HD2 LEU 890 8.651 7.021 5.168 562 3HD2 LEU 890 3HD2 LEU 890 8.536 8.755 4.875 563 HA LEU 891 HA LEU 891 7.394 10.905 5.412 564 1HB LEU 891 1HB LEU 891 8.821 12.721 5.821 565 2HB LEU 891 2HB LEU 891 8.564 13.380 4.215 566 HG LEU 891 HG LEU 891 7.516 14.692 6.054 567 1HD1 LEU 891 1HD1 LEU 891 6.594 14.262 3.550 568 2HD1 LEU 891 2HD1 LEU 891 5.172 13.848 4.507 569 3HD1 LEU 891 3HD1 LEU 891 5.913 15.440 4.665 570 1HD2 LEU 891 1HD2 LEU 891 6.781 12.396 7.166 571 2HD2 LEU 891 2HD2 LEU 891 5.837 13.865 7.409 572 3HD2 LEU 891 3HD2 LEU 891 5.326 12.676 6.211 573 HA ILE 892 HA ILE 892 4.367 13.164 2.345 574 HB ILE 892 HB ILE 892 6.679 12.963 0.606 575 1HG1 ILE 892 1HG1 ILE 892 4.099 14.492 0.446 576 2HG1 ILE 892 2HG1 ILE 892 5.516 14.793 -0.564 577 1HG2 ILE 892 1HG2 ILE 892 4.064 11.965 -0.501 578 2HG2 ILE 892 2HG2 ILE 892 5.282 12.716 -1.513 579 3HG2 ILE 892 3HG2 ILE 892 5.664 11.236 -0.645 580 1HD1 ILE 892 3HD1 ILE 892 6.759 14.886 1.719 581 2HD1 ILE 892 1HD1 ILE 892 5.834 16.285 1.179 582 3HD1 ILE 892 2HD1 ILE 892 5.147 15.184 2.374 583 HA ALA 893 HA ALA 893 3.880 8.841 0.362 584 1HB ALA 893 3HB ALA 893 5.591 7.658 -0.487 585 2HB ALA 893 1HB ALA 893 6.719 8.586 0.492 586 3HB ALA 893 2HB ALA 893 6.001 7.116 1.137 587 HA MET 894 HA MET 894 4.014 7.112 4.741 588 1HB MET 894 1HB MET 894 6.270 7.710 5.398 589 2HB MET 894 2HB MET 894 5.836 9.412 5.522 590 1HG MET 894 1HG MET 894 4.409 8.956 7.443 591 2HG MET 894 2HG MET 894 4.693 7.224 7.282 592 1HE MET 894 3HE MET 894 6.349 10.464 7.045 593 2HE MET 894 2HE MET 894 7.471 10.586 8.406 594 3HE MET 894 1HE MET 894 7.996 9.852 6.895 595 HA LYS 895 HA LYS 895 1.888 11.012 6.693 596 1HB LYS 895 1HB LYS 895 3.310 12.852 6.197 597 2HB LYS 895 2HB LYS 895 3.167 12.595 4.459 598 1HG LYS 895 1HG LYS 895 1.304 13.856 4.325 599 2HG LYS 895 2HG LYS 895 0.575 13.069 5.723 600 1HD LYS 895 1HD LYS 895 2.840 14.815 6.412 601 2HD LYS 895 2HD LYS 895 1.486 15.674 5.677 602 1HE LYS 895 1HE LYS 895 0.010 15.095 7.403 603 2HE LYS 895 2HE LYS 895 0.964 13.674 7.872 604 1HZ LYS 895 1HZ LYS 895 2.019 16.439 8.046 605 2HZ LYS 895 2HZ LYS 895 1.225 15.685 9.344 606 3HZ LYS 895 3HZ LYS 895 2.669 15.031 8.734 607 HA GLU 896 HA GLU 896 -0.811 11.109 2.733 608 1HB GLU 896 1HB GLU 896 1.084 11.191 1.044 609 2HB GLU 896 2HB GLU 896 -0.368 10.359 0.519 610 1HG GLU 896 1HG GLU 896 2.150 9.051 1.559 611 2HG GLU 896 2HG GLU 896 0.685 8.196 1.091 612 HA LEU 897 HA LEU 897 -1.252 6.442 2.943 613 1HB LEU 897 1HB LEU 897 1.035 5.665 2.335 614 2HB LEU 897 2HB LEU 897 1.514 5.842 4.023 615 HG LEU 897 HG LEU 897 0.579 3.516 2.970 616 1HD1 LEU 897 1HD1 LEU 897 0.385 4.676 5.748 617 2HD1 LEU 897 2HD1 LEU 897 -0.088 3.009 5.419 618 3HD1 LEU 897 3HD1 LEU 897 1.569 3.532 5.115 619 1HD2 LEU 897 1HD2 LEU 897 -1.687 4.791 2.676 620 2HD2 LEU 897 2HD2 LEU 897 -1.727 3.189 3.400 621 3HD2 LEU 897 3HD2 LEU 897 -1.834 4.613 4.422 622 HA LYS 898 HA LYS 898 -0.346 6.467 7.793 623 1HB LYS 898 1HB LYS 898 1.727 7.805 7.702 624 2HB LYS 898 2HB LYS 898 0.781 9.216 7.230 625 1HG LYS 898 1HG LYS 898 -0.204 9.438 9.334 626 2HG LYS 898 2HG LYS 898 0.115 7.760 9.773 627 1HD LYS 898 1HD LYS 898 2.657 8.709 9.365 628 2HD LYS 898 2HD LYS 898 1.849 10.133 10.023 629 1HE LYS 898 1HE LYS 898 0.965 7.950 11.601 630 2HE LYS 898 2HE LYS 898 2.722 7.763 11.428 631 1HZ LYS 898 1HZ LYS 898 2.971 10.122 11.971 632 2HZ LYS 898 2HZ LYS 898 1.295 10.248 12.220 633 3HZ LYS 898 3HZ LYS 898 2.230 9.270 13.241 634 HA ALA 899 HA ALA 899 -3.437 9.967 7.357 635 1HB ALA 899 3HB ALA 899 -2.185 11.545 6.015 636 2HB ALA 899 2HB ALA 899 -3.788 11.427 5.289 637 3HB ALA 899 1HB ALA 899 -2.423 10.581 4.558 638 HA ARG 900 HA ARG 900 -4.344 6.220 3.663 639 1HB ARG 900 1HB ARG 900 -5.529 5.138 5.286 640 2HB ARG 900 2HB ARG 900 -5.097 6.444 6.382 641 1HG ARG 900 1HG ARG 900 -7.128 7.696 5.452 642 2HG ARG 900 2HG ARG 900 -7.599 6.164 4.715 643 1HD ARG 900 1HD ARG 900 -7.010 5.422 7.323 644 2HD ARG 900 2HD ARG 900 -8.641 5.760 6.710 645 HE ARG 900 HE ARG 900 -6.968 8.035 7.673 646 1HH1 ARG 900 1HH1 ARG 900 -9.866 8.371 7.027 647 2HH1 ARG 900 2HH1 ARG 900 -10.603 8.290 8.593 648 1HH2 ARG 900 1HH2 ARG 900 -7.831 6.872 10.118 649 2HH2 ARG 900 2HH2 ARG 900 -9.451 7.441 10.343 650 HA LYS 901 HA LYS 901 -6.996 9.754 2.499 651 1HB LYS 901 1HB LYS 901 -5.781 11.352 3.905 652 2HB LYS 901 2HB LYS 901 -4.485 11.424 2.712 653 1HG LYS 901 1HG LYS 901 -6.219 13.323 2.648 654 2HG LYS 901 2HG LYS 901 -5.865 12.522 1.121 655 1HD LYS 901 1HD LYS 901 -7.917 11.483 1.024 656 2HD LYS 901 2HD LYS 901 -8.067 11.389 2.779 657 1HE LYS 901 1HE LYS 901 -8.502 13.829 2.875 658 2HE LYS 901 2HE LYS 901 -8.379 13.911 1.106 659 1HZ LYS 901 3HZ LYS 901 -10.128 12.239 0.949 660 2HZ LYS 901 1HZ LYS 901 -10.275 12.211 2.640 661 3HZ LYS 901 2HZ LYS 901 -10.681 13.614 1.779 662 HA ILE 902 HA ILE 902 -4.679 9.662 -1.512 663 HB ILE 902 HB ILE 902 -2.381 8.266 -1.821 664 1HG1 ILE 902 1HG1 ILE 902 -0.968 8.577 0.159 665 2HG1 ILE 902 2HG1 ILE 902 -2.335 9.217 1.063 666 1HG2 ILE 902 1HG2 ILE 902 -2.923 10.726 -2.191 667 2HG2 ILE 902 2HG2 ILE 902 -2.412 10.992 -0.524 668 3HG2 ILE 902 3HG2 ILE 902 -1.266 10.365 -1.708 669 1HD1 ILE 902 1HD1 ILE 902 -3.478 6.947 0.459 670 2HD1 ILE 902 2HD1 ILE 902 -1.836 6.399 0.130 671 3HD1 ILE 902 3HD1 ILE 902 -2.272 6.972 1.735 672 HA PRO 903 HA PRO 903 -6.576 5.417 -1.872 673 1HB PRO 903 1HB PRO 903 -8.647 6.035 -2.579 674 2HB PRO 903 2HB PRO 903 -7.970 6.512 -4.138 675 1HG PRO 903 1HG PRO 903 -8.989 8.219 -2.080 676 2HG PRO 903 2HG PRO 903 -8.242 8.698 -3.607 677 1HD PRO 903 1HD PRO 903 -6.446 9.481 -2.436 678 2HD PRO 903 2HD PRO 903 -7.140 8.855 -0.920 679 HA ILE 904 HA ILE 904 -4.796 4.708 -5.914 680 HB ILE 904 HB ILE 904 -2.992 5.053 -3.711 681 1HG1 ILE 904 1HG1 ILE 904 -2.072 5.489 -6.479 682 2HG1 ILE 904 2HG1 ILE 904 -3.613 6.251 -6.087 683 1HG2 ILE 904 1HG2 ILE 904 -2.100 3.200 -5.928 684 2HG2 ILE 904 2HG2 ILE 904 -1.009 4.007 -4.801 685 3HG2 ILE 904 3HG2 ILE 904 -2.174 2.823 -4.207 686 1HD1 ILE 904 2HD1 ILE 904 -2.233 6.913 -3.869 687 2HD1 ILE 904 3HD1 ILE 904 -0.899 6.822 -5.019 688 3HD1 ILE 904 1HD1 ILE 904 -2.246 7.922 -5.316 689 HA ILE 905 HA ILE 905 -4.890 0.328 -6.350 690 HB ILE 905 HB ILE 905 -6.064 1.346 -8.274 691 1HG1 ILE 905 1HG1 ILE 905 -4.525 -0.583 -9.807 692 2HG1 ILE 905 2HG1 ILE 905 -4.812 -1.173 -8.169 693 1HG2 ILE 905 1HG2 ILE 905 -4.139 2.795 -8.988 694 2HG2 ILE 905 2HG2 ILE 905 -3.344 1.353 -9.615 695 3HG2 ILE 905 3HG2 ILE 905 -4.866 1.897 -10.317 696 1HD1 ILE 905 1HD1 ILE 905 -7.021 0.012 -9.844 697 2HD1 ILE 905 2HD1 ILE 905 -6.617 -1.703 -9.908 698 3HD1 ILE 905 3HD1 ILE 905 -7.165 -0.978 -8.392 699 HA ILE 906 HA ILE 906 -0.670 -0.678 -7.751 700 HB ILE 906 HB ILE 906 -1.567 -1.645 -5.069 701 1HG1 ILE 906 1HG1 ILE 906 0.589 0.096 -6.228 702 2HG1 ILE 906 2HG1 ILE 906 0.660 -0.430 -4.546 703 1HG2 ILE 906 1HG2 ILE 906 0.759 -2.784 -6.591 704 2HG2 ILE 906 2HG2 ILE 906 0.910 -2.529 -4.854 705 3HG2 ILE 906 3HG2 ILE 906 -0.348 -3.592 -5.483 706 1HD1 ILE 906 1HD1 ILE 906 -1.995 0.476 -5.098 707 2HD1 ILE 906 2HD1 ILE 906 -0.820 1.169 -3.992 708 3HD1 ILE 906 3HD1 ILE 906 -0.863 1.698 -5.673 709 HA ARG 907 HA ARG 907 -1.448 -4.772 -9.303 710 1HB ARG 907 1HB ARG 907 1.048 -3.720 -10.617 711 2HB ARG 907 2HB ARG 907 0.272 -5.218 -11.106 712 1HG ARG 907 1HG ARG 907 -1.832 -3.994 -11.507 713 2HG ARG 907 2HG ARG 907 -0.528 -3.375 -12.512 714 1HD ARG 907 1HD ARG 907 -1.967 -2.064 -10.240 715 2HD ARG 907 2HD ARG 907 -0.234 -1.713 -10.409 716 HE ARG 907 HE ARG 907 -0.682 -0.669 -12.505 717 1HH1 ARG 907 1HH1 ARG 907 -2.425 -2.794 -13.675 718 2HH1 ARG 907 2HH1 ARG 907 -3.957 -1.994 -13.786 719 1HH2 ARG 907 1HH2 ARG 907 -3.083 0.555 -11.604 720 2HH2 ARG 907 2HH2 ARG 907 -4.330 -0.099 -12.612 721 HA ARG 908 HA ARG 908 1.589 -6.943 -6.916 722 1HB ARG 908 1HB ARG 908 -0.384 -8.732 -5.811 723 2HB ARG 908 2HB ARG 908 0.605 -7.553 -4.978 724 1HG ARG 908 1HG ARG 908 -1.054 -5.820 -5.333 725 2HG ARG 908 2HG ARG 908 -2.015 -6.885 -6.356 726 1HD ARG 908 1HD ARG 908 -2.895 -6.742 -3.961 727 2HD ARG 908 2HD ARG 908 -2.449 -8.389 -4.448 728 HE ARG 908 HE ARG 908 -0.209 -6.940 -3.290 729 1HH1 ARG 908 1HH1 ARG 908 -3.214 -7.899 -2.098 730 2HH1 ARG 908 2HH1 ARG 908 -2.583 -8.902 -0.836 731 1HH2 ARG 908 1HH2 ARG 908 0.703 -8.641 -1.906 732 2HH2 ARG 908 2HH2 ARG 908 -0.368 -9.322 -0.728 733 HA TYR 909 HA TYR 909 1.005 -10.228 -9.943 734 1HB TYR 909 1HB TYR 909 3.898 -9.658 -10.434 735 2HB TYR 909 2HB TYR 909 2.691 -10.230 -11.557 736 HD1 TYR 909 HD1 TYR 909 3.936 -7.158 -9.796 737 HD2 TYR 909 HD2 TYR 909 1.405 -8.732 -12.869 738 HE1 TYR 909 HE1 TYR 909 3.676 -4.909 -10.729 739 HE2 TYR 909 HE2 TYR 909 1.144 -6.486 -13.811 740 HH TYR 909 HH TYR 909 2.871 -4.189 -13.591 741 HA LEU 910 HA LEU 910 3.803 -12.656 -7.388 742 1HB LEU 910 1HB LEU 910 1.694 -14.415 -8.651 743 2HB LEU 910 2HB LEU 910 2.475 -14.729 -7.098 744 HG LEU 910 HG LEU 910 0.699 -12.375 -7.820 745 1HD1 LEU 910 1HD1 LEU 910 0.373 -14.803 -6.051 746 2HD1 LEU 910 2HD1 LEU 910 -0.661 -13.382 -5.910 747 3HD1 LEU 910 3HD1 LEU 910 -0.633 -14.306 -7.409 748 1HD2 LEU 910 1HD2 LEU 910 2.772 -12.517 -5.885 749 2HD2 LEU 910 2HD2 LEU 910 1.553 -11.259 -6.073 750 3HD2 LEU 910 3HD2 LEU 910 1.247 -12.627 -5.009 751 HA PRO 911 HA PRO 911 6.763 -14.494 -10.249 752 1HB PRO 911 1HB PRO 911 8.418 -14.971 -7.945 753 2HB PRO 911 2HB PRO 911 8.634 -13.729 -9.182 754 1HG PRO 911 1HG PRO 911 8.039 -12.139 -7.686 755 2HG PRO 911 2HG PRO 911 7.802 -13.380 -6.454 756 1HD PRO 911 1HD PRO 911 5.541 -13.093 -6.599 757 2HD PRO 911 2HD PRO 911 5.775 -11.857 -7.854 758 HA ASP 912 HA ASP 912 6.011 -18.271 -7.273 759 1HB ASP 912 1HB ASP 912 3.780 -16.556 -6.313 760 2HB ASP 912 2HB ASP 912 3.460 -18.290 -6.316 761 1HA GLY 913 1HA GLY 913 3.304 -17.924 -11.427 762 2HA GLY 913 2HA GLY 913 2.765 -19.240 -10.386 763 HA SER 914 HA SER 914 -0.586 -15.961 -11.315 764 1HB SER 914 1HB SER 914 -1.387 -15.248 -8.882 765 2HB SER 914 2HB SER 914 -1.266 -16.947 -9.325 766 HG SER 914 HG SER 914 -0.007 -16.984 -7.622 767 HA TYR 915 HA TYR 915 -0.106 -11.585 -9.597 768 1HB TYR 915 1HB TYR 915 1.199 -11.346 -11.450 769 2HB TYR 915 2HB TYR 915 0.270 -12.543 -12.335 770 HD1 TYR 915 HD1 TYR 915 -0.420 -9.053 -11.038 771 HD2 TYR 915 HD2 TYR 915 -0.510 -11.776 -14.363 772 HE1 TYR 915 HE1 TYR 915 -1.356 -7.273 -12.482 773 HE2 TYR 915 HE2 TYR 915 -1.445 -9.994 -15.801 774 HH TYR 915 HH TYR 915 -1.253 -7.109 -15.505 775 HA GLU 916 HA GLU 916 -3.894 -9.521 -11.143 776 1HB GLU 916 1HB GLU 916 -4.824 -11.034 -9.604 777 2HB GLU 916 2HB GLU 916 -4.025 -10.260 -8.247 778 1HG GLU 916 1HG GLU 916 -5.411 -8.253 -8.560 779 2HG GLU 916 2HG GLU 916 -6.416 -9.667 -8.283 780 HA ASP 917 HA ASP 917 -3.106 -5.399 -9.743 781 1HB ASP 917 1HB ASP 917 -3.942 -3.920 -11.530 782 2HB ASP 917 2HB ASP 917 -3.099 -5.332 -12.146 783 HA TRP 918 HA TRP 918 -6.372 -2.591 -8.362 784 1HB TRP 918 1HB TRP 918 -7.796 -3.941 -6.812 785 2HB TRP 918 2HB TRP 918 -7.791 -4.480 -8.469 786 HD1 TRP 918 HD1 TRP 918 -4.702 -5.995 -7.416 787 HE1 TRP 918 HE1 TRP 918 -5.140 -8.438 -6.629 788 HE3 TRP 918 HE3 TRP 918 -9.613 -5.658 -6.495 789 HZ2 TRP 918 HZ2 TRP 918 -7.375 -9.959 -5.552 790 HZ3 TRP 918 HZ3 TRP 918 -10.890 -7.481 -5.510 791 HH2 TRP 918 HH2 TRP 918 -9.796 -9.679 -5.048 792 1HA GLY 919 1HA GLY 919 -4.796 -2.712 -4.058 793 2HA GLY 919 2HA GLY 919 -4.586 -1.117 -4.757 794 HA VAL 920 HA VAL 920 -7.793 -0.138 -1.937 795 HB VAL 920 HB VAL 920 -6.755 2.436 -3.176 796 1HG1 VAL 920 1HG1 VAL 920 -8.567 1.858 -0.876 797 2HG1 VAL 920 2HG1 VAL 920 -7.357 3.122 -0.650 798 3HG1 VAL 920 3HG1 VAL 920 -8.535 3.252 -1.956 799 1HG2 VAL 920 1HG2 VAL 920 -5.725 0.484 -1.202 800 2HG2 VAL 920 2HG2 VAL 920 -4.845 1.598 -2.247 801 3HG2 VAL 920 3HG2 VAL 920 -5.561 2.177 -0.744 802 HA ASP 921 HA ASP 921 -10.671 1.624 -5.137 803 1HB ASP 921 1HB ASP 921 -8.976 1.899 -6.989 804 2HB ASP 921 2HB ASP 921 -9.303 0.228 -7.455 805 HA GLU 922 HA GLU 922 -12.246 -2.632 -5.256 806 1HB GLU 922 1HB GLU 922 -10.528 -2.927 -7.153 807 2HB GLU 922 2HB GLU 922 -9.690 -4.010 -6.043 808 1HG GLU 922 1HG GLU 922 -11.474 -5.559 -6.001 809 2HG GLU 922 2HG GLU 922 -12.642 -4.363 -6.556 810 HA LEU 