NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26520 | 2kle | 16191 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA ASP 724 HA ASP 724 12.714 -3.960 13.035 2 HB2 ASP 724 HB2 ASP 724 14.878 -3.573 14.265 3 HB3 ASP 724 HB3 ASP 724 13.981 -2.628 15.429 4 H ILE 725 HN ILE 725 12.195 -0.927 14.792 5 HA ILE 725 HA ILE 725 10.041 -1.809 16.372 6 HB ILE 725 HB ILE 725 10.808 1.004 15.535 7 HG12 ILE 725 HG12 ILE 725 11.422 -0.416 18.116 8 HG13 ILE 725 HG13 ILE 725 12.549 -0.375 16.767 9 HG21 ILE 725 HG21 ILE 725 9.032 -0.032 17.716 10 HG22 ILE 725 HG22 ILE 725 8.555 1.000 16.363 11 HG23 ILE 725 HG23 ILE 725 9.602 1.636 17.638 12 HD11 ILE 725 HD11 ILE 725 12.698 1.990 16.909 13 HD12 ILE 725 HD12 ILE 725 13.007 1.307 18.514 14 HD13 ILE 725 HD13 ILE 725 11.452 2.058 18.154 15 H SER 726 HN SER 726 10.126 -0.719 13.088 16 HA SER 726 HA SER 726 7.296 -0.182 13.178 17 HB2 SER 726 HB2 SER 726 9.286 0.265 10.932 18 HB3 SER 726 HB3 SER 726 7.566 0.627 10.852 19 HG SER 726 HG SER 726 7.739 2.028 12.482 20 H GLU 727 HN GLU 727 6.772 -0.896 10.372 21 HA GLU 727 HA GLU 727 5.419 -3.098 11.130 22 HB2 GLU 727 HB2 GLU 727 5.788 -1.922 8.385 23 HB3 GLU 727 HB3 GLU 727 4.487 -2.991 8.925 24 HG2 GLU 727 HG2 GLU 727 3.607 -1.343 10.390 25 HG3 GLU 727 HG3 GLU 727 5.006 -0.302 10.168 26 H SER 728 HN SER 728 5.227 -4.923 9.482 27 HA SER 728 HA SER 728 7.023 -6.682 10.510 28 HB2 SER 728 HB2 SER 728 5.935 -8.291 8.838 29 HB3 SER 728 HB3 SER 728 4.951 -7.472 10.049 30 HG SER 728 HG SER 728 4.146 -6.083 8.563 31 H LEU 729 HN LEU 729 7.063 -6.441 6.786 32 HA LEU 729 HA LEU 729 9.741 -6.090 6.420 33 HB2 LEU 729 HB2 LEU 729 10.096 -8.180 7.724 34 HB3 LEU 729 HB3 LEU 729 9.082 -9.050 6.594 35 HG LEU 729 HG LEU 729 10.709 -8.599 4.796 36 HD11 LEU 729 HD11 LEU 729 12.932 -7.738 5.342 37 HD12 LEU 729 HD12 LEU 729 12.397 -7.389 6.982 38 HD13 LEU 729 HD13 LEU 729 11.678 -6.531 5.617 39 HD21 LEU 729 HD21 LEU 729 10.846 -10.671 6.057 40 HD22 LEU 729 HD22 LEU 729 11.902 -9.894 7.238 41 HD23 LEU 729 HD23 LEU 729 12.452 -10.119 5.579 42 H ARG 730 HN ARG 730 7.669 -8.776 5.248 43 HA ARG 730 HA ARG 730 8.209 -8.054 2.555 44 HB2 ARG 730 HB2 ARG 730 5.860 -9.780 2.649 45 HB3 ARG 730 HB3 ARG 730 7.445 -10.089 2.009 46 HG2 ARG 730 HG2 ARG 730 8.240 -10.778 4.215 47 HG3 ARG 730 HG3 ARG 730 6.625 -10.451 4.863 