923 HA LEU 923 -10.423 -4.174 -1.368 811 1HB LEU 923 1HB LEU 923 -8.034 -5.190 -1.260 812 2HB LEU 923 2HB LEU 923 -9.129 -5.712 -2.517 813 HG LEU 923 HG LEU 923 -7.776 -3.431 -3.521 814 1HD1 LEU 923 1HD1 LEU 923 -5.938 -5.515 -2.318 815 2HD1 LEU 923 2HD1 LEU 923 -5.449 -4.299 -3.496 816 3HD1 LEU 923 3HD1 LEU 923 -5.992 -3.809 -1.895 817 1HD2 LEU 923 1HD2 LEU 923 -8.267 -6.232 -4.049 818 2HD2 LEU 923 2HD2 LEU 923 -8.186 -4.859 -5.152 819 3HD2 LEU 923 3HD2 LEU 923 -6.706 -5.684 -4.661 820 HA ILE 924 HA ILE 924 -8.245 -1.970 1.714 821 HB ILE 924 HB ILE 924 -6.884 -4.543 1.643 822 1HG1 ILE 924 1HG1 ILE 924 -7.439 -4.153 4.157 823 2HG1 ILE 924 2HG1 ILE 924 -8.320 -2.758 3.542 824 1HG2 ILE 924 1HG2 ILE 924 -4.845 -3.174 1.882 825 2HG2 ILE 924 2HG2 ILE 924 -5.566 -2.367 3.271 826 3HG2 ILE 924 3HG2 ILE 924 -5.207 -4.088 3.338 827 1HD1 ILE 924 3HD1 ILE 924 -8.622 -5.521 2.378 828 2HD1 ILE 924 1HD1 ILE 924 -9.674 -4.896 3.646 829 3HD1 ILE 924 2HD1 ILE 924 -9.624 -4.105 2.070 830 HA ILE 925 HA ILE 925 -4.783 0.529 0.547 831 HB ILE 925 HB ILE 925 -6.414 1.681 2.098 832 1HG1 ILE 925 1HG1 ILE 925 -3.518 2.307 1.862 833 2HG1 ILE 925 2HG1 ILE 925 -4.922 3.272 1.415 834 1HG2 ILE 925 1HG2 ILE 925 -5.662 -0.021 3.985 835 2HG2 ILE 925 2HG2 ILE 925 -4.490 1.239 4.352 836 3HG2 ILE 925 3HG2 ILE 925 -6.214 1.600 4.399 837 1HD1 ILE 925 2HD1 ILE 925 -5.340 3.661 3.876 838 2HD1 ILE 925 3HD1 ILE 925 -3.791 2.882 4.199 839 3HD1 ILE 925 1HD1 ILE 925 -3.848 4.380 3.270 840 HA THR 926 HA THR 926 -1.047 -0.756 2.721 841 HB THR 926 HB THR 926 -1.725 1.310 4.822 842 HG1 THR 926 HG1 THR 926 0.607 1.721 3.799 843 1HG2 THR 926 1HG2 THR 926 0.463 -0.759 4.890 844 2HG2 THR 926 2HG2 THR 926 0.713 0.829 5.617 845 3HG2 THR 926 3HG2 THR 926 -0.585 -0.213 6.199 846 HA ASP 927 HA ASP 927 -3.814 -3.465 5.352 847 1HB ASP 927 1HB ASP 927 -3.311 -3.187 7.820 848 2HB ASP 927 2HB ASP 927 -1.934 -2.858 6.770 No H/Q in entry = 848 Start of MODEL 21 1 HA MET 801 HA MET 801 15.127 -33.113 6.051 2 1HB MET 801 1HB MET 801 15.528 -34.194 3.323 3 2HB MET 801 2HB MET 801 16.988 -33.584 4.101 4 1HG MET 801 1HG MET 801 16.904 -35.152 5.804 5 2HG MET 801 2HG MET 801 15.153 -35.326 5.699 6 1HE MET 801 1HE MET 801 16.496 -37.399 6.332 7 2HE MET 801 2HE MET 801 15.601 -38.566 5.363 8 3HE MET 801 3HE MET 801 17.354 -38.469 5.215 9 HA SER 802 HA SER 802 16.590 -29.126 4.570 10 1HB SER 802 1HB SER 802 15.632 -27.379 5.982 11 2HB SER 802 2HB SER 802 14.407 -28.610 5.694 12 HG SER 802 HG SER 802 14.855 -29.467 7.723 13 HA ASP 803 HA ASP 803 19.822 -29.469 7.864 14 1HB ASP 803 1HB ASP 803 19.802 -32.140 6.569 15 2HB ASP 803 2HB ASP 803 21.347 -31.626 7.248 16 HA ASN 804 HA ASN 804 22.933 -28.347 4.772 17 1HB ASN 804 1HB ASN 804 20.657 -26.722 4.592 18 2HB ASN 804 2HB ASN 804 21.994 -25.582 4.749 19 2HD2 ASN 804 1HD2 ASN 804 23.640 -25.574 3.055 20 1HD2 ASN 804 2HD2 ASN 804 23.380 -26.351 1.568 21 HA GLU 805 HA GLU 805 25.978 -26.228 7.150 22 1HB GLU 805 1HB GLU 805 26.236 -25.311 4.373 23 2HB GLU 805 2HB GLU 805 26.950 -24.190 5.531 24 1HG GLU 805 1HG GLU 805 28.269 -26.008 6.516 25 2HG GLU 805 2HG GLU 805 27.523 -27.166 5.414 26 HA ASP 806 HA ASP 806 23.759 -22.533 8.408 27 1HB ASP 806 1HB ASP 806 23.256 -24.362 10.085 28 2HB ASP 806 2HB ASP 806 24.690 -23.852 10.977 29 HA ASN 807 HA ASN 807 27.689 -20.541 9.635 30 1HB ASN 807 1HB ASN 807 28.669 -22.466 8.043 31 2HB ASN 807 2HB ASN 807 28.922 -21.093 6.966 32 2HD2 ASN 807 1HD2 ASN 807 31.048 -20.388 7.204 33 1HD2 ASN 807 2HD2 ASN 807 31.861 -20.229 8.685 34 HA PHE 808 HA PHE 808 26.985 -17.252 6.519 35 1HB PHE 808 1HB PHE 808 29.736 -16.587 7.631 36 2HB PHE 808 2HB PHE 808 28.560 -15.403 7.061 37 HD1 PHE 808 HD1 PHE 808 26.056 -15.950 8.082 38 HD2 PHE 808 HD2 PHE 808 29.829 -16.819 9.943 39 HE1 PHE 808 HE1 PHE 808 24.956 -15.962 10.305 40 HE2 PHE 808 HE2 PHE 808 28.729 -16.831 12.166 41 HZ PHE 808 HZ PHE 808 26.293 -16.403 12.347 42 HA ASP 809 HA ASP 809 29.952 -17.302 3.042 43 1HB ASP 809 1HB ASP 809 27.699 -16.072 2.666 44 2HB ASP 809 2HB ASP 809 28.677 -14.608 2.556 45 1HA GLY 810 1HA GLY 810 33.068 -14.087 3.732 46 2HA GLY 810 2HA GLY 810 32.957 -14.160 5.492 47 HA ASP 811 HA ASP 811 36.065 -17.334 5.403 48 1HB ASP 811 1HB ASP 811 37.004 -14.748 4.338 49 2HB ASP 811 2HB ASP 811 38.290 -15.760 4.998 50 HA ASP 812 HA ASP 812 38.032 -16.489 9.326 51 1HB ASP 812 1HB ASP 812 38.874 -18.759 8.137 52 2HB ASP 812 2HB ASP 812 40.439 -18.000 8.429 53 HA PHE 813 HA PHE 813 41.552 -13.700 8.390 54 1HB PHE 813 1HB PHE 813 39.788 -12.868 6.084 55 2HB PHE 813 2HB PHE 813 41.241 -11.954 6.492 56 HD1 PHE 813 HD1 PHE 813 40.120 -15.492 5.928 57 HD2 PHE 813 HD2 PHE 813 43.280 -12.604 5.561 58 HE1 PHE 813 HE1 PHE 813 41.510 -17.165 4.736 59 HE2 PHE 813 HE2 PHE 813 44.670 -14.277 4.370 60 HZ PHE 813 HZ PHE 813 43.786 -16.557 3.958 61 HA ASP 814 HA ASP 814 39.476 -10.699 11.001 62 1HB ASP 814 1HB ASP 814 38.346 -10.347 8.661 63 2HB ASP 814 2HB ASP 814 36.861 -10.786 9.507 64 HA ASP 815 HA ASP 815 37.741 -14.489 13.650 65 1HB ASP 815 1HB ASP 815 36.849 -11.625 14.116 66 2HB ASP 815 2HB ASP 815 36.683 -12.938 15.279 67 HA VAL 816 HA VAL 816 33.132 -12.091 12.181 68 HB VAL 816 HB VAL 816 34.268 -14.543 10.793 69 1HG1 VAL 816 1HG1 VAL 816 31.722 -12.993 10.581 70 2HG1 VAL 816 2HG1 VAL 816 32.441 -13.598 9.089 71 3HG1 VAL 816 3HG1 VAL 816 32.003 -14.722 10.376 72 1HG2 VAL 816 1HG2 VAL 816 35.577 -12.482 10.354 73 2HG2 VAL 816 2HG2 VAL 816 34.700 -13.006 8.916 74 3HG2 VAL 816 3HG2 VAL 816 34.096 -11.654 9.874 75 HA GLU 817 HA GLU 817 31.898 -15.638 14.759 76 1HB GLU 817 1HB GLU 817 34.619 -15.280 15.982 77 2HB GLU 817 2HB GLU 817 33.433 -16.290 16.809 78 1HG GLU 817 1HG GLU 817 33.114 -17.558 14.660 79 2HG GLU 817 2HG GLU 817 34.452 -16.634 13.977 80 HA GLU 818 HA GLU 818 30.577 -12.843 18.056 81 1HB GLU 818 1HB GLU 818 32.821 -11.295 17.116 82 2HB GLU 818 2HB GLU 818 31.536 -10.198 17.623 83 1HG GLU 818 1HG GLU 818 31.648 -10.858 19.819 84 2HG GLU 818 2HG GLU 818 32.098 -12.514 19.407 85 HA ASP 819 HA ASP 819 27.529 -10.466 15.765 86 1HB ASP 819 1HB ASP 819 25.488 -11.889 15.585 87 2HB ASP 819 2HB ASP 819 26.952 -12.777 15.168 88 HA GLU 820 HA GLU 820 25.022 -9.360 19.408 89 1HB GLU 820 1HB GLU 820 24.614 -7.717 16.945 90 2HB GLU 820 2HB GLU 820 23.660 -7.298 18.368 91 1HG GLU 820 1HG GLU 820 26.572 -7.801 18.776 92 2HG GLU 820 2HG GLU 820 26.114 -6.298 17.974 93 1HA GLY 821 1HA GLY 821 21.125 -11.556 17.102 94 2HA GLY 821 2HA GLY 821 20.649 -10.336 18.283 95 HA LEU 822 HA LEU 822 18.930 -8.040 14.881 96 1HB LEU 822 1HB LEU 822 21.075 -6.250 15.840 97 2HB LEU 822 2HB LEU 822 20.362 -5.764 14.304 98 HG LEU 822 HG LEU 822 19.158 -4.754 16.214 99 1HD1 LEU 822 1HD1 LEU 822 18.044 -5.695 14.016 100 2HD1 LEU 822 2HD1 LEU 822 17.303 -6.847 15.126 101 3HD1 LEU 822 3HD1 LEU 822 17.032 -5.117 15.339 102 1HD2 LEU 822 1HD2 LEU 822 19.623 -6.596 17.829 103 2HD2 LEU 822 2HD2 LEU 822 17.911 -6.179 17.767 104 3HD2 LEU 822 3HD2 LEU 822 18.496 -7.625 16.945 105 HA ASP 823 HA ASP 823 21.615 -8.749 11.252 106 1HB ASP 823 1HB ASP 823 23.703 -9.986 13.064 107 2HB ASP 823 2HB ASP 823 23.927 -9.827 11.322 108 HA ASP 824 HA ASP 824 20.728 -13.242 11.052 109 1HB ASP 824 1HB ASP 824 21.489 -13.336 13.665 110 2HB ASP 824 2HB ASP 824 19.853 -13.985 13.789 111 HA LEU 825 HA LEU 825 16.299 -12.541 10.763 112 1HB LEU 825 1HB LEU 825 16.796 -12.704 13.423 113 2HB LEU 825 2HB LEU 825 15.819 -11.235 13.393 114 HG LEU 825 HG LEU 825 14.389 -12.862 11.715 115 1HD1 LEU 825 1HD1 LEU 825 16.164 -14.637 12.719 116 2HD1 LEU 825 2HD1 LEU 825 14.924 -14.725 13.969 117 3HD1 LEU 825 3HD1 LEU 825 14.512 -15.078 12.290 118 1HD2 LEU 825 1HD2 LEU 825 13.718 -11.462 13.774 119 2HD2 LEU 825 2HD2 LEU 825 12.775 -12.918 13.457 120 3HD2 LEU 825 3HD2 LEU 825 14.013 -12.925 14.714 121 HA GLU 826 HA GLU 826 16.324 -7.329 12.273 122 1HB GLU 826 1HB GLU 826 17.704 -8.325 10.139 123 2HB GLU 826 2HB GLU 826 16.217 -7.802 9.350 124 1HG GLU 826 1HG GLU 826 16.753 -5.619 9.579 125 2HG GLU 826 2HG GLU 826 17.178 -5.830 11.278 126 HA ASN 827 HA ASN 827 11.962 -8.311 11.354 127 1HB ASN 827 1HB ASN 827 12.001 -8.630 13.806 128 2HB ASN 827 2HB ASN 827 10.618 -7.647 13.327 129 2HD2 ASN 827 1HD2 ASN 827 10.364 -6.116 14.976 130 1HD2 ASN 827 2HD2 ASN 827 11.618 -5.167 15.615 131 HA ALA 828 HA ALA 828 12.264 -3.699 10.361 132 1HB ALA 828 1HB ALA 828 13.381 -5.283 8.060 133 2HB ALA 828 2HB ALA 828 12.816 -3.634 7.790 134 3HB ALA 828 3HB ALA 828 14.115 -3.944 8.943 135 HA GLU 829 HA GLU 829 8.492 -4.658 7.937 136 1HB GLU 829 1HB GLU 829 8.377 -4.533 5.458 137 2HB GLU 829 2HB GLU 829 9.653 -3.500 6.101 138 1HG GLU 829 1HG GLU 829 11.338 -5.190 5.575 139 2HG GLU 829 2HG GLU 829 10.084 -6.301 5.025 140 HA GLU 830 HA GLU 830 9.461 -9.591 8.553 141 1HB GLU 830 1HB GLU 830 7.182 -8.174 8.840 142 2HB GLU 830 2HB GLU 830 6.818 -8.986 7.316 143 1HG GLU 830 1HG GLU 830 6.833 -11.091 8.270 144 2HG GLU 830 2HG GLU 830 7.975 -10.625 9.532 145 HA GLU 831 HA GLU 831 10.710 -8.602 3.663 146 1HB GLU 831 1HB GLU 831 11.245 -10.730 5.355 147 2HB GLU 831 2HB GLU 831 10.200 -11.459 4.135 148 1HG GLU 831 1HG GLU 831 11.835 -9.990 2.542 149 2HG GLU 831 2HG GLU 831 12.157 -11.670 2.974 150 1HA GLY 832 1HA GLY 832 6.864 -11.039 2.220 151 2HA GLY 832 2HA GLY 832 7.030 -9.478 1.415 152 HA GLN 833 HA GLN 833 7.994 -11.400 -2.404 153 1HB GLN 833 1HB GLN 833 8.109 -13.423 -0.995 154 2HB GLN 833 2HB GLN 833 6.364 -13.636 -1.151 155 1HG GLN 833 1HG GLN 833 6.581 -13.897 -3.572 156 2HG GLN 833 2HG GLN 833 8.318 -13.607 -3.468 157 2HE2 GLN 833 1HE2 GLN 833 9.567 -15.236 -2.067 158 1HE2 GLN 833 2HE2 GLN 833 9.015 -16.842 -2.040 159 HA GLU 834 HA GLU 834 4.502 -10.970 -5.060 160 1HB GLU 834 1HB GLU 834 3.796 -10.144 -2.509 161 2HB GLU 834 2HB GLU 834 3.434 -8.718 -3.483 162 1HG GLU 834 1HG GLU 834 2.177 -10.225 -5.070 163 2HG GLU 834 2HG GLU 834 2.392 -11.529 -3.901 164 HA ASN 835 HA ASN 835 6.456 -7.392 -6.985 165 1HB ASN 835 1HB ASN 835 6.488 -7.637 -9.337 166 2HB ASN 835 2HB ASN 835 4.986 -8.553 -9.364 167 2HD2 ASN 835 1HD2 ASN 835 5.669 -10.568 -10.216 168 1HD2 ASN 835 2HD2 ASN 835 6.930 -11.501 -9.568 169 HA VAL 836 HA VAL 836 2.549 -5.416 -7.523 170 HB VAL 836 HB VAL 836 1.790 -5.053 -5.453 171 1HG1 VAL 836 1HG1 VAL 836 4.674 -5.478 -4.667 172 2HG1 VAL 836 2HG1 VAL 836 3.295 -5.574 -3.572 173 3HG1 VAL 836 3HG1 VAL 836 3.456 -6.729 -4.891 174 1HG2 VAL 836 1HG2 VAL 836 4.010 -3.009 -5.211 175 2HG2 VAL 836 2HG2 VAL 836 2.315 -2.700 -5.573 176 3HG2 VAL 836 3HG2 VAL 836 2.787 -3.272 -3.976 177 HA GLU 837 HA GLU 837 4.149 -1.606 -9.095 178 1HB GLU 837 1HB GLU 837 3.082 -3.197 -10.945 179 2HB GLU 837 2HB GLU 837 1.778 -2.014 -10.885 180 1HG GLU 837 1HG GLU 837 4.266 -0.598 -10.926 181 2HG GLU 837 2HG GLU 837 4.296 -1.795 -12.221 182 HA ILE 838 HA ILE 838 0.410 0.726 -8.070 183 HB ILE 838 HB ILE 838 2.995 1.621 -7.521 184 1HG1 ILE 838 1HG1 ILE 838 0.319 1.869 -6.373 185 2HG1 ILE 838 2HG1 ILE 838 1.401 3.173 -5.894 186 1HG2 ILE 838 1HG2 ILE 838 2.697 3.465 -9.150 187 2HG2 ILE 838 2HG2 ILE 838 1.290 4.012 -8.238 188 3HG2 ILE 838 3HG2 ILE 838 2.892 4.058 -7.500 189 1HD1 ILE 838 2HD1 ILE 838 2.393 0.338 -5.818 190 2HD1 ILE 838 3HD1 ILE 838 2.900 1.721 -4.849 191 3HD1 ILE 838 1HD1 ILE 838 1.365 0.924 -4.513 192 HA LEU 839 HA LEU 839 -0.582 4.140 -10.933 193 1HB LEU 839 1HB LEU 839 -1.504 1.442 -11.286 194 2HB LEU 839 2HB LEU 839 -2.836 2.533 -11.667 195 HG LEU 839 HG LEU 839 -0.739 3.796 -12.901 196 1HD1 LEU 839 1HD1 LEU 839 -0.044 0.955 -12.541 197 2HD1 LEU 839 2HD1 LEU 839 0.031 1.503 -14.216 198 3HD1 LEU 839 3HD1 LEU 839 0.985 2.319 -12.978 199 1HD2 LEU 839 1HD2 LEU 839 -3.125 2.903 -13.658 200 2HD2 LEU 839 2HD2 LEU 839 -1.892 3.296 -14.855 201 3HD2 LEU 839 3HD2 LEU 839 -2.165 1.616 -14.387 202 HA PRO 840 HA PRO 840 -3.826 6.441 -9.040 203 1HB PRO 840 1HB PRO 840 -4.320 7.933 -10.656 204 2HB PRO 840 2HB PRO 840 -5.436 6.778 -11.391 205 1HG PRO 840 1HG PRO 840 -2.894 7.640 -12.396 206 2HG PRO 840 2HG PRO 840 -3.970 6.427 -13.094 207 1HD PRO 840 1HD PRO 840 -2.455 4.814 -12.533 208 2HD PRO 840 2HD PRO 840 -1.441 6.020 -11.702 209 HA SER 841 HA SER 841 -6.618 3.177 -7.908 210 1HB SER 841 1HB SER 841 -8.492 4.215 -6.655 211 2HB SER 841 2HB SER 841 -6.934 4.861 -6.156 212 HG SER 841 HG SER 841 -8.773 6.368 -6.695 213 1HA GLY 842 1HA GLY 842 -9.761 1.586 -10.573 214 2HA GLY 842 2HA GLY 842 -10.339 3.247 -10.435 215 HA GLU 843 HA GLU 843 -7.824 2.892 -14.314 216 1HB GLU 843 1HB GLU 843 -6.607 4.469 -12.618 217 2HB GLU 843 2HB GLU 843 -5.224 3.407 -12.877 218 1HG GLU 843 1HG GLU 843 -6.144 3.893 -15.454 219 2HG GLU 843 2HG GLU 843 -4.761 4.677 -14.689 220 HA ARG 844 HA ARG 844 -5.291 -0.917 -14.522 221 1HB ARG 844 1HB ARG 844 -6.947 -1.910 -13.017 222 2HB ARG 844 2HB ARG 844 -6.586 -3.009 -14.348 223 1HG ARG 844 1HG ARG 844 -8.731 -1.273 -15.148 224 2HG ARG 844 2HG ARG 844 -8.758 -3.025 -14.943 225 1HD ARG 844 1HD ARG 844 -9.738 -2.891 -12.874 226 2HD ARG 844 2HD ARG 844 -8.820 -1.441 -12.427 227 HE ARG 844 HE ARG 844 -10.405 -0.412 -14.347 228 1HH1 ARG 844 1HH1 ARG 844 -12.688 -1.507 -14.735 229 2HH1 ARG 844 2HH1 ARG 844 -13.639 -1.507 -13.289 230 1HH2 ARG 844 1HH2 ARG 844 -10.945 -0.888 -11.198 231 2HH2 ARG 844 2HH2 ARG 844 -12.653 -1.157 -11.286 232 HA PRO 845 HA PRO 845 -7.350 -0.846 -18.926 233 1HB PRO 845 1HB PRO 845 -5.538 1.166 -19.890 234 2HB PRO 845 2HB PRO 845 -7.298 1.251 -19.783 235 1HG PRO 845 1HG PRO 845 -5.376 2.647 -18.188 236 2HG PRO 845 2HG PRO 845 -7.137 2.708 -18.066 237 1HD PRO 845 1HD PRO 845 -7.041 1.555 -16.123 238 2HD PRO 845 2HD PRO 845 -5.268 1.444 -16.257 239 HA GLN 846 HA GLN 846 -3.614 -2.920 -20.157 240 1HB GLN 846 1HB GLN 846 -2.581 -1.899 -18.162 241 2HB GLN 846 2HB GLN 846 -3.151 -3.248 -17.180 242 1HG GLN 846 1HG GLN 846 -1.834 -4.799 -18.647 243 2HG GLN 846 2HG GLN 846 -1.175 -3.388 -19.475 244 2HE2 GLN 846 1HE2 GLN 846 -0.144 -5.551 -17.336 245 1HE2 GLN 846 2HE2 GLN 846 0.764 -4.580 -16.281 246 HA ALA 847 HA ALA 847 -4.894 -7.139 -18.891 247 1HB ALA 847 2HB ALA 847 -4.030 -6.898 -15.991 248 2HB ALA 847 1HB ALA 847 -2.904 -7.075 -17.337 249 3HB ALA 847 3HB ALA 847 -4.045 -8.367 -16.966 250 HA ASN 848 HA ASN 848 -7.880 -5.450 -14.718 251 1HB ASN 848 1HB ASN 848 -8.386 -4.256 -16.856 252 2HB ASN 848 2HB ASN 848 -8.924 -5.787 -17.546 253 2HD2 ASN 848 1HD2 ASN 848 -10.774 -3.668 -17.345 254 1HD2 ASN 848 2HD2 ASN 848 -11.923 -4.034 -16.152 255 HA GLN 849 HA GLN 849 -9.308 -9.666 -14.753 256 1HB GLN 849 1HB GLN 849 -7.228 -11.393 -14.640 257 2HB GLN 849 2HB GLN 849 -7.726 -10.597 -16.122 258 1HG GLN 849 1HG GLN 849 -6.046 -8.825 -15.744 259 2HG GLN 849 2HG GLN 849 -5.295 -10.416 -15.818 260 2HE2 GLN 849 1HE2 GLN 849 -4.606 -7.779 -14.314 261 1HE2 GLN 849 2HE2 GLN 849 -4.318 -8.285 -12.723 262 HA LYS 850 HA LYS 850 -7.266 -10.763 -10.416 263 1HB LYS 850 1HB LYS 850 -9.298 -11.974 -9.600 264 2HB LYS 850 2HB LYS 850 -9.709 -10.605 -10.628 265 1HG LYS 850 1HG LYS 850 -9.591 -12.440 -12.547 266 2HG LYS 850 2HG LYS 850 -11.051 -12.244 -11.574 267 1HD LYS 850 1HD LYS 850 -9.013 -14.422 -11.535 268 2HD LYS 850 2HD LYS 850 -9.721 -13.961 -9.987 269 1HE LYS 850 1HE LYS 850 -11.396 -15.405 -10.584 270 2HE LYS 850 2HE LYS 850 -11.947 -14.072 -11.619 271 1HZ LYS 850 1HZ LYS 850 -9.950 -16.126 -12.414 272 2HZ LYS 850 2HZ LYS 850 -11.580 -16.140 -12.879 273 3HZ LYS 850 3HZ LYS 850 -10.562 -14.883 -13.397 274 HA ARG 851 HA ARG 851 -6.633 -15.327 -10.085 275 1HB ARG 851 1HB ARG 851 -4.815 -13.534 -11.263 276 2HB ARG 851 2HB ARG 851 -3.848 -14.528 -10.175 277 1HG ARG 851 1HG ARG 851 -4.438 -16.522 -11.262 278 2HG ARG 851 2HG ARG 851 -5.872 -15.807 -11.999 279 1HD ARG 851 1HD ARG 851 -3.147 -14.725 -12.698 280 2HD ARG 851 2HD ARG 851 -3.760 -16.182 -13.504 281 HE ARG 851 HE ARG 851 -5.560 -13.823 -13.373 282 1HH1 ARG 851 1HH1 ARG 851 -6.201 -16.096 -15.152 283 2HH1 ARG 851 2HH1 ARG 851 -5.616 -15.559 -16.691 284 1HH2 ARG 851 1HH2 ARG 851 -3.632 -13.047 -15.356 285 2HH2 ARG 851 2HH2 ARG 851 -4.162 -13.831 -16.806 286 HA ILE 852 HA ILE 852 -4.843 -15.281 -5.928 287 HB ILE 852 HB ILE 852 -2.445 -14.720 -5.525 288 1HG1 ILE 852 1HG1 ILE 852 -3.169 -12.598 -7.449 289 2HG1 ILE 852 2HG1 ILE 852 -1.651 -13.401 -7.803 290 1HG2 ILE 852 1HG2 ILE 852 -3.359 -16.448 -7.237 291 2HG2 ILE 852 2HG2 ILE 852 -2.855 -15.280 -8.458 292 3HG2 ILE 852 3HG2 ILE 852 -1.664 -15.975 -7.358 293 1HD1 ILE 852 1HD1 ILE 852 -1.429 -13.057 -5.105 294 2HD1 ILE 852 2HD1 ILE 852 -0.807 -11.910 -6.293 295 3HD1 ILE 852 3HD1 ILE 852 -2.375 -11.640 -5.539 296 HA THR 853 HA THR 853 -3.938 -11.016 -3.711 297 HB THR 853 HB THR 853 -5.061 -8.904 -4.598 298 HG1 THR 853 HG1 THR 853 -6.092 -10.646 -6.244 299 1HG2 THR 853 1HG2 THR 853 -2.619 -9.488 -4.883 300 2HG2 THR 853 2HG2 THR 853 -3.030 -10.134 -6.464 301 3HG2 THR 853 3HG2 THR 853 -3.275 -8.424 -6.126 302 HA THR 854 HA THR 854 -8.026 -11.714 -2.241 303 HB THR 854 HB THR 854 -6.483 -12.380 -0.412 304 HG1 THR 854 HG1 THR 854 -8.150 -12.403 0.838 305 1HG2 THR 854 1HG2 THR 854 -5.795 -9.633 -0.467 306 2HG2 THR 854 2HG2 THR 854 -6.526 -9.931 1.109 307 3HG2 THR 854 3HG2 THR 854 -5.135 -10.883 0.587 308 HA PRO 855 HA PRO 855 -9.822 -7.700 -2.726 309 1HB PRO 855 1HB PRO 855 -12.015 -8.313 -2.591 310 2HB PRO 855 2HB PRO 855 -11.918 -8.275 -0.828 311 1HG PRO 855 1HG PRO 855 -12.162 -10.575 -2.508 312 2HG PRO 855 2HG PRO 855 -11.953 -10.547 -0.754 313 1HD PRO 855 1HD PRO 855 -9.856 -11.430 -1.043 314 2HD PRO 855 2HD PRO 855 -9.994 -11.270 -2.812 315 HA TYR 856 HA TYR 856 -8.264 -5.371 0.705 316 1HB TYR 856 1HB TYR 856 -8.986 -7.490 1.821 317 2HB TYR 856 2HB TYR 856 -7.347 -8.089 1.658 318 HD1 TYR 856 HD1 TYR 856 -5.467 -6.468 2.630 319 HD2 TYR 856 HD2 TYR 856 -9.605 -6.360 3.762 320 HE1 TYR 856 HE1 TYR 856 -4.856 -5.349 4.745 321 HE2 TYR 856 HE2 TYR 856 -8.996 -5.241 5.882 322 HH TYR 856 HH TYR 856 -7.027 -5.027 7.348 323 HA MET 857 HA MET 857 -4.188 -5.336 -1.370 324 1HB MET 857 1HB MET 857 -5.189 -3.025 -1.611 325 2HB MET 857 2HB MET 857 -4.570 -2.657 -0.009 326 1HG MET 857 1HG MET 857 -2.424 -3.811 -1.476 327 2HG MET 857 2HG MET 857 -2.575 -2.145 -0.925 328 1HE MET 857 3HE MET 857 -3.410 -0.239 -2.165 329 2HE MET 857 1HE MET 857 -4.212 -0.263 -3.732 330 3HE MET 857 2HE MET 857 -4.994 -0.996 -2.340 331 HA THR 858 HA THR 858 -2.033 -5.205 2.642 332 HB THR 858 HB THR 858 -0.248 -6.890 2.309 333 HG1 THR 858 HG1 THR 858 0.737 -6.377 0.462 334 1HG2 THR 858 1HG2 THR 858 -2.813 -7.277 2.163 335 2HG2 THR 858 2HG2 THR 858 -2.524 -7.497 0.438 336 3HG2 THR 858 3HG2 THR 858 -1.742 -8.562 1.606 337 HA LYS 859 HA LYS 859 0.554 -1.832 3.581 338 1HB LYS 859 1HB LYS 859 2.384 -2.579 5.084 339 2HB LYS 859 2HB LYS 859 0.831 -3.285 5.530 340 1HG LYS 859 1HG LYS 859 1.468 -5.316 4.155 341 2HG LYS 859 2HG LYS 859 3.084 -4.621 4.008 342 1HD LYS 859 1HD LYS 859 2.965 -4.431 6.613 343 2HD LYS 859 2HD LYS 859 1.685 -5.636 6.469 344 1HE LYS 859 1HE LYS 859 4.141 -6.214 4.902 345 2HE LYS 859 2HE LYS 859 4.311 -6.306 6.666 346 1HZ LYS 859 1HZ LYS 859 2.130 -7.582 5.100 347 2HZ LYS 859 2HZ LYS 859 3.491 -8.401 5.706 348 3HZ LYS 859 3HZ LYS 859 2.368 -7.707 6.775 349 HA TYR 860 HA TYR 860 4.495 -3.245 1.161 350 1HB TYR 860 1HB TYR 860 4.220 -5.625 0.848 351 2HB TYR 860 2HB TYR 860 2.950 -5.376 -0.342 352 HD1 TYR 860 HD1 TYR 860 3.564 -3.850 -2.374 353 HD2 TYR 860 HD2 TYR 860 6.487 -5.765 0.117 354 HE1 TYR 860 HE1 TYR 860 5.262 -3.518 -4.125 355 HE2 TYR 860 HE2 TYR 860 8.185 -5.432 -1.654 356 HH TYR 860 HH TYR 860 8.416 -4.995 -3.935 357 HA GLU 861 HA GLU 861 1.877 -1.998 -2.842 358 1HB GLU 861 1HB GLU 861 -0.342 -2.759 -2.673 359 2HB GLU 861 2HB GLU 861 -0.452 -2.339 -0.964 360 1HG GLU 861 1HG GLU 861 -0.022 -0.044 -2.783 361 2HG GLU 861 2HG GLU 861 -1.568 -0.843 -2.972 362 HA ARG 862 HA ARG 862 1.212 1.816 0.166 363 1HB ARG 862 1HB ARG 862 0.194 0.641 2.071 364 2HB ARG 862 2HB ARG 862 1.749 -0.068 2.481 365 1HG ARG 862 1HG ARG 862 1.584 2.908 2.259 366 2HG ARG 862 2HG ARG 862 0.910 2.142 3.694 367 1HD ARG 862 1HD ARG 862 3.536 1.041 3.002 368 2HD ARG 862 2HD ARG 862 3.592 2.782 3.342 369 HE ARG 862 HE ARG 862 1.939 1.345 5.254 370 1HH1 ARG 862 1HH1 ARG 862 5.077 0.638 4.596 371 2HH1 ARG 862 2HH1 ARG 862 5.742 1.211 6.088 372 1HH2 ARG 862 1HH2 ARG 862 2.818 2.775 7.097 373 2HH2 ARG 862 2HH2 ARG 862 4.463 2.421 7.504 374 HA ALA 863 HA ALA 863 5.762 1.150 1.508 375 1HB ALA 863 2HB ALA 863 6.035 -1.731 0.665 376 2HB ALA 863 3HB ALA 863 7.036 -0.824 1.800 377 3HB ALA 863 1HB ALA 863 5.401 -1.305 2.255 378 HA ARG 864 HA ARG 864 6.795 0.406 -3.002 379 1HB ARG 864 1HB ARG 864 4.474 -1.260 -3.192 380 2HB ARG 864 2HB ARG 864 4.385 -0.097 -4.517 381 1HG ARG 864 1HG ARG 864 5.638 -2.073 -5.239 382 2HG ARG 864 2HG ARG 864 6.737 -1.901 -3.873 383 1HD ARG 864 1HD ARG 864 6.384 0.433 -5.739 384 2HD ARG 864 2HD ARG 864 7.819 -0.063 -4.819 385 HE ARG 864 HE ARG 864 7.415 -2.189 -6.527 386 1HH1 ARG 864 1HH1 ARG 864 6.109 -0.234 -8.393 387 2HH1 ARG 864 2HH1 ARG 864 7.455 0.321 -9.333 388 1HH2 ARG 864 1HH2 ARG 864 9.837 -0.847 -7.100 389 2HH2 ARG 864 2HH2 ARG 864 9.564 -0.027 -8.602 390 HA VAL 865 HA VAL 865 3.034 3.576 -3.941 391 HB VAL 865 HB VAL 865 2.381 2.339 -1.309 392 1HG1 VAL 865 1HG1 VAL 865 2.008 5.226 -1.826 393 2HG1 VAL 865 2HG1 VAL 865 0.731 4.341 -0.994 394 3HG1 VAL 865 3HG1 VAL 865 2.358 4.381 -0.318 395 1HG2 VAL 865 1HG2 VAL 865 1.095 2.985 -3.848 396 2HG2 VAL 865 2HG2 VAL 865 0.904 1.589 -2.790 397 3HG2 VAL 865 3HG2 VAL 865 0.061 3.090 -2.421 398 HA LEU 866 HA LEU 866 4.990 6.162 -0.206 399 1HB LEU 866 1HB LEU 866 5.193 4.898 1.715 400 2HB LEU 866 2HB LEU 866 5.591 3.440 0.817 401 HG LEU 866 HG LEU 866 7.685 5.546 0.800 402 1HD1 LEU 866 1HD1 LEU 866 6.623 4.302 3.301 403 2HD1 LEU 866 2HD1 LEU 866 8.371 4.459 3.134 404 3HD1 LEU 866 3HD1 LEU 866 7.347 5.892 3.058 405 1HD2 LEU 866 1HD2 LEU 866 7.436 2.566 0.903 406 2HD2 LEU 866 2HD2 LEU 866 8.433 3.568 -0.151 407 3HD2 LEU 866 3HD2 LEU 866 8.918 3.293 1.521 408 1HA GLY 867 1HA GLY 867 9.063 4.850 -2.310 409 2HA GLY 867 2HA GLY 867 8.495 3.421 -3.178 410 HA THR 868 HA THR 868 6.998 6.036 -6.399 411 HB THR 868 HB THR 868 4.937 5.477 -7.375 412 HG1 THR 868 HG1 THR 868 4.045 5.113 -4.708 413 1HG2 THR 868 1HG2 THR 868 6.513 3.591 -6.265 414 2HG2 THR 868 2HG2 THR 868 4.947 3.189 -5.556 415 3HG2 THR 868 3HG2 THR 868 5.134 3.248 -7.309 416 HA ARG 869 HA ARG 869 4.152 9.067 -4.100 417 1HB ARG 869 1HB ARG 869 4.914 7.675 -1.489 418 2HB ARG 869 2HB ARG 869 3.979 9.169 -1.574 419 1HG ARG 869 1HG ARG 869 3.103 6.679 -3.038 420 2HG ARG 869 2HG ARG 869 2.660 6.966 -1.355 421 1HD ARG 869 1HD ARG 869 2.122 9.396 -2.695 422 2HD ARG 869 2HD ARG 869 0.929 8.215 -2.118 423 HE ARG 869 HE ARG 869 2.012 7.244 -4.567 424 1HH1 ARG 869 1HH1 ARG 869 -0.795 8.435 -3.397 425 2HH1 ARG 869 2HH1 ARG 869 -1.289 9.281 -4.825 426 1HH2 ARG 869 1HH2 ARG 869 1.779 8.948 -6.405 427 2HH2 ARG 869 2HH2 ARG 869 0.167 9.571 -6.527 428 HA ALA 870 HA ALA 870 8.375 10.101 -1.867 429 1HB ALA 870 3HB ALA 870 8.995 7.995 -0.918 430 2HB ALA 870 2HB ALA 870 10.319 8.428 -2.000 431 3HB ALA 870 1HB ALA 870 9.116 7.243 -2.510 432 HA LEU 871 HA LEU 871 10.231 10.113 -6.084 433 1HB LEU 871 1HB LEU 871 9.085 8.550 -8.176 434 2HB LEU 871 2HB LEU 871 10.698 8.418 -7.494 435 HG LEU 871 HG LEU 871 8.452 7.138 -6.016 436 1HD1 LEU 871 1HD1 LEU 871 8.086 6.539 -8.391 437 2HD1 LEU 871 2HD1 LEU 871 9.749 5.959 -8.478 438 3HD1 LEU 871 3HD1 LEU 871 8.588 5.152 -7.424 439 1HD2 LEU 871 1HD2 LEU 871 11.394 6.675 -6.511 440 2HD2 LEU 871 2HD2 LEU 871 10.575 6.948 -4.973 441 3HD2 LEU 871 3HD2 LEU 871 10.380 5.411 -5.815 442 HA GLN 872 HA GLN 872 6.024 11.091 -8.416 443 1HB GLN 872 1HB GLN 872 4.940 9.996 -5.955 444 2HB GLN 872 2HB GLN 872 4.305 11.613 -6.225 445 1HG GLN 872 1HG GLN 872 4.095 10.566 -8.739 446 2HG GLN 872 2HG GLN 872 2.789 10.539 -7.555 447 2HE2 GLN 872 1HE2 GLN 872 5.111 8.565 -9.281 448 1HE2 GLN 872 2HE2 GLN 872 4.614 7.074 -8.638 449 HA ILE 873 HA ILE 873 6.290 14.941 -5.457 450 HB ILE 873 HB ILE 873 7.396 14.686 -3.090 451 1HG1 ILE 873 1HG1 ILE 873 6.262 12.129 -2.622 452 2HG1 ILE 873 2HG1 ILE 873 7.299 11.964 -4.033 453 1HG2 ILE 873 1HG2 ILE 873 4.668 14.071 -4.080 454 2HG2 ILE 873 2HG2 ILE 873 5.001 13.808 -2.370 455 3HG2 ILE 873 3HG2 ILE 873 5.227 15.405 -3.073 456 1HD1 ILE 873 1HD1 ILE 873 8.463 13.550 -1.859 457 2HD1 