48 HD2 ARG 730 HD2 ARG 730 5.684 -12.129 3.323 49 HD3 ARG 730 HD3 ARG 730 7.303 -12.476 2.723 50 HE ARG 730 HE ARG 730 7.472 -12.834 5.414 51 HH11 ARG 730 HH11 ARG 730 5.421 -14.255 2.894 52 HH12 ARG 730 HH12 ARG 730 5.272 -15.761 3.672 53 HH21 ARG 730 HH21 ARG 730 7.231 -14.912 6.478 54 HH22 ARG 730 HH22 ARG 730 6.315 -16.135 5.726 55 H GLN 731 HN GLN 731 5.472 -7.843 4.657 56 HA GLN 731 HA GLN 731 3.868 -6.215 2.882 57 HB2 GLN 731 HB2 GLN 731 2.694 -7.774 4.283 58 HB3 GLN 731 HB3 GLN 731 3.548 -7.206 5.707 59 HG2 GLN 731 HG2 GLN 731 1.227 -6.584 5.607 60 HG3 GLN 731 HG3 GLN 731 2.318 -5.211 5.786 61 HE21 GLN 731 HE21 GLN 731 1.566 -6.888 2.773 62 HE22 GLN 731 HE22 GLN 731 0.862 -5.503 2.003 63 H GLY 732 HN GLY 732 5.202 -5.874 6.137 64 HA2 GLY 732 HA3 GLY 732 4.770 -3.159 6.474 65 HA3 GLY 732 HA2 GLY 732 5.926 -4.130 7.351 66 H GLY 733 HN GLY 733 6.940 -4.471 4.307 67 HA2 GLY 733 HA3 GLY 733 8.327 -1.941 4.185 68 HA3 GLY 733 HA2 GLY 733 9.326 -3.381 4.334 69 H GLY 734 HN GLY 734 6.501 -2.399 2.410 70 HA2 GLY 734 HA3 GLY 734 7.944 -2.373 0.021 71 HA3 GLY 734 HA2 GLY 734 7.243 -3.969 0.230 72 H LYS 735 HN LYS 735 4.821 -3.790 0.977 73 HA LYS 735 HA LYS 735 3.456 -1.746 -0.509 74 HB2 LYS 735 HB2 LYS 735 2.481 -3.064 -2.133 75 HB3 LYS 735 HB3 LYS 735 4.154 -3.493 -2.273 76 HG2 LYS 735 HG2 LYS 735 1.897 -5.167 -1.133 77 HG3 LYS 735 HG3 LYS 735 2.820 -5.445 -2.571 78 HD2 LYS 735 HD2 LYS 735 4.035 -5.590 0.194 79 HD3 LYS 735 HD3 LYS 735 3.447 -6.981 -0.709 80 HE2 LYS 735 HE2 LYS 735 5.083 -6.398 -2.519 81 HE3 LYS 735 HE3 LYS 735 5.716 -5.135 -1.466 82 HZ1 LYS 735 HZ1 LYS 735 5.698 -8.047 -0.891 83 HZ2 LYS 735 HZ2 LYS 735 6.245 -6.887 0.180 84 HZ3 LYS 735 HZ3 LYS 735 7.060 -7.135 -1.268 85 H LEU 736 HN LEU 736 1.048 -2.032 -0.303 86 HA LEU 736 HA LEU 736 0.410 -3.658 2.115 87 HB2 LEU 736 HB2 LEU 736 -1.345 -1.347 1.576 88 HB3 LEU 736 HB3 LEU 736 -0.922 -2.129 3.010 89 HG LEU 736 HG LEU 736 1.201 -0.454 1.765 90 HD11 LEU 736 HD11 LEU 736 0.429 1.435 2.979 91 HD12 LEU 736 HD12 LEU 736 -0.873 0.512 3.733 92 HD13 LEU 736 HD13 LEU 736 -0.930 0.876 2.005 93 HD21 LEU 736 HD21 LEU 736 1.807 -0.271 4.149 94 HD22 LEU 736 HD22 LEU 736 1.846 -1.927 3.548 95 HD23 LEU 736 HD23 LEU 736 0.498 -1.376 4.543 96 H ASN 737 HN ASN 737 -1.281 -5.029 1.848 97 HA ASN 737 HA ASN 737 -3.190 -4.456 -0.275 98 HB2 ASN 737 HB2 ASN 737 -2.127 -7.300 0.045 99 HB3 ASN 737 HB3 ASN 737 -3.120 -6.750 -1.257 100 HD21 ASN 737 HD21 ASN 737 -1.186 -4.367 -1.619 101 HD22 ASN 737 HD22 ASN 737 0.130 -5.091 -2.432 102 H PHE 738 HN PHE 738 -5.349 -5.347 0.233 103 HA PHE 738 HA PHE 738 -6.030 -5.548 2.924 104 HB2 PHE 738 HB2 PHE 738 -7.671 -5.545 1.027 105 HB3 PHE 738 HB3 PHE 738 -7.032 -7.160 0.675 106 HD1 PHE 738 HD2 PHE 738 -8.349 -5.450 3.633 107 HD2 PHE 738 HD1 PHE 738 -8.389 -8.867 1.182 108 HE1 PHE 738 HE2 PHE 738 -9.987 -6.497 5.148 109 HE2 PHE 738 HE1 PHE 738 -10.040 -9.943 2.664 110 HZ PHE 738 HZ PHE 738 -10.829 -8.753 4.657 111 H ASP 739 HN ASP 739 -5.484 -8.341 0.811 112 HA ASP 739 HA ASP 739 -5.398 -10.244 2.918 113 HB2 ASP 739 HB2 ASP 739 -5.411 -10.309 0.086 114 HB3 ASP 739 HB3 ASP 739 -3.972 -11.138 0.604 115 H GLU 740 HN GLU 740 -2.946 -8.281 1.446 116 HA GLU 740 HA GLU 740 -0.822 -9.872 2.713 117 HB2 GLU 740 HB2 GLU 740 -0.788 -8.817 0.307 118 HB3 GLU 740 HB3 GLU 740 -0.366 -7.345 1.173 119 HG2 GLU 740 HG2 GLU 740 1.673 -8.216 0.507 120 HG3 GLU 740 HG3 GLU 740 1.535 -8.729 2.193 121 H LEU 741 HN LEU 741 -2.401 -6.740 3.002 122 HA LEU 741 HA LEU 741 -0.737 -5.443 4.765 123 HB2 LEU 741 HB2 LEU 741 -2.503 -4.289 3.880 124 HB3 LEU 741 HB3 LEU 741 -3.756 -5.350 4.501 125 HG LEU 741 HG LEU 741 -2.495 -4.422 6.762 126 HD11 LEU 741 HD11 LEU 741 -2.123 -2.053 6.537 127 HD12 LEU 741 HD12 LEU 741 -2.464 -2.138 4.817 128 HD13 LEU 741 HD13 LEU 741 -1.026 -2.914 5.458 129 HD21 LEU 741 HD21 LEU 741 -4.853 -4.496 6.434 130 HD22 LEU 741 HD22 LEU 741 -4.743 -3.256 5.225 131 HD23 LEU 741 HD23 LEU 741 -4.386 -2.863 6.905 132 H ARG 742 HN ARG 742 -2.999 -8.026 5.140 133 HA ARG 742 HA ARG 742 -3.318 -8.139 7.936 134 HB2 ARG 742 HB2 ARG 742 -3.021 -10.752 6.515 135 HB3 ARG 742 HB3 ARG 742 -4.127 -10.219 7.730 136 HG2 ARG 742 HG2 ARG 742 -4.294 -9.178 5.027 137 HG3 ARG 742 HG3 ARG 742 -5.051 -10.726 5.446 138 HD2 ARG 742 HD2 ARG 742 -5.807 -8.715 7.408 139 HD3 ARG 742 HD3 ARG 742 -6.018 -8.073 5.807 140 HE ARG 742 HE ARG 742 -7.363 -9.962 5.214 141 HH11 ARG 742 HH11 ARG 742 -6.918 -9.548 8.683 142 HH12 ARG 742 HH12 ARG 742 -8.386 -10.319 9.107 143 HH21 ARG 742 HH21 ARG 742 -9.360 -11.088 5.816 144 HH22 ARG 742 HH22 ARG 742 -9.803 -11.189 7.443 145 H GLN 743 HN GLN 743 -0.748 -9.215 5.872 