ILE 873 2HD1 ILE 873 8.185 11.855 -1.471 458 3HD1 ILE 873 3HD1 ILE 873 9.181 12.293 -2.857 459 HA ALA 874 HA ALA 874 11.009 14.171 -4.789 460 1HB ALA 874 1HB ALA 874 10.679 11.587 -6.306 461 2HB ALA 874 3HB ALA 874 11.237 11.787 -4.648 462 3HB ALA 874 2HB ALA 874 12.254 12.307 -5.988 463 HA MET 875 HA MET 875 10.753 15.288 -9.273 464 1HB MET 875 1HB MET 875 7.874 14.309 -9.508 465 2HB MET 875 2HB MET 875 8.788 15.039 -10.828 466 1HG MET 875 1HG MET 875 10.550 13.144 -10.127 467 2HG MET 875 2HG MET 875 9.076 12.343 -9.587 468 1HE MET 875 1HE MET 875 11.156 13.867 -12.003 469 2HE MET 875 2HE MET 875 11.267 12.378 -12.939 470 3HE MET 875 3HE MET 875 10.424 13.772 -13.610 471 HA CYS 876 HA CYS 876 7.915 18.495 -7.395 472 1HB CYS 876 1HB CYS 876 7.001 18.488 -9.687 473 2HB CYS 876 2HB CYS 876 5.690 17.424 -9.184 474 HG CYS 876 HG CYS 876 4.585 19.343 -7.927 475 HA ALA 877 HA ALA 877 4.807 15.630 -5.033 476 1HB ALA 877 3HB ALA 877 4.892 17.698 -4.055 477 2HB ALA 877 1HB ALA 877 4.032 18.474 -5.384 478 3HB ALA 877 2HB ALA 877 3.147 17.494 -4.213 479 HA PRO 878 HA PRO 878 1.044 14.919 -7.952 480 1HB PRO 878 1HB PRO 878 1.973 12.219 -8.244 481 2HB PRO 878 2HB PRO 878 1.816 13.445 -9.505 482 1HG PRO 878 1HG PRO 878 4.222 12.420 -8.307 483 2HG PRO 878 2HG PRO 878 4.068 13.566 -9.630 484 1HD PRO 878 1HD PRO 878 4.942 14.105 -6.972 485 2HD PRO 878 2HD PRO 878 4.643 15.277 -8.272 486 HA VAL 879 HA VAL 879 1.313 11.540 -4.254 487 HB VAL 879 HB VAL 879 2.991 13.830 -3.282 488 1HG1 VAL 879 1HG1 VAL 879 1.352 13.205 -1.426 489 2HG1 VAL 879 2HG1 VAL 879 2.181 11.655 -1.372 490 3HG1 VAL 879 3HG1 VAL 879 3.054 13.141 -1.037 491 1HG2 VAL 879 1HG2 VAL 879 3.599 11.432 -4.439 492 2HG2 VAL 879 2HG2 VAL 879 4.708 12.343 -3.438 493 3HG2 VAL 879 3HG2 VAL 879 3.767 11.039 -2.735 494 HA MET 880 HA MET 880 -2.297 13.628 -2.796 495 1HB MET 880 1HB MET 880 -1.914 11.091 -1.694 496 2HB MET 880 2HB MET 880 -2.469 12.067 -0.334 497 1HG MET 880 1HG MET 880 -3.843 11.931 -3.034 498 2HG MET 880 2HG MET 880 -4.350 11.031 -1.606 499 1HE MET 880 2HE MET 880 -6.053 12.787 -3.335 500 2HE MET 880 1HE MET 880 -6.494 14.385 -2.740 501 3HE MET 880 3HE MET 880 -4.990 14.169 -3.632 502 HA VAL 881 HA VAL 881 -0.873 16.355 0.432 503 HB VAL 881 HB VAL 881 1.105 15.932 1.971 504 1HG1 VAL 881 1HG1 VAL 881 -1.271 14.390 1.619 505 2HG1 VAL 881 2HG1 VAL 881 0.017 13.269 2.054 506 3HG1 VAL 881 3HG1 VAL 881 -0.357 14.636 3.102 507 1HG2 VAL 881 1HG2 VAL 881 2.261 14.681 -0.102 508 2HG2 VAL 881 2HG2 VAL 881 2.649 14.271 1.569 509 3HG2 VAL 881 3HG2 VAL 881 1.506 13.282 0.662 510 HA GLU 882 HA GLU 882 2.383 18.574 -1.711 511 1HB GLU 882 1HB GLU 882 0.420 20.397 -0.308 512 2HB GLU 882 2HB GLU 882 1.548 20.975 -1.535 513 1HG GLU 882 1HG GLU 882 0.095 18.555 -2.349 514 2HG GLU 882 2HG GLU 882 -0.962 19.933 -2.045 515 HA LEU 883 HA LEU 883 4.855 19.518 2.169 516 1HB LEU 883 1HB LEU 883 5.744 17.274 1.732 517 2HB LEU 883 2HB LEU 883 6.539 17.850 0.270 518 HG LEU 883 HG LEU 883 7.764 19.523 1.775 519 1HD1 LEU 883 1HD1 LEU 883 6.145 19.158 3.693 520 2HD1 LEU 883 2HD1 LEU 883 6.902 17.584 3.934 521 3HD1 LEU 883 3HD1 LEU 883 7.850 19.058 4.133 522 1HD2 LEU 883 1HD2 LEU 883 8.170 16.531 1.957 523 2HD2 LEU 883 2HD2 LEU 883 9.006 17.679 0.911 524 3HD2 LEU 883 3HD2 LEU 883 9.320 17.676 2.647 525 HA GLU 884 HA GLU 884 6.822 22.395 -0.924 526 1HB GLU 884 1HB GLU 884 8.773 21.078 0.677 527 2HB GLU 884 2HB GLU 884 9.604 21.719 -0.739 528 1HG GLU 884 1HG GLU 884 7.623 23.478 0.653 529 2HG GLU 884 2HG GLU 884 9.201 23.238 1.406 530 1HA GLY 885 1HA GLY 885 7.186 19.502 -4.912 531 2HA GLY 885 2HA GLY 885 8.561 20.600 -4.756 532 HA GLU 886 HA GLU 886 10.071 16.365 -2.519 533 1HB GLU 886 1HB GLU 886 10.644 16.408 -4.837 534 2HB GLU 886 2HB GLU 886 11.604 17.874 -4.647 535 1HG GLU 886 1HG GLU 886 13.179 16.567 -3.181 536 2HG GLU 886 2HG GLU 886 12.260 15.115 -3.575 537 HA THR 887 HA THR 887 13.661 17.681 -0.170 538 HB THR 887 HB THR 887 11.039 18.157 1.298 539 HG1 THR 887 HG1 THR 887 12.913 19.849 0.003 540 1HG2 THR 887 1HG2 THR 887 13.845 18.419 2.233 541 2HG2 THR 887 2HG2 THR 887 12.793 19.796 2.563 542 3HG2 THR 887 3HG2 THR 887 12.363 18.195 3.163 543 HA ASP 888 HA ASP 888 12.761 14.381 3.002 544 1HB ASP 888 1HB ASP 888 10.345 15.399 3.283 545 2HB ASP 888 2HB ASP 888 9.869 13.859 2.573 546 HA PRO 889 HA PRO 889 13.139 10.997 0.145 547 1HB PRO 889 1HB PRO 889 13.465 9.101 2.281 548 2HB PRO 889 2HB PRO 889 14.721 9.836 1.283 549 1HG PRO 889 1HG PRO 889 14.220 10.322 4.040 550 2HG PRO 889 2HG PRO 889 15.381 11.155 3.000 551 1HD PRO 889 1HD PRO 889 14.110 13.038 3.184 552 2HD PRO 889 2HD PRO 889 12.833 12.140 4.043 553 HA LEU 890 HA LEU 890 8.783 9.735 1.046 554 1HB LEU 890 1HB LEU 890 8.655 7.724 2.413 555 2HB LEU 890 2HB LEU 890 10.306 7.917 1.853 556 HG LEU 890 HG LEU 890 10.435 7.284 4.157 557 1HD1 LEU 890 1HD1 LEU 890 11.882 9.237 3.414 558 2HD1 LEU 890 2HD1 LEU 890 10.735 10.287 4.245 559 3HD1 LEU 890 3HD1 LEU 890 11.639 9.077 5.152 560 1HD2 LEU 890 1HD2 LEU 890 7.957 8.271 4.462 561 2HD2 LEU 890 2HD2 LEU 890 9.029 7.969 5.828 562 3HD2 LEU 890 3HD2 LEU 890 8.872 9.600 5.178 563 HA LEU 891 HA LEU 891 7.499 11.793 5.411 564 1HB LEU 891 1HB LEU 891 8.455 13.879 5.454 565 2HB LEU 891 2HB LEU 891 8.486 13.978 3.707 566 HG LEU 891 HG LEU 891 7.018 15.678 4.829 567 1HD1 LEU 891 1HD1 LEU 891 6.619 14.428 2.438 568 2HD1 LEU 891 2HD1 LEU 891 5.060 14.172 3.225 569 3HD1 LEU 891 3HD1 LEU 891 5.680 15.804 3.008 570 1HD2 LEU 891 1HD2 LEU 891 5.881 13.254 5.979 571 2HD2 LEU 891 2HD2 LEU 891 5.711 14.927 6.502 572 3HD2 LEU 891 3HD2 LEU 891 4.653 14.282 5.248 573 HA ILE 892 HA ILE 892 4.158 12.848 2.086 574 HB ILE 892 HB ILE 892 6.497 12.495 0.335 575 1HG1 ILE 892 1HG1 ILE 892 4.169 14.068 -0.519 576 2HG1 ILE 892 2HG1 ILE 892 4.835 14.521 1.049 577 1HG2 ILE 892 1HG2 ILE 892 3.843 11.347 -0.382 578 2HG2 ILE 892 2HG2 ILE 892 4.727 12.238 -1.606 579 3HG2 ILE 892 3HG2 ILE 892 5.461 10.831 -0.854 580 1HD1 ILE 892 1HD1 ILE 892 6.691 13.975 -1.203 581 2HD1 ILE 892 2HD1 ILE 892 5.844 15.517 -1.164 582 3HD1 ILE 892 3HD1 ILE 892 6.896 15.050 0.173 583 HA ALA 893 HA ALA 893 4.248 8.272 0.765 584 1HB ALA 893 3HB ALA 893 6.248 7.519 -0.025 585 2HB ALA 893 1HB ALA 893 7.153 8.281 1.277 586 3HB ALA 893 2HB ALA 893 6.338 6.749 1.556 587 HA MET 894 HA MET 894 4.587 7.387 5.431 588 1HB MET 894 1HB MET 894 6.687 8.413 6.006 589 2HB MET 894 2HB MET 894 6.072 10.026 5.662 590 1HG MET 894 1HG MET 894 4.459 8.739 7.700 591 2HG MET 894 2HG MET 894 6.157 8.745 8.170 592 1HE MET 894 2HE MET 894 7.455 10.714 6.949 593 2HE MET 894 3HE MET 894 7.048 12.419 7.189 594 3HE MET 894 1HE MET 894 7.573 11.437 8.550 595 HA LYS 895 HA LYS 895 1.847 11.300 6.489 596 1HB LYS 895 1HB LYS 895 2.999 13.184 5.632 597 2HB LYS 895 2HB LYS 895 3.086 12.500 4.011 598 1HG LYS 895 1HG LYS 895 0.585 12.737 3.855 599 2HG LYS 895 2HG LYS 895 1.446 14.270 3.978 600 1HD LYS 895 1HD LYS 895 0.659 13.020 6.554 601 2HD LYS 895 2HD LYS 895 -0.667 13.617 5.555 602 1HE LYS 895 1HE LYS 895 1.743 15.371 5.974 603 2HE LYS 895 2HE LYS 895 0.049 15.834 5.707 604 1HZ LYS 895 3HZ LYS 895 -0.512 14.893 7.863 605 2HZ LYS 895 1HZ LYS 895 1.109 14.471 8.127 606 3HZ LYS 895 2HZ LYS 895 0.664 16.108 8.035 607 HA GLU 896 HA GLU 896 -0.435 10.141 2.281 608 1HB GLU 896 1HB GLU 896 2.137 8.728 1.635 609 2HB GLU 896 2HB GLU 896 0.644 8.138 0.920 610 1HG GLU 896 1HG GLU 896 1.162 11.073 0.805 611 2HG GLU 896 2HG GLU 896 2.086 10.027 -0.275 612 HA LEU 897 HA LEU 897 -0.804 5.821 4.011 613 1HB LEU 897 1HB LEU 897 1.471 4.878 3.820 614 2HB LEU 897 2HB LEU 897 1.927 5.676 5.326 615 HG LEU 897 HG LEU 897 1.085 3.124 5.277 616 1HD1 LEU 897 1HD1 LEU 897 1.718 4.850 7.200 617 2HD1 LEU 897 2HD1 LEU 897 -0.019 4.788 7.500 618 3HD1 LEU 897 3HD1 LEU 897 0.942 3.312 7.575 619 1HD2 LEU 897 1HD2 LEU 897 -1.171 4.115 4.318 620 2HD2 LEU 897 2HD2 LEU 897 -1.232 2.849 5.538 621 3HD2 LEU 897 3HD2 LEU 897 -1.481 4.525 6.002 622 HA LYS 898 HA LYS 898 -0.109 7.445 8.640 623 1HB LYS 898 1HB LYS 898 1.892 8.805 8.132 624 2HB LYS 898 2HB LYS 898 0.880 9.921 7.219 625 1HG LYS 898 1HG LYS 898 -0.155 10.770 9.122 626 2HG LYS 898 2HG LYS 898 0.204 9.335 10.083 627 1HD LYS 898 1HD LYS 898 2.720 10.286 9.365 628 2HD LYS 898 2HD LYS 898 1.800 11.754 9.695 629 1HE LYS 898 1HE LYS 898 1.784 9.396 11.599 630 2HE LYS 898 2HE LYS 898 2.966 10.714 11.726 631 1HZ LYS 898 1HZ LYS 898 0.025 11.114 11.573 632 2HZ LYS 898 2HZ LYS 898 0.911 11.121 13.024 633 3HZ LYS 898 3HZ LYS 898 1.204 12.307 11.848 634 HA ALA 899 HA ALA 899 -3.381 10.391 6.984 635 1HB ALA 899 2HB ALA 899 -3.663 11.075 4.518 636 2HB ALA 899 3HB ALA 899 -2.155 11.581 5.283 637 3HB ALA 899 1HB ALA 899 -2.171 10.187 4.205 638 HA ARG 900 HA ARG 900 -3.818 5.655 4.537 639 1HB ARG 900 1HB ARG 900 -5.099 4.961 6.307 640 2HB ARG 900 2HB ARG 900 -4.655 6.484 7.069 641 1HG ARG 900 1HG ARG 900 -6.698 7.470 5.799 642 2HG ARG 900 2HG ARG 900 -7.186 5.791 5.585 643 1HD ARG 900 1HD ARG 900 -7.577 5.471 7.854 644 2HD ARG 900 2HD ARG 900 -6.403 6.713 8.333 645 HE ARG 900 HE ARG 900 -8.441 7.999 6.833 646 1HH1 ARG 900 1HH1 ARG 900 -9.231 5.725 9.085 647 2HH1 ARG 900 2HH1 ARG 900 -9.945 6.810 10.231 648 1HH2 ARG 900 1HH2 ARG 900 -8.828 9.669 8.618 649 2HH2 ARG 900 2HH2 ARG 900 -9.717 9.043 9.966 650 HA LYS 901 HA LYS 901 -6.668 8.335 2.272 651 1HB LYS 901 1HB LYS 901 -5.903 10.431 3.171 652 2HB LYS 901 2HB LYS 901 -4.382 10.308 2.289 653 1HG LYS 901 1HG LYS 901 -6.074 11.895 1.267 654 2HG LYS 901 2HG LYS 901 -5.486 10.641 0.176 655 1HD LYS 901 1HD LYS 901 -7.526 9.666 0.009 656 2HD LYS 901 2HD LYS 901 -7.846 9.833 1.734 657 1HE LYS 901 1HE LYS 901 -7.831 12.437 0.415 658 2HE LYS 901 2HE LYS 901 -9.036 11.346 -0.298 659 1HZ LYS 901 3HZ LYS 901 -9.800 10.789 1.928 660 2HZ LYS 901 1HZ LYS 901 -8.668 11.859 2.606 661 3HZ LYS 901 2HZ LYS 901 -9.935 12.461 1.654 662 HA ILE 902 HA ILE 902 -2.996 7.851 -1.173 663 HB ILE 902 HB ILE 902 -1.964 5.556 -1.128 664 1HG1 ILE 902 1HG1 ILE 902 -3.967 5.104 0.804 665 2HG1 ILE 902 2HG1 ILE 902 -2.681 3.995 0.338 666 1HG2 ILE 902 1HG2 ILE 902 -1.535 7.381 1.249 667 2HG2 ILE 902 2HG2 ILE 902 -0.430 6.091 0.774 668 3HG2 ILE 902 3HG2 ILE 902 -0.711 7.454 -0.309 669 1HD1 ILE 902 3HD1 ILE 902 -2.396 6.124 2.481 670 2HD1 ILE 902 1HD1 ILE 902 -2.772 4.432 2.805 671 3HD1 ILE 902 2HD1 ILE 902 -1.226 4.869 2.079 672 HA PRO 903 HA PRO 903 -6.793 5.724 -2.726 673 1HB PRO 903 1HB PRO 903 -7.041 7.842 -4.656 674 2HB PRO 903 2HB PRO 903 -8.028 7.596 -3.211 675 1HG PRO 903 1HG PRO 903 -6.296 9.749 -3.620 676 2HG PRO 903 2HG PRO 903 -6.933 9.238 -2.050 677 1HD PRO 903 1HD PRO 903 -4.682 8.949 -1.529 678 2HD PRO 903 2HD PRO 903 -4.225 8.735 -3.240 679 HA ILE 904 HA ILE 904 -4.996 4.674 -6.626 680 HB ILE 904 HB ILE 904 -2.884 5.222 -4.764 681 1HG1 ILE 904 1HG1 ILE 904 -2.402 5.508 -7.658 682 2HG1 ILE 904 2HG1 ILE 904 -3.910 6.227 -7.098 683 1HG2 ILE 904 1HG2 ILE 904 -2.362 3.097 -6.837 684 2HG2 ILE 904 2HG2 ILE 904 -1.088 4.185 -6.292 685 3HG2 ILE 904 3HG2 ILE 904 -1.889 3.120 -5.140 686 1HD1 ILE 904 1HD1 ILE 904 -1.487 6.731 -5.442 687 2HD1 ILE 904 2HD1 ILE 904 -1.577 7.556 -6.999 688 3HD1 ILE 904 3HD1 ILE 904 -2.847 7.797 -5.798 689 HA ILE 905 HA ILE 905 -5.191 0.314 -6.865 690 HB ILE 905 HB ILE 905 -6.238 1.279 -8.905 691 1HG1 ILE 905 1HG1 ILE 905 -4.702 -0.782 -10.259 692 2HG1 ILE 905 2HG1 ILE 905 -5.120 -1.277 -8.621 693 1HG2 ILE 905 1HG2 ILE 905 -3.377 1.278 -9.908 694 2HG2 ILE 905 2HG2 ILE 905 -4.779 1.448 -10.962 695 3HG2 ILE 905 3HG2 ILE 905 -4.447 2.666 -9.737 696 1HD1 ILE 905 1HD1 ILE 905 -7.178 -0.025 -10.416 697 2HD1 ILE 905 2HD1 ILE 905 -6.831 -1.750 -10.509 698 3HD1 ILE 905 3HD1 ILE 905 -7.426 -1.047 -9.002 699 HA ILE 906 HA ILE 906 -0.925 -0.813 -7.947 700 HB ILE 906 HB ILE 906 -2.054 -1.778 -5.358 701 1HG1 ILE 906 1HG1 ILE 906 0.207 -0.038 -6.299 702 2HG1 ILE 906 2HG1 ILE 906 0.116 -0.577 -4.625 703 1HG2 ILE 906 1HG2 ILE 906 0.395 -2.917 -6.671 704 2HG2 ILE 906 2HG2 ILE 906 0.383 -2.681 -4.923 705 3HG2 ILE 906 3HG2 ILE 906 -0.816 -3.731 -5.679 706 1HD1 ILE 906 1HD1 ILE 906 -2.452 0.285 -5.074 707 2HD1 ILE 906 2HD1 ILE 906 -1.187 1.267 -4.335 708 3HD1 ILE 906 3HD1 ILE 906 -1.519 1.409 -6.057 709 HA ARG 907 HA ARG 907 -1.675 -4.870 -9.621 710 1HB ARG 907 1HB ARG 907 0.854 -3.731 -10.767 711 2HB ARG 907 2HB ARG 907 0.230 -5.295 -11.281 712 1HG ARG 907 1HG ARG 907 -0.623 -3.527 -12.756 713 2HG ARG 907 2HG ARG 907 -1.933 -4.260 -11.833 714 1HD ARG 907 1HD ARG 907 -2.233 -2.369 -10.491 715 2HD ARG 907 2HD ARG 907 -0.570 -1.799 -10.747 716 HE ARG 907 HE ARG 907 -1.218 -0.983 -12.924 717 1HH1 ARG 907 1HH1 ARG 907 -3.162 -3.309 -13.424 718 2HH1 ARG 907 2HH1 ARG 907 -4.670 -2.461 -13.487 719 1HH2 ARG 907 1HH2 ARG 907 -3.407 0.432 -12.050 720 2HH2 ARG 907 2HH2 ARG 907 -4.810 -0.340 -12.709 721 HA ARG 908 HA ARG 908 1.098 -7.015 -6.848 722 1HB ARG 908 1HB ARG 908 -1.366 -8.667 -6.426 723 2HB ARG 908 2HB ARG 908 -0.149 -8.189 -5.257 724 1HG ARG 908 1HG ARG 908 -1.078 -5.783 -5.564 725 2HG ARG 908 2HG ARG 908 -2.467 -6.563 -6.320 726 1HD ARG 908 1HD ARG 908 -2.189 -8.071 -4.009 727 2HD ARG 908 2HD ARG 908 -3.275 -6.666 -4.134 728 HE ARG 908 HE ARG 908 -1.358 -5.286 -3.281 729 1HH1 ARG 908 1HH1 ARG 908 -2.064 -8.219 -1.919 730 2HH1 ARG 908 2HH1 ARG 908 -0.547 -8.434 -1.112 731 1HH2 ARG 908 1HH2 ARG 908 0.984 -5.767 -2.714 732 2HH2 ARG 908 2HH2 ARG 908 1.179 -7.047 -1.563 733 HA TYR 909 HA TYR 909 1.097 -10.249 -10.039 734 1HB TYR 909 1HB TYR 909 3.981 -9.529 -10.286 735 2HB TYR 909 2HB TYR 909 2.876 -10.098 -11.518 736 HD1 TYR 909 HD1 TYR 909 1.432 -8.543 -12.734 737 HD2 TYR 909 HD2 TYR 909 4.132 -7.133 -9.730 738 HE1 TYR 909 HE1 TYR 909 1.202 -6.253 -13.588 739 HE2 TYR 909 HE2 TYR 909 3.903 -4.848 -10.562 740 HH TYR 909 HH TYR 909 2.605 -4.122 -13.563 741 HA LEU 910 HA LEU 910 3.954 -12.552 -7.406 742 1HB LEU 910 1HB LEU 910 2.135 -14.376 -8.977 743 2HB LEU 910 2HB LEU 910 2.904 -14.821 -7.452 744 HG LEU 910 HG LEU 910 0.870 -12.624 -7.929 745 1HD1 LEU 910 1HD1 LEU 910 0.860 -15.374 -6.811 746 2HD1 LEU 910 2HD1 LEU 910 -0.111 -14.177 -5.961 747 3HD1 LEU 910 3HD1 LEU 910 -0.404 -14.500 -7.667 748 1HD2 LEU 910 1HD2 LEU 910 2.862 -12.324 -6.144 749 2HD2 LEU 910 2HD2 LEU 910 1.215 -11.799 -5.807 750 3HD2 LEU 910 3HD2 LEU 910 1.795 -13.343 -5.185 751 HA PRO 911 HA PRO 911 7.331 -13.795 -10.109 752 1HB PRO 911 1HB PRO 911 8.807 -14.385 -7.711 753 2HB PRO 911 2HB PRO 911 9.003 -12.992 -8.779 754 1HG PRO 911 1HG PRO 911 8.105 -11.651 -7.193 755 2HG PRO 911 2HG PRO 911 7.891 -13.042 -6.131 756 1HD PRO 911 1HD PRO 911 5.635 -12.963 -6.477 757 2HD PRO 911 2HD PRO 911 5.848 -11.570 -7.560 758 HA ASP 912 HA ASP 912 6.743 -17.977 -7.740 759 1HB ASP 912 1HB ASP 912 4.331 -16.616 -6.657 760 2HB ASP 912 2HB ASP 912 4.192 -18.359 -6.878 761 1HA GLY 913 1HA GLY 913 4.061 -17.368 -11.897 762 2HA GLY 913 2HA GLY 913 3.678 -18.866 -11.051 763 HA SER 914 HA SER 914 -0.073 -15.976 -11.574 764 1HB SER 914 1HB SER 914 0.635 -16.096 -8.648 765 2HB SER 914 2HB SER 914 -0.953 -15.545 -9.171 766 HG SER 914 HG SER 914 -1.394 -17.510 -9.949 767 HA TYR 915 HA TYR 915 0.111 -11.660 -9.631 768 1HB TYR 915 1HB TYR 915 1.212 -11.267 -11.602 769 2HB TYR 915 2HB TYR 915 0.216 -12.425 -12.471 770 HD1 TYR 915 HD1 TYR 915 -0.084 -8.994 -10.943 771 HD2 TYR 915 HD2 TYR 915 -1.161 -11.623 -14.165 772 HE1 TYR 915 HE1 TYR 915 -1.274 -7.134 -12.063 773 HE2 TYR 915 HE2 TYR 915 -2.352 -9.760 -15.285 774 HH TYR 915 HH TYR 915 -1.892 -6.646 -14.649 775 HA GLU 916 HA GLU 916 -4.076 -9.945 -10.715 776 1HB GLU 916 1HB GLU 916 -3.457 -10.883 -8.171 777 2HB GLU 916 2HB GLU 916 -4.089 -9.263 -7.883 778 1HG GLU 916 1HG GLU 916 -5.533 -11.051 -9.799 779 2HG GLU 916 2HG GLU 916 -5.737 -11.313 -8.068 780 HA ASP 917 HA ASP 917 -3.354 -5.549 -10.055 781 1HB ASP 917 1HB ASP 917 -4.297 -4.426 -12.049 782 2HB ASP 917 2HB ASP 917 -3.353 -5.844 -12.443 783 HA TRP 918 HA TRP 918 -6.734 -2.690 -8.996 784 1HB TRP 918 1HB TRP 918 -8.191 -3.937 -7.422 785 2HB TRP 918 2HB TRP 918 -8.060 -4.709 -8.980 786 HD1 TRP 918 HD1 TRP 918 -4.948 -5.789 -7.647 787 HE1 TRP 918 HE1 TRP 918 -5.174 -8.080 -6.499 788 HE3 TRP 918 HE3 TRP 918 -9.906 -5.758 -6.857 789 HZ2 TRP 918 HZ2 TRP 918 -7.271 -9.643 -5.242 790 HZ3 TRP 918 HZ3 TRP 918 -11.029 -7.547 -5.616 791 HH2 TRP 918 HH2 TRP 918 -9.730 -9.529 -4.813 792 1HA GLY 919 1HA GLY 919 -5.138 -2.631 -4.703 793 2HA GLY 919 2HA GLY 919 -4.937 -1.048 -5.432 794 HA VAL 920 HA VAL 920 -8.039 -0.035 -2.511 795 HB VAL 920 HB VAL 920 -6.964 2.504 -3.784 796 1HG1 VAL 920 1HG1 VAL 920 -8.507 1.977 -1.242 797 2HG1 VAL 920 2HG1 VAL 920 -7.434 3.368 -1.384 798 3HG1 VAL 920 3HG1 VAL 920 -8.810 3.202 -2.473 799 1HG2 VAL 920 1HG2 VAL 920 -5.996 0.559 -1.713 800 2HG2 VAL 920 2HG2 VAL 920 -5.092 1.358 -2.999 801 3HG2 VAL 920 3HG2 VAL 920 -5.549 2.257 -1.556 802 HA ASP 921 HA ASP 921 -11.018 1.741 -5.638 803 1HB ASP 921 1HB ASP 921 -9.444 2.040 -7.528 804 2HB ASP 921 2HB ASP 921 -9.600 0.326 -7.916 805 HA GLU 922 HA GLU 922 -12.625 -2.523 -5.701 806 1HB GLU 922 1HB GLU 922 -10.802 -2.912 -7.512 807 2HB GLU 922 2HB GLU 922 -10.064 -3.980 -6.317 808 1HG GLU 922 1HG GLU 922 -11.795 -5.523 -6.422 809 2HG GLU 922 2HG GLU 922 -12.990 -4.303 -6.857 810 HA LEU 923 HA LEU 923 -10.905 -3.843 -1.669 811 1HB LEU 923 1HB LEU 923 -8.567 -4.957 -1.532 812 2HB LEU 923 2HB LEU 923 -9.639 -5.453 -2.827 813 HG LEU 923 HG LEU 923 -8.155 -3.160 -3.694 814 1HD1 LEU 923 1HD1 LEU 923 -6.514 -5.475 -2.643 815 2HD1 LEU 923 2HD1 LEU 923 -5.918 -4.275 -3.791 816 3HD1 LEU 923 3HD1 LEU 923 -6.385 -3.784 -2.169 817 1HD2 LEU 923 1HD2 LEU 923 -9.306 -5.096 -4.849 818 2HD2 LEU 923 2HD2 LEU 923 -7.768 -4.534 -5.507 819 3HD2 LEU 923 3HD2 LEU 923 -7.828 -5.995 -4.514 820 HA ILE 924 HA ILE 924 -8.551 -1.510 1.237 821 HB ILE 924 HB ILE 924 -7.335 -4.176 1.393 822 1HG1 ILE 924 1HG1 ILE 924 -8.057 -3.794 3.776 823 2HG1 ILE 924 2HG1 ILE 924 -8.651 -2.221 3.247 824 1HG2 ILE 924 1HG2 ILE 924 -5.283 -2.783 1.640 825 2HG2 ILE 924 2HG2 ILE 924 -6.060 -1.962 2.990 826 3HG2 ILE 924 3HG2 ILE 924 -5.703 -3.682 3.090 827 1HD1 ILE 924 2HD1 ILE 924 -10.011 -3.324 1.509 828 2HD1 ILE 924 3HD1 ILE 924 -9.462 -4.895 2.086 829 3HD1 ILE 924 1HD1 ILE 924 -10.456 -3.876 3.125 830 HA ILE 925 HA ILE 925 -4.826 0.412 -0.188 831 HB ILE 925 HB ILE 925 -4.493 2.326 1.417 832 1HG1 ILE 925 1HG1 ILE 925 -6.862 1.483 2.994 833 2HG1 ILE 925 2HG1 ILE 925 -5.382 0.586 3.318 834 1HG2 ILE 925 1HG2 ILE 925 -6.937 1.585 0.016 835 2HG2 ILE 925 2HG2 ILE 925 -7.266 2.664 1.371 836 3HG2 ILE 925 3HG2 ILE 925 -6.134 3.151 0.111 837 1HD1 ILE 925 2HD1 ILE 925 -4.212 2.843 3.530 838 2HD1 ILE 925 3HD1 ILE 925 -5.819 3.569 3.532 839 3HD1 ILE 925 1HD1 ILE 925 -5.356 2.450 4.813 840 HA THR 926 HA THR 926 -1.267 -0.572 2.468 841 HB THR 926 HB THR 926 -2.315 1.213 4.688 842 HG1 THR 926 HG1 THR 926 -1.837 2.593 3.165 843 1HG2 THR 926 1HG2 THR 926 0.452 0.058 4.245 844 2HG2 THR 926 2HG2 THR 926 0.013 1.212 5.503 845 3HG2 THR 926 3HG2 THR 926 -0.670 -0.413 5.520 846 HA ASP 927 HA ASP 927 -4.296 -3.431 4.748 847 1HB ASP 927 1HB ASP 927 -2.598 -1.832 6.450 848 2HB ASP 927 2HB ASP 927 -3.917 -2.491 7.416 No H/Q in entry = 848 Start of MODEL 22 1 HA MET 801 HA MET 801 38.085 -49.869 -5.981 2 1HB MET 801 1HB MET 801 36.904 -50.374 -8.648 3 2HB MET 801 2HB MET 801 38.033 -49.019 -8.584 4 1HG MET 801 1HG MET 801 39.808 -50.384 -7.814 5 2HG MET 801 2HG MET 801 38.716 -51.691 -7.358 6 1HE MET 801 3HE MET 801 39.529 -49.305 -9.955 7 2HE MET 801 1HE MET 801 40.121 -50.211 -11.345 8 3HE MET 801 2HE MET 801 38.397 -49.888 -11.182 9 HA SER 802 HA SER 802 35.445 -46.272 -4.214 10 1HB SER 802 1HB SER 802 37.641 -45.595 -6.195 11 2HB SER 802 2HB SER 802 36.991 -44.532 -4.949 12 HG SER 802 HG SER 802 37.763 -46.023 -3.398 13 HA ASP 803 HA ASP 803 33.257 -45.385 -8.058 14 1HB ASP 803 1HB ASP 803 31.353 -46.972 -8.449 15 2HB ASP 803 2HB ASP 803 32.897 -47.787 -8.197 16 HA ASN 804 HA ASN 804 30.513 -42.993 -5.241 17 1HB ASN 804 1HB ASN 804 30.503 -40.641 -6.048 18 2HB ASN 804 2HB ASN 804 32.145 -41.267 -5.902 19 2HD2 ASN 804 1HD2 ASN 804 30.284 -39.456 -7.948 20 1HD2 ASN 804 2HD2 ASN 804 31.030 -39.829 -9.426 21 HA GLU 805 HA GLU 805 27.020 -43.840 -7.886 22 1HB GLU 805 1HB GLU 805 26.572 -44.051 -5.112 23 2HB GLU 805 2HB GLU 805 25.237 -43.073 -5.723 24 1HG GLU 805 1HG GLU 805 25.246 -44.947 -7.633 25 2HG GLU 805 2HG GLU 805 25.943 -45.908 -6.329 26 HA ASP 806 HA ASP 806 25.608 -39.664 -8.598 27 1HB ASP 806 1HB ASP 806 25.119 -41.609 -10.760 28 2HB ASP 806 2HB ASP 806 24.143 -40.145 -10.883 29 HA ASN 807 HA ASN 807 21.261 -40.078 -7.400 30 1HB ASN 807 1HB ASN 807 22.769 -41.151 -5.374 31 2HB ASN 807 2HB ASN 807 22.063 -39.751 -4.568 32 2HD2 ASN 807 1HD2 ASN 807 19.563 -39.726 -6.090 33 1HD2 ASN 807 2HD2 ASN 807 18.672 -41.088 -5.609 34 HA PHE 808 HA PHE 808 21.591 -35.800 -5.316 35 1HB PHE 808 1HB PHE 808 19.358 -34.943 -6.112 36 2HB PHE 808 2HB PHE 808 20.153 -36.013 -7.267 37 HD1 PHE 808 HD1 PHE 808 17.608 -35.957 -4.533 38 HD2 PHE 808 HD2 PHE 808 19.105 -37.997 -8.003 39 HE1 PHE 808 HE1 PHE 808 15.641 -37.467 -4.492 40 HE2 PHE 808 HE2 PHE 808 17.139 -39.508 -7.962 41 HZ PHE 808 HZ PHE 808 15.407 -39.243 -6.207 42 HA ASP 809 HA ASP 809 18.784 -35.746 -1.681 43 1HB ASP 809 1HB ASP 809 19.638 -33.803 -0.436 44 2HB ASP 809 2HB ASP 809 20.061 -33.001 -1.950 45 1HA GLY 810 1HA GLY 810 15.380 -32.865 -2.280 46 2HA GLY 810 2HA GLY 810 15.547 -32.370 -0.595 47 HA ASP 811 HA ASP 811 16.830 -28.451 -2.262 48 1HB ASP 811 1HB ASP 811 17.635 -28.425 0.091 49 2HB ASP 811 2HB ASP 811 18.542 -27.300 -0.919 50 HA ASP 812 HA ASP 812 20.341 -29.386 -5.083 51 1HB ASP 812 1HB ASP 812 18.287 -31.449 -5.684 52 2HB ASP 812 2HB ASP 812 19.364 -31.019 -7.014 53 HA PHE 813 HA PHE 813 18.642 -26.501 -8.012 54 1HB PHE 813 1HB PHE 813 16.215 -26.164 -8.266 55 2HB PHE 813 2HB PHE 813 16.558 -27.836 -7.831 56 HD1 PHE 813 HD1 PHE 813 16.338 -28.537 -5.391 57 HD2 PHE 813 HD2 PHE 813 14.864 -24.789 -6.885 58 HE1 PHE 813 HE1 PHE 813 14.879 -28.315 -3.397 59 HE2 PHE 813 HE2 PHE 813 13.406 -24.567 -4.891 60 HZ PHE 813 HZ PHE 813 13.413 -26.331 -3.147 61 HA ASP 814 HA ASP 814 17.599 -22.713 -5.471 62 1HB ASP 814 1HB ASP 814 15.955 -24.306 -3.877 63 2HB ASP 814 2HB ASP 814 16.971 -23.459 -2.711 64 HA ASP 815 HA ASP 815 21.414 -23.453 -2.918 65 1HB ASP 815 1HB ASP 815 22.013 -24.778 -5.515 66 2HB ASP 815 2HB ASP 815 23.396 -24.137 -4.628 67 HA VAL 816 HA VAL 816 22.450 -19.572 -5.222 68 HB VAL 816 HB VAL 816 20.266 -18.615 -3.347 69 1HG1 VAL 816 1HG1 VAL 816 22.037 -16.999 -4.354 70 2HG1 VAL 816 2HG1 VAL 816 21.208 -17.288 -5.883 71 3HG1 VAL 816 3HG1 VAL 816 20.333 -16.577 -4.527 72 1HG2 VAL 816 1HG2 VAL 816 20.207 -19.658 -6.179 73 2HG2 VAL 816 2HG2 VAL 816 19.163 -20.094 -4.827 74 3HG2 VAL 816 3HG2 VAL 816 18.984 -18.524 -5.608 75 HA GLU 817 HA GLU 817 24.425 -18.868 -1.092 76 1HB GLU 817 1HB GLU 817 25.979 -21.217 -2.223 77 2HB GLU 817 2HB GLU 817 26.322 -20.458 -0.668 78 1HG GLU 817 1HG GLU 817 23.682 -20.879 -0.357 79 2HG GLU 817 2HG GLU 817 24.047 -22.205 -1.460 80 HA GLU 818 HA GLU 818 27.631 -17.460 -4.502 81 1HB GLU 818 1HB GLU 818 25.004 -16.334 -5.276 82 2HB GLU 818 2HB GLU 818 26.373 -15.247 -5.505 83 1HG GLU 818 1HG GLU 818 27.439 -17.515 -6.514 84 2HG GLU 818 2HG GLU 818 25.737 -17.806 -6.878 85 HA ASP 819 HA ASP 819 29.048 -14.170 -1.918 86 1HB ASP 819 1HB ASP 819 29.607 -13.343 -4.432 87 2HB ASP 819 2HB ASP 819 28.571 -12.012 -3.912 88 HA GLU 820 HA GLU 820 24.938 -12.656 -0.788 89 1HB GLU 820 1HB GLU 820 26.559 -13.445 1.643 90 2HB GLU 820 2HB GLU 820 24.935 -12.771 1.779 91 1HG GLU 820 1HG GLU 820 23.966 -14.591 0.588 92 2HG GLU 820 2HG GLU 820 25.538 -15.153 0.021 93 1HA GLY 821 1HA GLY 821 26.105 -8.704 1.177 94 2HA GLY 821 2HA GLY 821 25.648 -8.325 -0.483 95 HA LEU 822 HA LEU 822 21.623 -8.171 2.250 96 1HB LEU 822 1HB LEU 822 23.203 -8.900 4.396 97 2HB LEU 822 2HB LEU 822 22.750 -7.246 4.809 98 HG LEU 822 HG LEU 822 20.745 -9.336 3.928 99 1HD1 LEU 822 1HD1 LEU 822 21.982 -9.899 6.084 100 2HD1 LEU 822 2HD1 LEU 822 21.292 -8.424 6.763 101 3HD1 LEU 822 3HD1 LEU 822 20.232 -9.732 6.237 102 1HD2 LEU 822 1HD2 LEU 822 20.617 -6.544 5.069 103 2HD2 LEU 822 2HD2 LEU 822 19.822 -7.180 3.629 104 3HD2 LEU 822 3HD2 LEU 822 19.255 -7.653 5.230 105 HA ASP 823 HA ASP 823 22.741 -3.711 2.392 