146 HA GLN 743 HA GLN 743 0.672 -10.752 7.668 147 HB2 GLN 743 HB2 GLN 743 1.184 -9.574 5.239 148 HB3 GLN 743 HB3 GLN 743 2.390 -8.895 6.304 149 HG2 GLN 743 HG2 GLN 743 3.618 -10.785 6.360 150 HG3 GLN 743 HG3 GLN 743 2.187 -11.796 6.577 151 HE21 GLN 743 HE21 GLN 743 0.844 -10.870 4.299 152 HE22 GLN 743 HE22 GLN 743 1.590 -11.463 2.901 153 H ASP 744 HN ASP 744 0.260 -7.421 7.432 154 HA ASP 744 HA ASP 744 2.133 -6.794 9.447 155 HB2 ASP 744 HB2 ASP 744 0.922 -5.299 7.558 156 HB3 ASP 744 HB3 ASP 744 0.108 -4.803 8.999 157 H LEU 745 HN LEU 745 -1.381 -6.752 9.153 158 HA LEU 745 HA LEU 745 -1.712 -6.798 12.044 159 HB2 LEU 745 HB2 LEU 745 -4.026 -5.839 11.343 160 HB3 LEU 745 HB3 LEU 745 -2.643 -4.778 11.593 161 HG LEU 745 HG LEU 745 -2.359 -5.170 8.999 162 HD11 LEU 745 HD11 LEU 745 -4.240 -6.844 9.028 163 HD12 LEU 745 HD12 LEU 745 -4.253 -5.645 7.776 164 HD13 LEU 745 HD13 LEU 745 -5.358 -5.473 9.114 165 HD21 LEU 745 HD21 LEU 745 -3.730 -3.142 8.636 166 HD22 LEU 745 HD22 LEU 745 -2.653 -3.025 10.007 167 HD23 LEU 745 HD23 LEU 745 -4.360 -3.261 10.281 168 H LYS 746 HN LYS 746 -1.298 -9.157 10.809 169 HA LYS 746 HA LYS 746 -3.472 -10.566 10.071 170 HB2 LYS 746 HB2 LYS 746 -0.956 -11.547 11.360 171 HB3 LYS 746 HB3 LYS 746 -2.229 -12.712 10.991 172 HG2 LYS 746 HG2 LYS 746 -1.854 -11.473 8.557 173 HG3 LYS 746 HG3 LYS 746 -0.323 -11.252 9.318 174 HD2 LYS 746 HD2 LYS 746 0.084 -13.539 9.663 175 HD3 LYS 746 HD3 LYS 746 -1.551 -13.983 9.173 176 HE2 LYS 746 HE2 LYS 746 -1.109 -13.135 6.926 177 HE3 LYS 746 HE3 LYS 746 0.526 -12.688 7.408 178 HZ1 LYS 746 HZ1 LYS 746 0.534 -14.734 6.219 179 HZ2 LYS 746 HZ2 LYS 746 -0.588 -15.427 7.252 180 HZ3 LYS 746 HZ3 LYS 746 0.963 -15.042 7.820 181 H GLY 747 HN GLY 747 -5.334 -10.590 11.152 182 HA2 GLY 747 HA3 GLY 747 -6.639 -11.977 12.618 183 HA3 GLY 747 HA2 GLY 747 -5.301 -11.925 13.753 184 H LYS 748 HN LYS 748 -8.038 -10.210 12.515 185 HA LYS 748 HA LYS 748 -8.116 -8.817 14.944 186 HB2 LYS 748 HB2 LYS 748 -7.801 -6.583 14.396 187 HB3 LYS 748 HB3 LYS 748 -6.543 -7.432 13.517 188 HG2 LYS 748 HG2 LYS 748 -9.144 -6.666 12.217 189 HG3 LYS 748 HG3 LYS 748 -7.657 -5.636 12.269 190 HD2 LYS 748 HD2 LYS 748 -6.703 -6.974 10.778 191 HD3 LYS 748 HD3 LYS 748 -7.701 -8.391 11.146 192 HE2 LYS 748 HE2 LYS 748 -8.476 -7.349 9.154 193 HE3 LYS 748 HE3 LYS 748 -9.563 -7.032 10.435 194 HZ1 LYS 748 HZ1 LYS 748 -7.502 -4.971 9.731 195 HZ2 LYS 748 HZ2 LYS 748 -8.711 -4.861 10.857 196 HZ3 LYS 748 HZ3 LYS 748 -9.111 -4.913 9.271 197 H GLY 749 HN GLY 749 -9.540 -9.296 11.842 198 HA2 GLY 749 HA3 GLY 749 -12.015 -8.184 12.873 199 HA3 GLY 749 HA2 GLY 749 -11.587 -8.289 11.173 200 H HIS 750 HN HIS 750 -13.871 -9.382 11.522 201 HA HIS 750 HA HIS 750 -13.583 -12.154 12.396 202 HB2 HIS 750 HB2 HIS 750 -16.075 -10.647 11.559 203 HB3 HIS 750 HB3 HIS 750 -16.054 -12.327 12.078 204 HD2 HIS 750 HD2 HIS 750 -15.026 -12.468 14.887 205 HE1 HIS 750 HE1 HIS 750 -16.785 -8.722 15.746 206 HE2 HIS 750 HE2 HIS 750 -15.844 -10.838 16.703 207 H THR 751 HN THR 751 -15.437 -10.888 9.646 208 HA THR 751 HA THR 751 -14.301 -13.071 7.977 209 HB THR 751 HB THR 751 -16.590 -11.503 6.988 210 HG1 THR 751 HG1 THR 751 -17.250 -11.475 9.114 211 HG21 THR 751 HG21 THR 751 -16.160 -14.459 7.472 212 HG22 THR 751 HG22 THR 751 -15.943 -13.637 5.924 213 HG23 THR 751 HG23 THR 751 -17.538 -13.771 6.638 214 H ASP 752 HN ASP 752 -13.468 -12.529 5.935 215 HA ASP 752 HA ASP 752 -11.946 -10.177 5.722 216 HB2 ASP 752 HB2 ASP 752 -12.858 -12.058 3.509 217 HB3 ASP 752 HB3 ASP 752 -11.746 -10.750 3.266 218 H ALA 753 HN ALA 753 -15.167 -10.876 4.583 219 HA ALA 753 HA ALA 753 -15.525 -8.640 2.960 220 HB1 ALA 753 HB1 ALA 753 -17.757 -9.921 4.533 221 HB2 ALA 753 HB2 ALA 753 -17.079 -10.586 3.063 222 HB3 ALA 753 HB3 ALA 753 -17.877 -9.016 3.033 223 H GLU 754 HN GLU 754 -16.081 -8.953 6.351 224 HA GLU 754 HA GLU 754 -17.189 -6.422 6.846 225 HB2 GLU 754 HB2 GLU 754 -15.755 -8.498 8.360 226 HB3 GLU 754 HB3 GLU 754 -16.010 -6.977 9.180 227 HG2 GLU 754 HG2 GLU 754 -18.427 -7.363 8.911 228 HG3 GLU 754 HG3 GLU 754 -18.093 -8.834 7.997 229 H ILE 755 HN ILE 755 -13.935 -7.575 6.891 230 HA ILE 755 HA ILE 755 -12.721 -5.112 7.821 231 HB ILE 755 HB ILE 755 -11.401 -7.498 6.500 232 HG12 ILE 755 HG12 ILE 755 -11.950 -6.999 9.414 233 HG13 ILE 755 HG13 ILE 755 -12.946 -8.048 8.414 234 HG21 ILE 755 HG21 ILE 755 -9.472 -6.761 7.308 235 HG22 ILE 755 HG22 ILE 755 -10.226 -5.953 8.611 236 HG23 ILE 755 HG23 ILE 755 -10.126 -5.136 7.083 237 HD11 ILE 755 HD11 ILE 755 -10.029 -8.355 8.799 238 HD12 ILE 755 HD12 ILE 755 -11.121 -9.448 7.994 239 HD13 ILE 755 HD13 ILE 755 -11.220 -9.287 9.717 240 H GLU 756 HN GLU 756 -13.120 -6.741 4.783 241 HA GLU 756 HA GLU 756 -11.504 -5.115 3.291 242 HB2 GLU 756 HB2 GLU 756 -12.397 -7.350 2.585 243 HB3 GLU 756 HB3 GLU 756 -13.942 -6.555 2.285 244 HG2 GLU 756 HG2 GLU 756 -12.776 -5.148 0.542 245 HG3 GLU 756 HG3 GLU 756 -11.344 -6.105 0.854 246 H ALA 757 HN ALA 757 -14.957 -4.972 3.835 247 HA ALA 757 HA ALA 757 -15.510 -2.623 2.340 248 HB1 ALA 757 HB1 ALA 757 -16.958 -4.103 4.500 249 HB2 ALA 757 HB2 ALA 757 -17.407 -3.851 2.783 250 HB3 ALA 757 HB3 ALA 757 -17.522 -2.540 3.929 251 H ILE 758 HN ILE 758 -14.938 -3.157 5.805 252 HA ILE 758 HA ILE 758 -15.574 -0.638 6.689 253 HB ILE 758 HB ILE 758 -15.278 -2.623 8.157 254 HG12 ILE 758 HG12 ILE 758 -15.334 -0.205 8.980 255 HG13 ILE 758 HG13 ILE 758 -14.795 -1.442 10.116 256 HG21 ILE 758 HG21 ILE 758 -13.035 -3.370 7.333 257 HG22 ILE 758 HG22 ILE 758 -13.079 -3.200 9.090 258 HG23 ILE 758 HG23 ILE 758 -12.333 -1.954 8.104 259 HD11 ILE 758 HD11 ILE 758 -13.443 0.531 10.337 260 HD12 ILE 758 HD12 ILE 758 -13.049 0.477 8.607 261 HD13 ILE 758 HD13 ILE 758 -12.482 -0.790 9.679 262 H PHE 759 HN PHE 759 -12.439 -1.915 5.642 263 HA PHE 759 HA PHE 759 -10.976 0.354 6.340 264 HB2 PHE 759 HB2 PHE 759 -9.081 -0.773 5.440 265 HB3 PHE 759 HB3 PHE 759 -10.191 -2.066 5.765 266 HD1 PHE 759 HD2 PHE 759 -9.399 0.169 2.817 267 HD2 PHE 759 HD1 PHE 759 -10.350 -3.722 4.221 268 HE1 PHE 759 HE2 PHE 759 -9.229 -0.687 0.536 269 HE2 PHE 759 HE1 PHE 759 -10.138 -4.582 1.910 270 HZ PHE 759 HZ PHE 759 -9.588 -3.071 0.086 271 H THR 760 HN THR 760 -12.872 -0.392 3.594 272 HA THR 760 HA THR 760 -11.630 1.264 1.685 273 HB THR 760 HB THR 760 -14.556 0.432 1.868 274 HG1 THR 760 HG1 THR 760 -13.103 -1.426 1.732 275 HG21 THR 760 HG21 THR 760 -14.115 2.307 0.302 276 HG22 THR 760 HG22 THR 760 -14.689 0.844 -0.474 277 HG23 THR 760 HG23 THR 760 -12.973 1.267 -0.568 278 H LYS 761 HN LYS 761 -14.006 1.776 4.118 279 HA LYS 761 HA LYS 761 -14.269 4.594 3.375 280 HB2 LYS 761 HB2 LYS 761 -16.234 3.051 4.072 281 HB3 LYS 761 HB3 LYS 761 -15.644 3.284 5.685 282 HG2 LYS 761 HG2 LYS 761 -16.147 5.785 5.539 283 HG3 LYS 761 HG3 LYS 761 -16.544 5.502 3.866 284 HD2 LYS 761 HD2 LYS 761 -18.503 5.685 5.325 285 HD3 LYS 761 HD3 LYS 761 -18.417 4.154 4.456 286 HE2 LYS 761 HE2 LYS 761 -17.518 3.067 6.454 287 HE3 LYS 761 HE3 LYS 761 -17.585 4.601 7.322 288 HZ1 LYS 761 