106 1HB ASP 823 1HB ASP 823 24.614 -2.575 3.570 107 2HB ASP 823 2HB ASP 823 23.965 -3.912 4.520 108 HA ASP 824 HA ASP 824 26.160 -3.286 -0.764 109 1HB ASP 824 1HB ASP 824 27.446 -5.700 0.388 110 2HB ASP 824 2HB ASP 824 27.894 -5.320 -1.275 111 HA LEU 825 HA LEU 825 23.745 -5.491 -3.808 112 1HB LEU 825 1HB LEU 825 24.927 -7.449 -2.313 113 2HB LEU 825 2HB LEU 825 23.269 -8.047 -2.389 114 HG LEU 825 HG LEU 825 23.591 -7.324 -4.968 115 1HD1 LEU 825 1HD1 LEU 825 26.319 -7.771 -3.810 116 2HD1 LEU 825 2HD1 LEU 825 25.986 -8.358 -5.440 117 3HD1 LEU 825 3HD1 LEU 825 25.810 -6.643 -5.066 118 1HD2 LEU 825 1HD2 LEU 825 23.100 -9.611 -3.727 119 2HD2 LEU 825 2HD2 LEU 825 23.617 -9.608 -5.414 120 3HD2 LEU 825 3HD2 LEU 825 24.784 -9.947 -4.134 121 HA GLU 826 HA GLU 826 19.521 -5.734 -1.992 122 1HB GLU 826 1HB GLU 826 20.264 -4.675 0.110 123 2HB GLU 826 2HB GLU 826 18.736 -3.976 -0.426 124 1HG GLU 826 1HG GLU 826 21.260 -2.660 0.027 125 2HG GLU 826 2HG GLU 826 20.804 -2.472 -1.667 126 HA ASN 827 HA ASN 827 19.015 -2.072 -5.016 127 1HB ASN 827 1HB ASN 827 21.209 -3.650 -6.292 128 2HB ASN 827 2HB ASN 827 20.146 -2.732 -7.360 129 2HD2 ASN 827 1HD2 ASN 827 22.833 -1.935 -7.156 130 1HD2 ASN 827 2HD2 ASN 827 22.930 -0.469 -6.306 131 HA ALA 828 HA ALA 828 16.298 -5.161 -6.933 132 1HB ALA 828 3HB ALA 828 15.524 -6.919 -5.628 133 2HB ALA 828 2HB ALA 828 15.187 -5.877 -4.246 134 3HB ALA 828 1HB ALA 828 16.845 -6.359 -4.603 135 HA GLU 829 HA GLU 829 12.539 -2.822 -6.150 136 1HB GLU 829 1HB GLU 829 11.416 -5.632 -6.190 137 2HB GLU 829 2HB GLU 829 10.383 -4.210 -6.339 138 1HG GLU 829 1HG GLU 829 11.926 -3.469 -8.243 139 2HG GLU 829 2HG GLU 829 12.597 -5.099 -8.195 140 HA GLU 830 HA GLU 830 12.998 -2.160 -1.470 141 1HB GLU 830 1HB GLU 830 10.752 -1.659 -3.095 142 2HB GLU 830 2HB GLU 830 10.128 -2.567 -1.718 143 1HG GLU 830 1HG GLU 830 11.851 -0.821 -0.486 144 2HG GLU 830 2HG GLU 830 11.248 0.162 -1.820 145 HA GLU 831 HA GLU 831 12.835 -7.272 -1.793 146 1HB GLU 831 1HB GLU 831 13.516 -5.452 0.243 147 2HB GLU 831 2HB GLU 831 12.229 -6.441 0.931 148 1HG GLU 831 1HG GLU 831 13.838 -8.286 -0.404 149 2HG GLU 831 2HG GLU 831 14.993 -7.164 0.317 150 1HA GLY 832 1HA GLY 832 8.805 -8.405 0.407 151 2HA GLY 832 2HA GLY 832 8.469 -7.729 -1.187 152 HA GLN 833 HA GLN 833 8.247 -11.844 -2.740 153 1HB GLN 833 1HB GLN 833 8.048 -12.383 -0.331 154 2HB GLN 833 2HB GLN 833 6.967 -13.403 -1.284 155 1HG GLN 833 1HG GLN 833 6.070 -10.787 -0.056 156 2HG GLN 833 2HG GLN 833 5.063 -12.082 -0.703 157 2HE2 GLN 833 1HE2 GLN 833 5.674 -14.348 0.486 158 1HE2 GLN 833 2HE2 GLN 833 5.741 -14.241 2.179 159 HA GLU 834 HA GLU 834 4.667 -11.211 -5.248 160 1HB GLU 834 1HB GLU 834 3.446 -10.726 -3.207 161 2HB GLU 834 2HB GLU 834 4.031 -9.064 -3.193 162 1HG GLU 834 1HG GLU 834 2.322 -8.396 -4.496 163 2HG GLU 834 2HG GLU 834 2.720 -9.612 -5.708 164 HA ASN 835 HA ASN 835 6.605 -8.018 -7.804 165 1HB ASN 835 1HB ASN 835 4.509 -8.914 -9.750 166 2HB ASN 835 2HB ASN 835 6.148 -8.382 -10.063 167 2HD2 ASN 835 1HD2 ASN 835 7.913 -9.972 -9.226 168 1HD2 ASN 835 2HD2 ASN 835 7.584 -11.626 -9.407 169 HA VAL 836 HA VAL 836 2.994 -5.524 -7.418 170 HB VAL 836 HB VAL 836 4.058 -5.707 -5.236 171 1HG1 VAL 836 1HG1 VAL 836 6.075 -3.966 -6.569 172 2HG1 VAL 836 2HG1 VAL 836 5.823 -3.751 -4.844 173 3HG1 VAL 836 3HG1 VAL 836 6.310 -5.321 -5.474 174 1HG2 VAL 836 1HG2 VAL 836 3.501 -2.822 -5.983 175 2HG2 VAL 836 2HG2 VAL 836 2.355 -3.980 -5.308 176 3HG2 VAL 836 3HG2 VAL 836 3.698 -3.396 -4.327 177 HA GLU 837 HA GLU 837 4.318 -1.981 -9.815 178 1HB GLU 837 1HB GLU 837 2.321 -3.623 -11.125 179 2HB GLU 837 2HB GLU 837 1.986 -1.920 -11.411 180 1HG GLU 837 1HG GLU 837 4.763 -3.056 -11.748 181 2HG GLU 837 2HG GLU 837 3.585 -3.103 -13.060 182 HA ILE 838 HA ILE 838 0.955 0.542 -8.211 183 HB ILE 838 HB ILE 838 3.679 1.846 -8.265 184 1HG1 ILE 838 1HG1 ILE 838 2.511 -0.250 -6.770 185 2HG1 ILE 838 2HG1 ILE 838 4.074 0.507 -6.500 186 1HG2 ILE 838 1HG2 ILE 838 1.203 2.838 -6.843 187 2HG2 ILE 838 2HG2 ILE 838 2.841 3.371 -6.466 188 3HG2 ILE 838 3HG2 ILE 838 2.152 3.695 -8.057 189 1HD1 ILE 838 1HD1 ILE 838 1.498 1.652 -5.395 190 2HD1 ILE 838 2HD1 ILE 838 2.496 0.508 -4.500 191 3HD1 ILE 838 3HD1 ILE 838 3.149 2.077 -4.961 192 HA LEU 839 HA LEU 839 0.248 4.280 -10.720 193 1HB LEU 839 1HB LEU 839 -0.881 1.714 -11.417 194 2HB LEU 839 2HB LEU 839 -2.062 2.979 -11.751 195 HG LEU 839 HG LEU 839 0.284 4.097 -12.689 196 1HD1 LEU 839 1HD1 LEU 839 0.557 1.180 -12.649 197 2HD1 LEU 839 2HD1 LEU 839 0.732 1.856 -14.268 198 3HD1 LEU 839 3HD1 LEU 839 1.775 2.416 -12.962 199 1HD2 LEU 839 1HD2 LEU 839 -2.096 2.746 -13.853 200 2HD2 LEU 839 2HD2 LEU 839 -1.490 4.381 -14.118 201 3HD2 LEU 839 3HD2 LEU 839 -0.741 3.017 -14.948 202 HA PRO 840 HA PRO 840 -2.904 6.546 -8.633 203 1HB PRO 840 1HB PRO 840 -3.146 8.304 -10.035 204 2HB PRO 840 2HB PRO 840 -4.295 7.377 -11.003 205 1HG PRO 840 1HG PRO 840 -1.623 8.130 -11.704 206 2HG PRO 840 2HG PRO 840 -2.744 7.141 -12.644 207 1HD PRO 840 1HD PRO 840 -1.420 5.327 -12.246 208 2HD PRO 840 2HD PRO 840 -0.370 6.296 -11.183 209 HA SER 841 HA SER 841 -6.249 3.718 -7.770 210 1HB SER 841 1HB SER 841 -7.943 4.977 -6.941 211 2HB SER 841 2HB SER 841 -6.945 6.367 -7.351 212 HG SER 841 HG SER 841 -9.296 5.707 -8.340 213 1HA GLY 842 1HA GLY 842 -7.573 3.016 -11.929 214 2HA GLY 842 2HA GLY 842 -7.353 1.387 -11.300 215 HA GLU 843 HA GLU 843 -11.488 -0.201 -10.144 216 1HB GLU 843 1HB GLU 843 -11.539 1.840 -8.736 217 2HB GLU 843 2HB GLU 843 -11.717 2.833 -10.182 218 1HG GLU 843 1HG GLU 843 -13.754 1.031 -10.514 219 2HG GLU 843 2HG GLU 843 -13.724 1.201 -8.758 220 HA ARG 844 HA ARG 844 -12.006 0.898 -14.599 221 1HB ARG 844 1HB ARG 844 -9.866 -1.218 -14.517 222 2HB ARG 844 2HB ARG 844 -10.639 -0.765 -16.037 223 1HG ARG 844 1HG ARG 844 -9.330 1.214 -14.151 224 2HG ARG 844 2HG ARG 844 -8.532 0.520 -15.564 225 1HD ARG 844 1HD ARG 844 -10.817 1.378 -16.736 226 2HD ARG 844 2HD ARG 844 -10.678 2.576 -15.433 227 HE ARG 844 HE ARG 844 -8.562 2.046 -17.477 228 1HH1 ARG 844 1HH1 ARG 844 -7.308 3.077 -15.059 229 2HH1 ARG 844 2HH1 ARG 844 -7.436 4.795 -15.231 230 1HH2 ARG 844 1HH2 ARG 844 -9.894 4.633 -17.670 231 2HH2 ARG 844 2HH2 ARG 844 -8.901 5.676 -16.710 232 HA PRO 845 HA PRO 845 -15.213 -2.304 -14.327 233 1HB PRO 845 1HB PRO 845 -16.637 -0.859 -16.368 234 2HB PRO 845 2HB PRO 845 -17.001 -0.933 -14.642 235 1HG PRO 845 1HG PRO 845 -16.004 1.304 -16.102 236 2HG PRO 845 2HG PRO 845 -16.273 1.191 -14.361 237 1HD PRO 845 1HD PRO 845 -14.018 1.255 -14.045 238 2HD PRO 845 2HD PRO 845 -13.742 1.210 -15.804 239 HA GLN 846 HA GLN 846 -14.112 -4.523 -17.999 240 1HB GLN 846 1HB GLN 846 -13.569 -2.294 -18.871 241 2HB GLN 846 2HB GLN 846 -11.957 -2.396 -18.162 242 1HG GLN 846 1HG GLN 846 -11.192 -3.855 -19.765 243 2HG GLN 846 2HG GLN 846 -12.771 -4.611 -19.978 244 2HE2 GLN 846 1HE2 GLN 846 -10.930 -3.468 -22.079 245 1HE2 GLN 846 2HE2 GLN 846 -11.855 -2.301 -22.894 246 HA ALA 847 HA ALA 847 -9.918 -6.141 -16.704 247 1HB ALA 847 1HB ALA 847 -9.216 -3.585 -15.871 248 2HB ALA 847 2HB ALA 847 -8.954 -4.557 -14.423 249 3HB ALA 847 3HB ALA 847 -8.127 -4.971 -15.924 250 HA ASN 848 HA ASN 848 -12.311 -6.888 -12.566 251 1HB ASN 848 1HB ASN 848 -14.154 -7.502 -14.819 252 2HB ASN 848 2HB ASN 848 -14.298 -8.539 -13.400 253 2HD2 ASN 848 1HD2 ASN 848 -15.243 -5.523 -14.694 254 1HD2 ASN 848 2HD2 ASN 848 -15.800 -4.812 -13.257 255 HA GLN 849 HA GLN 849 -10.380 -10.881 -13.431 256 1HB GLN 849 1HB GLN 849 -7.840 -10.686 -13.241 257 2HB GLN 849 2HB GLN 849 -8.587 -9.662 -14.465 258 1HG GLN 849 1HG GLN 849 -8.012 -7.752 -13.391 259 2HG GLN 849 2HG GLN 849 -8.433 -8.407 -11.809 260 2HE2 GLN 849 1HE2 GLN 849 -5.826 -7.382 -13.641 261 1HE2 GLN 849 2HE2 GLN 849 -4.591 -8.153 -12.791 262 HA LYS 850 HA LYS 850 -8.166 -11.281 -9.055 263 1HB LYS 850 1HB LYS 850 -9.810 -13.008 -8.271 264 2HB LYS 850 2HB LYS 850 -10.598 -11.655 -9.074 265 1HG LYS 850 1HG LYS 850 -11.642 -13.421 -10.153 266 2HG LYS 850 2HG LYS 850 -10.261 -13.193 -11.225 267 1HD LYS 850 1HD LYS 850 -9.210 -15.108 -10.510 268 2HD LYS 850 2HD LYS 850 -9.852 -14.972 -8.872 269 1HE LYS 850 1HE LYS 850 -11.671 -16.253 -9.370 270 2HE LYS 850 2HE LYS 850 -11.930 -15.425 -10.919 271 1HZ LYS 850 1HZ LYS 850 -9.996 -16.611 -11.808 272 2HZ LYS 850 2HZ LYS 850 -9.838 -17.458 -10.344 273 3HZ LYS 850 3HZ LYS 850 -11.212 -17.687 -11.317 274 HA ARG 851 HA ARG 851 -6.590 -15.606 -9.255 275 1HB ARG 851 1HB ARG 851 -5.134 -13.272 -10.148 276 2HB ARG 851 2HB ARG 851 -4.016 -14.455 -9.467 277 1HG ARG 851 1HG ARG 851 -6.135 -15.522 -11.260 278 2HG ARG 851 2HG ARG 851 -4.865 -14.567 -12.025 279 1HD ARG 851 1HD ARG 851 -3.160 -16.017 -10.865 280 2HD ARG 851 2HD ARG 851 -4.495 -17.049 -10.313 281 HE ARG 851 HE ARG 851 -5.091 -17.099 -12.870 282 1HH1 ARG 851 1HH1 ARG 851 -2.307 -15.630 -13.139 283 2HH1 ARG 851 2HH1 ARG 851 -1.358 -16.945 -13.748 284 1HH2 ARG 851 1HH2 ARG 851 -3.716 -19.360 -12.951 285 2HH2 ARG 851 2HH2 ARG 851 -2.157 -19.057 -13.642 286 HA ILE 852 HA ILE 852 -4.629 -15.295 -5.121 287 HB ILE 852 HB ILE 852 -2.183 -14.702 -5.029 288 1HG1 ILE 852 1HG1 ILE 852 -3.135 -12.783 -7.055 289 2HG1 ILE 852 2HG1 ILE 852 -1.704 -13.667 -7.554 290 1HG2 ILE 852 1HG2 ILE 852 -3.318 -16.599 -6.427 291 2HG2 ILE 852 2HG2 ILE 852 -2.887 -15.597 -7.814 292 3HG2 ILE 852 3HG2 ILE 852 -1.630 -16.208 -6.738 293 1HD1 ILE 852 1HD1 ILE 852 -1.033 -13.067 -4.989 294 2HD1 ILE 852 2HD1 ILE 852 -0.627 -12.039 -6.363 295 3HD1 ILE 852 3HD1 ILE 852 -2.046 -11.682 -5.382 296 HA THR 853 HA THR 853 -3.533 -10.841 -3.450 297 HB THR 853 HB THR 853 -4.666 -8.804 -4.416 298 HG1 THR 853 HG1 THR 853 -5.895 -10.751 -5.820 299 1HG2 THR 853 1HG2 THR 853 -2.338 -9.639 -4.986 300 2HG2 THR 853 2HG2 THR 853 -3.038 -10.347 -6.433 301 3HG2 THR 853 3HG2 THR 853 -3.090 -8.602 -6.199 302 HA THR 854 HA THR 854 -7.267 -11.890 -1.322 303 HB THR 854 HB THR 854 -5.423 -12.186 0.340 304 HG1 THR 854 HG1 THR 854 -6.688 -11.558 2.153 305 1HG2 THR 854 1HG2 THR 854 -4.571 -9.777 -0.119 306 2HG2 THR 854 2HG2 THR 854 -5.778 -9.283 1.066 307 3HG2 THR 854 3HG2 THR 854 -4.483 -10.385 1.534 308 HA PRO 855 HA PRO 855 -9.295 -8.034 -2.255 309 1HB PRO 855 1HB PRO 855 -11.442 -8.789 -2.104 310 2HB PRO 855 2HB PRO 855 -11.370 -8.648 -0.344 311 1HG PRO 855 1HG PRO 855 -11.445 -11.047 -1.882 312 2HG PRO 855 2HG PRO 855 -11.219 -10.908 -0.136 313 1HD PRO 855 1HD PRO 855 -9.081 -11.691 -0.432 314 2HD PRO 855 2HD PRO 855 -9.227 -11.562 -2.204 315 HA TYR 856 HA TYR 856 -7.925 -5.359 0.996 316 1HB TYR 856 1HB TYR 856 -8.542 -7.290 2.360 317 2HB TYR 856 2HB TYR 856 -7.006 -8.060 2.015 318 HD1 TYR 856 HD1 TYR 856 -4.859 -6.690 2.743 319 HD2 TYR 856 HD2 TYR 856 -8.804 -6.026 4.296 320 HE1 TYR 856 HE1 TYR 856 -3.887 -5.604 4.733 321 HE2 TYR 856 HE2 TYR 856 -7.832 -4.953 6.299 322 HH TYR 856 HH TYR 856 -5.945 -4.133 7.227 323 HA MET 857 HA MET 857 -3.894 -5.148 -1.086 324 1HB MET 857 1HB MET 857 -4.860 -2.859 -1.348 325 2HB MET 857 2HB MET 857 -4.389 -2.499 0.306 326 1HG MET 857 1HG MET 857 -2.080 -3.531 -0.994 327 2HG MET 857 2HG MET 857 -2.347 -1.889 -0.426 328 1HE MET 857 1HE MET 857 -4.584 -0.774 -1.901 329 2HE MET 857 2HE MET 857 -3.043 0.085 -1.829 330 3HE MET 857 3HE MET 857 -3.904 -0.066 -3.359 331 HA THR 858 HA THR 858 -1.633 -5.176 2.821 332 HB THR 858 HB THR 858 0.146 -6.861 2.423 333 HG1 THR 858 HG1 THR 858 -0.537 -6.433 -0.298 334 1HG2 THR 858 1HG2 THR 858 -2.335 -7.349 2.516 335 2HG2 THR 858 2HG2 THR 858 -2.329 -7.345 0.753 336 3HG2 THR 858 3HG2 THR 858 -1.383 -8.544 1.634 337 HA LYS 859 HA LYS 859 0.935 -1.775 3.657 338 1HB LYS 859 1HB LYS 859 2.827 -2.505 5.107 339 2HB LYS 859 2HB LYS 859 1.276 -3.171 5.618 340 1HG LYS 859 1HG LYS 859 1.774 -5.296 4.556 341 2HG LYS 859 2HG LYS 859 3.257 -4.644 3.857 342 1HD LYS 859 1HD LYS 859 4.416 -4.851 5.803 343 2HD LYS 859 2HD LYS 859 3.046 -4.336 6.786 344 1HE LYS 859 1HE LYS 859 2.237 -6.488 7.031 345 2HE LYS 859 2HE LYS 859 2.859 -7.010 5.451 346 1HZ LYS 859 1HZ LYS 859 5.133 -6.679 6.391 347 2HZ LYS 859 2HZ LYS 859 4.420 -6.479 7.919 348 3HZ LYS 859 3HZ LYS 859 4.268 -7.957 7.094 349 HA TYR 860 HA TYR 860 4.812 -3.066 1.154 350 1HB TYR 860 1HB TYR 860 4.737 -5.455 0.940 351 2HB TYR 860 2HB TYR 860 3.399 -5.381 -0.197 352 HD1 TYR 860 HD1 TYR 860 5.985 -2.800 -0.336 353 HD2 TYR 860 HD2 TYR 860 4.801 -6.614 -1.941 354 HE1 TYR 860 HE1 TYR 860 7.572 -2.490 -2.189 355 HE2 TYR 860 HE2 TYR 860 6.406 -6.292 -3.796 356 HH TYR 860 HH TYR 860 8.580 -4.977 -4.152 357 HA GLU 861 HA GLU 861 2.205 -2.203 -2.904 358 1HB GLU 861 1HB GLU 861 -0.205 -1.953 -2.971 359 2HB GLU 861 2HB GLU 861 -0.322 -2.113 -1.222 360 1HG GLU 861 1HG GLU 861 -0.934 -4.185 -2.631 361 2HG GLU 861 2HG GLU 861 0.175 -4.434 -1.288 362 HA ARG 862 HA ARG 862 1.169 1.672 -0.141 363 1HB ARG 862 1HB ARG 862 0.146 0.706 1.815 364 2HB ARG 862 2HB ARG 862 1.648 -0.086 2.277 365 1HG ARG 862 1HG ARG 862 1.770 2.867 1.945 366 2HG ARG 862 2HG ARG 862 0.877 2.278 3.342 367 1HD ARG 862 1HD ARG 862 2.771 1.592 4.404 368 2HD ARG 862 2HD ARG 862 3.449 0.899 2.917 369 HE ARG 862 HE ARG 862 3.601 3.561 2.375 370 1HH1 ARG 862 1HH1 ARG 862 5.551 1.454 3.937 371 2HH1 ARG 862 2HH1 ARG 862 6.332 2.603 4.972 372 1HH2 ARG 862 1HH2 ARG 862 4.119 5.169 4.235 373 2HH2 ARG 862 2HH2 ARG 862 5.522 4.706 5.141 374 HA ALA 863 HA ALA 863 5.714 1.404 1.375 375 1HB ALA 863 2HB ALA 863 6.658 -1.273 0.671 376 2HB ALA 863 3HB ALA 863 6.814 -0.404 2.197 377 3HB ALA 863 1HB ALA 863 5.348 -1.319 1.850 378 HA ARG 864 HA ARG 864 6.747 0.505 -3.128 379 1HB ARG 864 1HB ARG 864 4.540 -1.280 -3.163 380 2HB ARG 864 2HB ARG 864 4.256 -0.152 -4.485 381 1HG ARG 864 1HG ARG 864 5.559 -2.037 -5.298 382 2HG ARG 864 2HG ARG 864 6.765 -1.786 -4.037 383 1HD ARG 864 1HD ARG 864 6.074 0.184 -6.256 384 2HD ARG 864 2HD ARG 864 7.298 0.437 -4.997 385 HE ARG 864 HE ARG 864 8.034 -1.991 -6.025 386 1HH1 ARG 864 1HH1 ARG 864 8.475 1.207 -6.815 387 2HH1 ARG 864 2HH1 ARG 864 8.949 0.935 -8.460 388 1HH2 ARG 864 1HH2 ARG 864 8.106 -2.428 -8.425 389 2HH2 ARG 864 2HH2 ARG 864 8.740 -1.123 -9.371 390 HA VAL 865 HA VAL 865 2.865 3.578 -3.963 391 HB VAL 865 HB VAL 865 2.353 2.334 -1.352 392 1HG1 VAL 865 1HG1 VAL 865 1.897 5.232 -1.752 393 2HG1 VAL 865 2HG1 VAL 865 0.700 4.285 -0.867 394 3HG1 VAL 865 3HG1 VAL 865 2.368 4.352 -0.298 395 1HG2 VAL 865 1HG2 VAL 865 0.614 3.441 -3.507 396 2HG2 VAL 865 2HG2 VAL 865 1.111 1.762 -3.302 397 3HG2 VAL 865 3HG2 VAL 865 0.051 2.518 -2.114 398 HA LEU 866 HA LEU 866 4.900 6.297 -0.450 399 1HB LEU 866 1HB LEU 866 5.162 5.186 1.548 400 2HB LEU 866 2HB LEU 866 5.464 3.654 0.742 401 HG LEU 866 HG LEU 866 7.653 5.676 0.597 402 1HD1 LEU 866 1HD1 LEU 866 6.537 5.489 3.024 403 2HD1 LEU 866 2HD1 LEU 866 7.518 4.024 3.079 404 3HD1 LEU 866 3HD1 LEU 866 8.285 5.590 2.811 405 1HD2 LEU 866 1HD2 LEU 866 7.291 2.707 0.751 406 2HD2 LEU 866 2HD2 LEU 866 8.285 3.652 -0.358 407 3HD2 LEU 866 3HD2 LEU 866 8.820 3.390 1.301 408 1HA GLY 867 1HA GLY 867 8.980 5.004 -2.485 409 2HA GLY 867 2HA GLY 867 8.474 3.507 -3.270 410 HA THR 868 HA THR 868 7.119 5.845 -6.647 411 HB THR 868 HB THR 868 5.274 3.848 -6.478 412 HG1 THR 868 HG1 THR 868 5.718 5.806 -8.461 413 1HG2 THR 868 1HG2 THR 868 3.890 6.526 -6.723 414 2HG2 THR 868 2HG2 THR 868 3.215 5.083 -7.457 415 3HG2 THR 868 3HG2 THR 868 3.435 5.156 -5.711 416 HA ARG 869 HA ARG 869 4.231 9.012 -4.726 417 1HB ARG 869 1HB ARG 869 4.282 7.308 -2.300 418 2HB ARG 869 2HB ARG 869 4.285 9.035 -1.953 419 1HG ARG 869 1HG ARG 869 2.303 9.318 -3.416 420 2HG ARG 869 2HG ARG 869 1.980 8.212 -2.082 421 1HD ARG 869 1HD ARG 869 3.038 6.928 -4.540 422 2HD ARG 869 2HD ARG 869 1.698 6.426 -3.490 423 HE ARG 869 HE ARG 869 0.471 8.464 -4.560 424 1HH1 ARG 869 1HH1 ARG 869 1.544 9.661 -6.619 425 2HH1 ARG 869 2HH1 ARG 869 1.549 8.598 -7.988 426 1HH2 ARG 869 1HH2 ARG 869 1.050 5.733 -6.099 427 2HH2 ARG 869 2HH2 ARG 869 1.272 6.375 -7.693 428 HA ALA 870 HA ALA 870 8.089 10.228 -1.908 429 1HB ALA 870 3HB ALA 870 8.768 8.154 -0.970 430 2HB ALA 870 2HB ALA 870 10.138 8.651 -1.962 431 3HB ALA 870 1HB ALA 870 9.012 7.432 -2.559 432 HA LEU 871 HA LEU 871 10.362 10.446 -5.936 433 1HB LEU 871 1HB LEU 871 9.374 9.037 -8.195 434 2HB LEU 871 2HB LEU 871 10.893 8.776 -7.356 435 HG LEU 871 HG LEU 871 8.447 7.553 -6.171 436 1HD1 LEU 871 1HD1 LEU 871 9.679 6.820 -8.799 437 2HD1 LEU 871 2HD1 LEU 871 9.035 5.554 -7.753 438 3HD1 LEU 871 3HD1 LEU 871 7.979 6.842 -8.333 439 1HD2 LEU 871 1HD2 LEU 871 11.382 6.892 -6.482 440 2HD2 LEU 871 2HD2 LEU 871 10.489 7.189 -4.991 441 3HD2 LEU 871 3HD2 LEU 871 10.222 5.700 -5.897 442 HA GLN 872 HA GLN 872 6.363 11.665 -8.496 443 1HB GLN 872 1HB GLN 872 5.121 10.460 -6.126 444 2HB GLN 872 2HB GLN 872 4.425 12.035 -6.502 445 1HG GLN 872 1HG GLN 872 3.206 10.219 -7.663 446 2HG GLN 872 2HG GLN 872 3.983 11.294 -8.820 447 2HE2 GLN 872 1HE2 GLN 872 3.430 8.097 -8.366 448 1HE2 GLN 872 2HE2 GLN 872 4.826 7.444 -9.075 449 HA ILE 873 HA ILE 873 6.362 15.281 -5.254 450 HB ILE 873 HB ILE 873 7.206 14.865 -2.820 451 1HG1 ILE 873 1HG1 ILE 873 6.165 12.264 -2.568 452 2HG1 ILE 873 2HG1 ILE 873 7.234 12.181 -3.960 453 1HG2 ILE 873 1HG2 ILE 873 4.635 14.206 -4.146 454 2HG2 ILE 873 2HG2 ILE 873 4.791 13.854 -2.428 455 3HG2 ILE 873 3HG2 ILE 873 5.014 15.501 -3.014 456 1HD1 ILE 873 1HD1 ILE 873 8.301 13.666 -1.656 457 2HD1 ILE 873 2HD1 ILE 873 8.085 11.936 -1.413 458 3HD1 ILE 873 3HD1 ILE 873 9.093 12.523 -2.734 459 HA ALA 874 HA ALA 874 11.020 14.451 -4.307 460 1HB ALA 874 1HB ALA 874 10.791 11.967 -6.000 461 2HB ALA 874 3HB ALA 874 11.279 12.070 -4.309 462 3HB ALA 874 2HB ALA 874 12.347 12.672 -5.574 463 HA MET 875 HA MET 875 11.065 15.860 -8.708 464 1HB MET 875 1HB MET 875 9.376 13.916 -9.447 465 2HB MET 875 2HB MET 875 8.235 15.257 -9.537 466 1HG MET 875 1HG MET 875 10.926 15.576 -10.812 467 2HG MET 875 2HG MET 875 9.707 14.609 -11.640 468 1HE MET 875 3HE MET 875 10.919 16.746 -12.991 469 2HE MET 875 2HE MET 875 10.076 18.290 -13.167 470 3HE MET 875 1HE MET 875 11.156 18.023 -11.801 471 HA CYS 876 HA CYS 876 7.936 18.873 -6.979 472 1HB CYS 876 1HB CYS 876 7.250 18.918 -9.349 473 2HB CYS 876 2HB CYS 876 5.935 17.796 -9.012 474 HG CYS 876 HG CYS 876 5.547 20.656 -8.844 475 HA ALA 877 HA ALA 877 4.723 15.838 -5.009 476 1HB ALA 877 3HB ALA 877 4.619 17.918 -4.038 477 2HB ALA 877 1HB ALA 877 3.806 18.637 -5.428 478 3HB ALA 877 2HB ALA 877 2.910 17.591 -4.326 479 HA PRO 878 HA PRO 878 1.241 15.083 -8.324 480 1HB PRO 878 1HB PRO 878 2.402 12.495 -8.757 481 2HB PRO 878 2HB PRO 878 2.225 13.805 -9.929 482 1HG PRO 878 1HG PRO 878 4.625 12.880 -8.604 483 2HG PRO 878 2HG PRO 878 4.473 14.057 -9.902 484 1HD PRO 878 1HD PRO 878 5.165 14.589 -7.215 485 2HD PRO 878 2HD PRO 878 4.744 15.780 -8.464 486 HA VAL 879 HA VAL 879 1.632 11.461 -4.865 487 HB VAL 879 HB VAL 879 2.989 13.831 -3.708 488 1HG1 VAL 879 1HG1 VAL 879 1.203 13.248 -1.999 489 2HG1 VAL 879 2HG1 VAL 879 2.044 11.716 -1.792 490 3HG1 VAL 879 3HG1 VAL 879 2.862 13.232 -1.438 491 1HG2 VAL 879 1HG2 VAL 879 3.829 11.461 -4.709 492 2HG2 VAL 879 2HG2 VAL 879 4.763 12.409 -3.576 493 3HG2 VAL 879 3HG2 VAL 879 3.781 11.075 -2.994 494 HA MET 880 HA MET 880 -2.345 12.794 -3.555 495 1HB MET 880 1HB MET 880 -3.295 11.197 -1.977 496 2HB MET 880 2HB MET 880 -1.697 10.848 -1.320 497 1HG MET 880 1HG MET 880 -1.005 10.042 -3.597 498 2HG MET 880 2HG MET 880 -2.300 9.082 -2.888 499 1HE MET 880 1HE MET 880 -0.862 10.820 -5.495 500 2HE MET 880 2HE MET 880 -1.623 9.494 -6.370 501 3HE MET 880 3HE MET 880 -2.064 11.157 -6.748 502 HA VAL 881 HA VAL 881 -1.734 15.848 -0.411 503 HB VAL 881 HB VAL 881 0.157 15.683 1.342 504 1HG1 VAL 881 1HG1 VAL 881 -2.188 14.350 1.130 505 2HG1 VAL 881 2HG1 VAL 881 -1.077 12.981 1.132 506 3HG1 VAL 881 3HG1 VAL 881 -1.081 14.119 2.479 507 1HG2 VAL 881 1HG2 VAL 881 1.678 14.499 -0.378 508 2HG2 VAL 881 2HG2 VAL 881 1.653 13.854 1.263 509 3HG2 VAL 881 3HG2 VAL 881 0.740 13.052 -0.014 510 HA GLU 882 HA GLU 882 1.418 18.535 -2.085 511 1HB GLU 882 1HB GLU 882 -0.983 19.787 -0.884 512 2HB GLU 882 2HB GLU 882 0.317 20.899 -1.312 513 1HG GLU 882 1HG GLU 882 0.282 20.239 -3.591 514 2HG GLU 882 2HG GLU 882 -0.663 18.792 -3.240 515 HA LEU 883 HA LEU 883 3.551 19.244 2.047 516 1HB LEU 883 1HB LEU 883 4.549 17.064 1.484 517 2HB LEU 883 2HB LEU 883 5.462 17.807 0.173 518 HG LEU 883 HG LEU 883 6.483 19.352 1.919 519 1HD1 LEU 883 1HD1 LEU 883 4.733 17.647 3.597 520 2HD1 LEU 883 2HD1 LEU 883 6.356 17.923 4.229 521 3HD1 LEU 883 3HD1 LEU 883 5.303 19.292 3.874 522 1HD2 LEU 883 1HD2 LEU 883 7.264 16.890 1.031 523 2HD2 LEU 883 2HD2 LEU 883 8.240 17.903 2.096 524 3HD2 LEU 883 3HD2 LEU 883 7.239 16.620 2.773 525 HA GLU 884 HA GLU 884 5.633 22.416 -0.643 526 1HB GLU 884 1HB GLU 884 7.733 20.885 0.727 527 2HB GLU 884 2HB GLU 884 8.367 22.115 -0.367 528 1HG GLU 884 1HG GLU 884 6.093 22.947 1.354 529 2HG GLU 884 2HG GLU 884 7.626 22.656 2.178 530 1HA GLY 885 1HA GLY 885 6.859 19.768 -4.623 531 2HA GLY 885 2HA GLY 885 8.127 20.960 -4.329 532 HA GLU 886 HA GLU 886 9.907 16.731 -2.308 533 1HB GLU 886 1HB GLU 886 10.574 16.995 -4.589 534 2HB GLU 886 2HB GLU 886 11.401 18.511 -4.246 535 1HG GLU 886 1HG GLU 886 12.975 17.186 -2.752 536 2HG GLU 886 2HG GLU 886 12.234 15.724 -3.402 537 HA THR 887 HA THR 887 13.290 18.117 0.282 538 HB THR 887 HB THR 887 10.569 18.392 1.611 539 HG1 THR 887 HG1 THR 887 12.444 20.331 0.736 540 1HG2 THR 887 1HG2 THR 887 13.321 18.930 2.708 541 2HG2 THR 887 2HG2 THR 887 11.958 19.929 3.216 542 3HG2 THR 887 3HG2 THR 887 11.934 18.189 3.506 543 HA ASP 888 HA ASP 888 12.399 14.608 3.229 544 1HB ASP 888 1HB ASP 888 9.950 15.566 3.463 545 2HB ASP 888 2HB ASP 888 9.540 14.040 2.688 546 HA PRO 889 HA PRO 889 12.891 11.328 0.255 547 1HB PRO 889 1HB PRO 889 13.262 9.379 2.335 548 2HB PRO 889 2HB PRO 889 14.504 10.190 1.376 549 1HG PRO 889 1HG PRO 889 13.980 10.559 4.139 550 2HG PRO 889 2HG PRO 889 15.086 11.499 3.133 551 1HD PRO 889 1HD PRO 889 13.709 13.291 3.440 552 2HD PRO 889 2HD PRO 889 12.456 12.268 4.189 553 HA LEU 890 HA LEU 890 8.589 9.849 1.070 554 1HB LEU 890 1HB LEU 890 8.485 7.861 2.477 555 2HB LEU 890 2HB LEU 890 10.136 8.094 1.934 556 HG LEU 890 HG LEU 890 10.226 7.492 4.257 557 1HD1 LEU 890 1HD1 LEU 890 11.664 9.447 3.463 558 2HD1 LEU 890 2HD1 LEU 890 10.520 10.491 4.304 559 3HD1 LEU 890 3HD1 LEU 890 11.441 9.290 5.204 560 1HD2 LEU 890 1HD2 LEU 890 7.747 8.465 4.516 561 2HD2 LEU 890 2HD2 LEU 890 8.810 8.228 5.901 562 3HD2 LEU 890 3HD2 LEU 890 8.637 9.831 5.189 563 HA LEU 891 HA LEU 891 7.147 12.014 5.338 564 1HB LEU 891 1HB LEU 891 8.070 14.125 5.263 565 2HB LEU 891 2HB LEU 891 8.059 14.145 3.510 566 HG LEU 891 HG LEU 891 6.552 15.836 4.611 567 1HD1 LEU 891 1HD1 LEU 891 6.186 14.497 2.259 568 2HD1 LEU 891 2HD1 LEU 891 4.640 14.214 3.063 569 3HD1 LEU 891 3HD1 LEU 891 5.204 15.858 2.792 570 1HD2 LEU 891 1HD2 LEU 891 5.707 13.598 6.076 571 2HD2 LEU 891 2HD2 LEU 891 5.017 15.220 6.131 572 3HD2 LEU 891 3HD2 LEU 891 4.347 14.014 5.034 573 HA ILE 892 HA ILE 892 3.805 12.819 1.949 574 HB ILE 892 HB ILE 892 6.171 12.526 0.214 575 1HG1 ILE 892 1HG1 ILE 892 3.900 14.085 -0.716 576 2HG1 ILE 892 2HG1 ILE 892 4.371 14.493 0.932 577 1HG2 ILE 892 1HG2 ILE 892 3.486 11.444 -0.551 578 2HG2 ILE 892 2HG2 ILE 892 4.506 12.218 -1.751 579 3HG2 ILE 892 3HG2 ILE 892 5.092 10.801 -0.896 580 1HD1 ILE 892 1HD1 ILE 892 6.507 14.093 -1.089 581 2HD1 ILE 892 2HD1 ILE 892 5.586 15.594 -1.144 582 3HD1 ILE 892 3HD1 ILE 892 6.480 15.155 0.312 583 HA ALA 893 HA ALA 893 4.122 8.247 0.644 584 1HB ALA 893 1HB ALA 893 7.001 8.396 1.259 585 2HB ALA 893 3HB ALA 893 6.180 7.534 -0.036 586 3HB ALA 893 2HB ALA 893 6.254 6.840 1.579 587 HA MET 894 HA MET 894 4.331 7.527 5.372 588 1HB MET 894 1HB MET 894 6.396 8.672 5.912 589 2HB MET 894 2HB MET 894 5.684 10.241 5.549 590 1HG MET 894 1HG MET 894 4.206 10.061 7.482 591 2HG MET 894 2HG MET 894 4.798 8.435 7.819 592 1HE MET 894 3HE MET 894 5.834 11.736 6.740 593 2HE MET 894 2HE MET 894 6.324 12.498 8.259 594 3HE MET 894 1HE MET 894 7.539 11.835 7.170 595 HA LYS 895 HA LYS 895 1.454 11.398 6.030 596 1HB LYS 895 1HB LYS 895 2.586 13.220 5.017 597 2HB LYS 895 2HB LYS 895 2.619 12.431 3.443 598 1HG LYS 895 1HG LYS 895 0.621 13.292 2.873 599 2HG LYS 895 2HG LYS 895 -0.109 12.794 4.398 600 1HD LYS 895 1HD LYS 895 0.925 14.769 5.507 601 2HD LYS 895 2HD LYS 895 -0.183 15.234 4.215 602 1HE LYS 895 1HE LYS 895 2.801 15.451 4.328 603 2HE LYS 895 2HE LYS 895 2.058 15.115 2.752 604 1HZ LYS 895 1HZ LYS 895 1.222 17.279 4.612 605 2HZ LYS 895 2HZ LYS 895 2.159 17.506 3.213 606 3HZ LYS 895 3HZ LYS 895 0.555 16.962 3.086 607 HA GLU 896 HA GLU 896 -0.850 9.803 2.003 608 1HB GLU 896 1HB GLU 896 1.794 8.708 1.269 609 2HB GLU 896 2HB GLU 896 0.456 7.612 0.940 610 1HG GLU 896 1HG GLU 896 -0.105 10.385 0.156 611 2HG GLU 896 2HG GLU 896 1.258 9.678 -0.711 612 HA LEU 897 HA LEU 897 -0.936 5.672 4.168 613 1HB LEU 897 1HB LEU 897 1.417 4.894 4.041 614 2HB LEU 897 2HB LEU 897 1.792 5.836 5.483 615 HG LEU 897 HG LEU 897 1.083 3.210 5.559 616 1HD1 LEU 897 1HD1 LEU 897 1.816 4.996 7.360 617 2HD1 LEU 897 2HD1 LEU 897 0.099 4.987 7.762 618 3HD1 LEU 897 3HD1 LEU 897 1.037 3.497 7.862 619 1HD2 LEU 897 1HD2 LEU 897 -1.269 4.102 4.717 620 2HD2 LEU 897 2HD2 LEU 897 -1.199 2.875 5.975 621 3HD2 LEU 897 3HD2 LEU 897 -1.473 4.556 6.406 622 HA LYS 898 HA LYS 898 -0.345 7.827 8.592 623 1HB LYS 898 1HB LYS 898 1.553 9.269 7.957 624 2HB LYS 898 2HB LYS 898 0.480 10.197 6.911 625 1HG LYS 898 1HG LYS 898 -0.656 11.173 8.698 626 2HG LYS 898 2HG LYS 898 -0.192 9.896 9.822 627 1HD LYS 898 1HD LYS 898 2.252 10.936 9.034 628 2HD LYS 898 2HD LYS 898 1.224 12.368 9.115 629 1HE LYS 898 1HE LYS 898 0.454 11.323 11.421 630 2HE LYS 898 2HE LYS 898 2.000 12.191 11.333 631 1HZ LYS 898 1HZ LYS 898 1.741 9.285 10.778 632 2HZ LYS 898 2HZ LYS 898 3.162 10.167 11.055 633 3HZ LYS 898 3HZ LYS 898 2.078 9.883 12.332 634 HA ALA 899 HA ALA 899 -3.816 10.359 6.665 635 1HB ALA 899 2HB ALA 899 -4.161 10.669 4.106 636 2HB ALA 899 3HB ALA 899 -2.755 11.460 4.821 637 3HB ALA 899 1HB ALA 899 -2.560 9.949 3.932 638 HA ARG 900 HA ARG 900 -3.767 5.393 4.720 639 1HB ARG 900 1HB ARG 900 -4.884 4.721 6.606 640 2HB ARG 900 2HB ARG 900 -4.662 6.367 7.188 641 1HG ARG 900 1HG ARG 900 -6.844 6.912 5.908 642 2HG ARG 900 2HG ARG 900 -7.081 5.168 5.840 643 1HD ARG 900 1HD ARG 900 -6.968 5.031 8.295 644 2HD ARG 900 2HD ARG 900 -6.683 6.781 8.386 645 HE ARG 900 HE ARG 900 -9.243 5.503 7.799 646 1HH1 ARG 900 1HH1 ARG 900 -9.474 7.023 5.508 647 2HH1 ARG 900 2HH1 ARG 900 -9.805 8.646 6.014 648 1HH2 ARG 900 1HH2 ARG 900 -8.709 8.139 9.264 649 2HH2 ARG 900 2HH2 ARG 900 -9.373 9.277 8.140 650 HA LYS 901 HA LYS 901 -7.017 7.516 2.362 651 1HB LYS 901 1HB LYS 901 -6.366 9.459 0.865 652 2HB LYS 901 2HB LYS 901 -6.198 9.795 2.585 653 1HG LYS 901 1HG LYS 901 -3.774 9.258 2.434 654 2HG LYS 901 2HG LYS 901 -3.955 8.988 0.703 655 1HD LYS 901 1HD LYS 901 -4.545 11.586 2.153 656 2HD LYS 901 2HD LYS 901 -3.120 11.265 1.166 657 1HE LYS 901 1HE LYS 901 -5.248 10.570 -0.507 658 2HE LYS 901 2HE LYS 901 -4.338 12.092 -0.574 659 1HZ LYS 901 1HZ LYS 901 -6.586 11.623 1.311 660 2HZ LYS 901 2HZ LYS 901 -5.847 13.102 0.919 661 3HZ LYS 901 3HZ LYS 901 -6.819 12.304 -0.224 662 HA ILE 902 HA ILE 902 -2.768 6.163 -0.620 663 HB ILE 902 HB ILE 902 -4.532 3.973 0.498 664 1HG1 ILE 902 1HG1 ILE 902 -3.501 5.145 2.380 665 2HG1 ILE 902 2HG1 ILE 902 -2.679 3.605 2.137 666 1HG2 ILE 902 1HG2 ILE 902 -2.974 3.698 -1.578 667 2HG2 ILE 902 2HG2 ILE 902 -1.666 3.748 -0.397 668 3HG2 ILE 902 3HG2 ILE 902 -2.897 2.489 -0.296 669 1HD1 ILE 902 1HD1 ILE 902 -1.126 5.096 0.562 670 2HD1 ILE 902 2HD1 ILE 902 -1.695 6.382 1.626 671 3HD1 ILE 902 3HD1 ILE 902 -0.838 4.995 2.299 672 HA PRO 903 HA PRO 903 -6.911 6.178 -3.044 673 1HB PRO 903 1HB PRO 903 -6.055 8.504 -4.500 674 2HB PRO 903 2HB PRO 903 -7.427 8.359 -3.401 675 1HG PRO 903 1HG PRO 903 -5.009 9.804 -2.964 676 2HG PRO 903 2HG PRO 903 -6.340 9.571 -1.827 677 1HD PRO 903 1HD PRO 903 -4.980 8.262 -0.570 678 2HD PRO 903 2HD PRO 903 -3.690 8.358 -1.785 679 HA ILE 904 HA ILE 904 -4.613 4.816 -6.528 680 HB ILE 904 HB ILE 904 -2.647 5.224 -4.450 681 1HG1 ILE 904 1HG1 ILE 904 -1.935 5.469 -7.307 682 2HG1 ILE 904 2HG1 ILE 904 -3.381 6.349 -6.817 683 1HG2 ILE 904 1HG2 ILE 904 -2.050 3.173 -6.589 684 2HG2 ILE 904 2HG2 ILE 904 -0.803 4.035 -5.687 685 3HG2 ILE 904 3HG2 ILE 904 -1.923 2.968 -4.842 686 1HD1 ILE 904 1HD1 ILE 904 -0.811 6.529 -5.244 687 2HD1 ILE 904 2HD1 ILE 904 -1.146 7.601 -6.603 688 3HD1 ILE 904 3HD1 ILE 904 -2.201 7.613 -5.191 689 HA ILE 905 HA ILE 905 -4.850 0.411 -6.503 690 HB ILE 905 HB ILE 905 -6.004 1.294 -8.498 691 1HG1 ILE 905 1HG1 ILE 905 -4.519 -0.779 -9.897 692 2HG1 ILE 905 2HG1 ILE 905 -4.863 -1.245 -8.231 693 1HG2 ILE 905 1HG2 ILE 905 -3.187 1.429 -9.575 694 2HG2 ILE 905 2HG2 ILE 905 -4.578 1.333 -10.654 695 3HG2 ILE 905 3HG2 ILE 905 -4.414 2.694 -9.548 696 1HD1 ILE 905 1HD1 ILE 905 -6.995 -0.048 -9.986 697 2HD1 ILE 905 2HD1 ILE 905 -6.660 -1.779 -10.006 698 3HD1 ILE 905 3HD1 ILE 905 -7.192 -0.997 -8.514 699 HA ILE 906 HA ILE 906 -0.680 -0.863 -7.829 700 HB ILE 906 HB ILE 906 -1.643 -1.577 -5.100 701 1HG1 ILE 906 1HG1 ILE 906 0.678 -0.121 -6.348 702 2HG1 ILE 906 2HG1 ILE 906 0.668 -0.514 -4.628 703 1HG2 ILE 906 1HG2 ILE 906 0.619 -3.000 -6.483 704 2HG2 ILE 906 2HG2 ILE 906 0.722 -2.654 -4.756 705 3HG2 ILE 906 3HG2 ILE 906 -0.593 -3.652 -5.379 706 1HD1 ILE 906 1HD1 ILE 906 -1.876 0.560 -5.172 707 2HD1 ILE 906 2HD1 ILE 906 -0.559 1.342 -4.299 708 3HD1 ILE 906 3HD1 ILE 906 -0.732 1.589 -6.034 709 HA ARG 907 HA ARG 907 -1.664 -4.963 -9.262 710 1HB ARG 907 1HB ARG 907 0.771 -3.893 -10.634 711 2HB ARG 907 2HB ARG 907 0.174 -5.506 -10.995 712 1HG ARG 907 1HG ARG 907 -2.030 -4.571 -11.530 713 2HG ARG 907 2HG ARG 907 -0.782 -3.880 -12.558 714 1HD ARG 907 1HD ARG 907 -2.432 -2.576 -10.442 715 2HD ARG 907 2HD ARG 907 -0.737 -2.060 -10.556 716 HE ARG 907 HE ARG 907 -1.263 -1.057 -12.626 717 1HH1 ARG 907 1HH1 ARG 907 -4.152 -2.053 -11.433 718 2HH1 ARG 907 2HH1 ARG 907 -4.903 -2.399 -12.955 719 1HH2 ARG 907 1HH2 ARG 907 -1.960 -2.132 -14.769 720 2HH2 ARG 907 2HH2 ARG 907 -3.662 -2.444 -14.844 721 HA ARG 908 HA ARG 908 1.294 -7.133 -6.746 722 1HB ARG 908 1HB ARG 908 -0.956 -8.850 -5.899 723 2HB ARG 908 2HB ARG 908 0.223 -8.011 -4.915 724 1HG ARG 908 1HG ARG 908 -1.078 -5.879 -5.300 725 2HG ARG 908 2HG ARG 908 -2.317 -6.843 -6.101 726 1HD ARG 908 1HD ARG 908 -2.511 -8.236 -3.965 727 2HD ARG 908 2HD ARG 908 -2.965 -6.537 -3.714 728 HE ARG 908 HE ARG 908 -0.505 -6.253 -2.988 729 1HH1 ARG 908 1HH1 ARG 908 1.202 -8.042 -2.588 730 2HH1 ARG 908 2HH1 ARG 908 0.682 -9.210 -1.419 731 1HH2 ARG 908 1HH2 ARG 908 -2.654 -8.277 -1.579 732 2HH2 ARG 908 2HH2 ARG 908 -1.500 -9.343 -0.848 733 HA TYR 909 HA TYR 909 0.813 -10.460 -9.765 734 1HB TYR 909 1HB TYR 909 3.656 -9.851 -10.429 735 2HB TYR 909 2HB TYR 909 2.386 -10.429 -11.471 736 HD1 TYR 909 HD1 TYR 909 3.657 -7.334 -9.752 737 HD2 TYR 909 HD2 TYR 909 1.109 -8.980 -12.774 738 HE1 TYR 909 HE1 TYR 909 3.382 -5.100 -10.732 739 HE2 TYR 909 HE2 TYR 909 0.813 -6.745 -13.752 740 HH TYR 909 HH TYR 909 1.007 -4.452 -13.190 741 HA LEU 910 HA LEU 910 3.839 -12.873 -7.471 742 1HB LEU 910 1HB LEU 910 1.898 -14.615 -8.981 743 2HB LEU 910 2HB LEU 910 2.772 -15.136 -7.538 744 HG LEU 910 HG LEU 910 0.726 -12.918 -7.779 745 1HD1 LEU 910 1HD1 LEU 910 0.834 -15.679 -6.681 746 2HD1 LEU 910 2HD1 LEU 910 -0.112 -14.490 -5.789 747 3HD1 LEU 910 3HD1 LEU 910 -0.487 -14.832 -7.475 748 1HD2 LEU 910 1HD2 LEU 910 2.921 -13.224 -5.898 749 2HD2 LEU 910 2HD2 LEU 910 1.754 -11.912 -6.043 750 3HD2 LEU 910 3HD2 LEU 910 1.367 -13.330 -5.075 751 HA PRO 911 HA PRO 911 7.026 -14.122 -10.383 752 1HB PRO 911 1HB PRO 911 8.632 -14.763 -8.082 753 2HB PRO 911 2HB PRO 911 8.784 -13.356 -9.139 754 1HG PRO 911 1HG PRO 911 7.854 -13.414 -6.431 755 2HG PRO 911 2HG PRO 911 7.966 -12.017 -7.506 756 1HD PRO 911 1HD PRO 911 5.688 -11.961 -7.647 757 2HD PRO 911 2HD PRO 911 5.575 -13.410 -6.628 758 HA ASP 912 HA ASP 912 6.478 -18.329 -8.061 759 1HB ASP 912 1HB ASP 912 4.166 -16.933 -6.810 760 2HB ASP 912 2HB ASP 912 3.994 -18.675 -7.026 761 1HA GLY 913 1HA GLY 913 3.509 -17.662 -11.997 762 2HA GLY 913 2HA GLY 913 3.139 -19.147 -11.124 763 HA SER 914 HA SER 914 -0.553 -16.142 -11.458 764 1HB SER 914 1HB SER 914 0.262 -16.363 -8.566 765 2HB SER 914 2HB SER 914 -1.324 -15.738 -9.005 766 HG SER 914 HG SER 914 -1.644 -17.687 -10.187 767 HA TYR 915 HA TYR 915 -0.202 -11.883 -9.420 768 1HB TYR 915 1HB TYR 915 0.862 -11.373 -11.377 769 2HB TYR 915 2HB TYR 915 -0.037 -12.609 -12.241 770 HD1 TYR 915 HD1 TYR 915 -0.500 -9.137 -10.861 771 HD2 TYR 915 HD2 TYR 915 -1.509 -11.974 -13.926 772 HE1 TYR 915 HE1 TYR 915 -1.790 -7.390 -12.056 773 HE2 TYR 915 HE2 TYR 915 -2.798 -10.225 -15.119 774 HH TYR 915 HH TYR 915 -2.475 -7.053 -14.635 775 HA GLU 916 HA GLU 916 -4.327 -9.958 -10.504 776 1HB GLU 916 1HB GLU 916 -3.850 -11.091 -8.021 777 2HB GLU 916 2HB GLU 916 -4.356 -9.450 -7.626 778 1HG GLU 916 1HG GLU 916 -5.928 -10.907 -9.697 779 2HG GLU 916 2HG GLU 916 -6.142 -11.392 -8.014 780 HA ASP 917 HA ASP 917 -3.356 -5.657 -9.637 781 1HB ASP 917 1HB ASP 917 -3.582 -6.054 -12.101 782 2HB ASP 917 2HB ASP 917 -3.920 -4.430 -11.579 783 HA TRP 918 HA TRP 918 -6.494 -2.608 -8.459 784 1HB TRP 918 1HB TRP 918 -7.918 -3.798 -6.783 785 2HB TRP 918 2HB TRP 918 -7.954 -4.494 -8.385 786 HD1 TRP 918 HD1 TRP 918 -4.811 -5.793 -7.199 787 HE1 TRP 918 HE1 TRP 918 -5.137 -8.155 -6.219 788 HE3 TRP 918 HE3 TRP 918 -9.752 -5.597 -6.357 789 HZ2 TRP 918 HZ2 TRP 918 -7.297 -9.709 -5.057 790 HZ3 TRP 918 HZ3 TRP 918 -10.944 -7.401 -5.234 791 HH2 TRP 918 HH2 TRP 918 -9.746 -9.504 -4.587 792 1HA GLY 919 1HA GLY 919 -4.855 -2.633 -4.156 793 2HA GLY 919 2HA GLY 919 -4.562 -1.079 -4.923 794 HA VAL 920 HA VAL 920 -7.664 0.187 -2.099 795 HB VAL 920 HB VAL 920 -6.512 2.665 -3.432 796 1HG1 VAL 920 1HG1 VAL 920 -7.891 2.257 -0.761 797 2HG1 VAL 920 2HG1 VAL 920 -7.032 3.726 -1.220 798 3HG1 VAL 920 3HG1 VAL 920 -8.475 3.235 -2.106 799 1HG2 VAL 920 1HG2 VAL 920 -5.546 0.723 -1.383 800 2HG2 VAL 920 2HG2 VAL 920 -4.634 1.615 -2.600 801 3HG2 VAL 920 3HG2 VAL 920 -5.163 2.423 -1.128 802 HA ASP 921 HA ASP 921 -10.475 1.961 -5.345 803 1HB ASP 921 1HB ASP 921 -8.484 1.125 -7.303 804 2HB ASP 921 2HB ASP 921 -10.119 0.825 -7.889 805 HA GLU 922 HA GLU 922 -12.238 -2.216 -5.393 806 1HB GLU 922 1HB GLU 922 -10.356 -2.672 -7.152 807 2HB GLU 922 2HB GLU 922 -9.766 -3.821 -5.954 808 1HG GLU 922 1HG GLU 922 -12.037 -4.884 -5.912 809 2HG GLU 922 2HG GLU 922 -11.267 -4.987 -7.496 810 HA LEU 923 HA LEU 923 -10.623 -3.628 -1.341 811 1HB LEU 923 1HB LEU 923 -8.351 -4.854 -1.148 812 2HB LEU 923 2HB LEU 923 -9.439 -5.314 -2.441 813 HG LEU 923 HG LEU 923 -7.890 -3.182 -3.461 814 1HD1 LEU 923 1HD1 LEU 923 -6.216 -5.304 -2.103 815 2HD1 LEU 923 2HD1 LEU 923 -5.620 -4.147 -3.292 816 3HD1 LEU 923 3HD1 LEU 923 -6.214 -3.582 -1.734 817 1HD2 LEU 923 1HD2 LEU 923 -8.474 -5.988 -3.889 818 2HD2 LEU 923 2HD2 LEU 923 -8.324 -4.659 -5.043 819 3HD2 LEU 923 3HD2 LEU 923 -6.884 -5.502 -4.480 820 HA ILE 924 HA ILE 924 -8.271 -1.441 1.648 821 HB ILE 924 HB ILE 924 -7.063 -4.107 1.739 822 1HG1 ILE 924 1HG1 ILE 924 -7.710 -3.623 4.187 823 2HG1 ILE 924 2HG1 ILE 924 -8.449 -2.167 3.528 824 1HG2 ILE 924 1HG2 ILE 924 -4.987 -2.755 1.984 825 2HG2 ILE 924 2HG2 ILE 924 -5.734 -1.935 3.352 826 3HG2 ILE 924 3HG2 ILE 924 -5.408 -3.663 3.428 827 1HD1 ILE 924 3HD1 ILE 924 -8.974 -4.971 2.533 828 2HD1 ILE 924 1HD1 ILE 924 -10.058 -4.045 3.568 829 3HD1 ILE 924 2HD1 ILE 924 -9.720 -3.495 1.926 830 HA ILE 925 HA ILE 925 -4.596 0.596 0.280 831 HB ILE 925 HB ILE 925 -4.297 2.452 1.915 832 1HG1 ILE 925 1HG1 ILE 925 -6.482 1.496 3.659 833 2HG1 ILE 925 2HG1 ILE 925 -4.994 0.563 3.794 834 1HG2 ILE 925 1HG2 ILE 925 -7.061 1.564 1.112 835 2HG2 ILE 925 2HG2 ILE 925 -6.840 3.047 2.040 836 3HG2 ILE 925 3HG2 ILE 925 -6.090 2.879 0.455 837 1HD1 ILE 925 1HD1 ILE 925 -4.782 3.545 3.771 838 2HD1 ILE 925 2HD1 ILE 925 -5.364 2.764 5.241 839 3HD1 ILE 925 3HD1 ILE 925 -3.774 2.357 4.597 840 HA THR 926 HA THR 926 -0.961 -0.529 2.759 841 HB THR 926 HB THR 926 -1.774 1.084 5.187 842 HG1 THR 926 HG1 THR 926 -1.832 2.576 3.660 843 1HG2 THR 926 1HG2 THR 926 0.842 0.062 4.087 844 2HG2 THR 926 2HG2 THR 926 0.775 1.367 5.267 845 3HG2 THR 926 3HG2 THR 926 0.140 -0.225 5.677 846 HA ASP 927 HA ASP 927 -3.908 -3.235 5.308 847 1HB ASP 927 1HB ASP 927 -1.925 -1.817 6.802 848 2HB ASP 927 2HB ASP 927 -3.193 -2.291 7.933 No H/Q in entry = 848
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