HZ1 LYS 761 -19.440 3.157 7.827 289 HZ2 LYS 761 HZ2 LYS 761 -19.944 3.162 6.217 290 HZ3 LYS 761 HZ3 LYS 761 -19.948 4.590 7.127 291 H TYR 762 HN TYR 762 -13.153 2.656 6.207 292 HA TYR 762 HA TYR 762 -12.390 5.138 7.525 293 HB2 TYR 762 HB2 TYR 762 -12.939 2.409 8.458 294 HB3 TYR 762 HB3 TYR 762 -11.822 3.384 9.398 295 HD1 TYR 762 HD1 TYR 762 -15.347 3.105 8.238 296 HD2 TYR 762 HD2 TYR 762 -12.589 5.203 10.699 297 HE1 TYR 762 HE1 TYR 762 -17.228 4.114 9.516 298 HE2 TYR 762 HE2 TYR 762 -14.448 6.212 11.931 299 HH TYR 762 HH TYR 762 -16.844 6.710 11.531 300 H ASP 763 HN ASP 763 -10.747 2.567 5.832 301 HA ASP 763 HA ASP 763 -8.291 2.688 7.180 302 HB2 ASP 763 HB2 ASP 763 -9.005 0.993 5.375 303 HB3 ASP 763 HB3 ASP 763 -8.596 2.194 4.231 304 H GLN 764 HN GLN 764 -6.361 3.681 6.512 305 HA GLN 764 HA GLN 764 -6.468 6.385 6.096 306 HB2 GLN 764 HB2 GLN 764 -4.214 4.461 5.593 307 HB3 GLN 764 HB3 GLN 764 -4.035 6.200 5.508 308 HG2 GLN 764 HG2 GLN 764 -3.196 5.421 7.511 309 HG3 GLN 764 HG3 GLN 764 -4.661 6.343 7.896 310 HE21 GLN 764 HE21 GLN 764 -4.320 2.948 6.814 311 HE22 GLN 764 HE22 GLN 764 -5.019 2.269 8.225 312 H ASP 765 HN ASP 765 -5.763 3.818 3.687 313 HA ASP 765 HA ASP 765 -5.968 5.933 1.652 314 HB2 ASP 765 HB2 ASP 765 -4.638 3.296 1.726 315 HB3 ASP 765 HB3 ASP 765 -4.822 4.181 0.186 316 H GLY 766 HN GLY 766 -7.719 3.336 2.923 317 HA2 GLY 766 HA3 GLY 766 -9.703 2.274 2.180 318 HA3 GLY 766 HA2 GLY 766 -9.888 3.670 1.139 319 H ASP 767 HN ASP 767 -7.010 2.003 0.654 320 HA ASP 767 HA ASP 767 -8.098 0.885 -1.814 321 HB2 ASP 767 HB2 ASP 767 -5.488 2.124 -1.148 322 HB3 ASP 767 HB3 ASP 767 -5.479 0.808 -2.324 323 H GLN 768 HN GLN 768 -5.382 0.216 0.353 324 HA GLN 768 HA GLN 768 -4.439 -1.801 1.135 325 HB2 GLN 768 HB2 GLN 768 -6.799 -1.103 2.277 326 HB3 GLN 768 HB3 GLN 768 -7.169 -2.740 1.857 327 HG2 GLN 768 HG2 GLN 768 -5.283 -3.518 3.061 328 HG3 GLN 768 HG3 GLN 768 -4.866 -1.851 3.480 329 HE21 GLN 768 HE21 GLN 768 -7.092 -4.446 4.046 330 HE22 GLN 768 HE22 GLN 768 -7.901 -3.680 5.372 331 H GLU 769 HN GLU 769 -3.749 -2.658 -0.812 332 HA GLU 769 HA GLU 769 -4.027 -5.138 -1.522 333 HB2 GLU 769 HB2 GLU 769 -5.620 -5.582 -3.281 334 HB3 GLU 769 HB3 GLU 769 -6.487 -4.870 -1.940 335 HG2 GLU 769 HG2 GLU 769 -6.889 -2.839 -3.194 336 HG3 GLU 769 HG3 GLU 769 -5.646 -3.301 -4.337 337 H LEU 770 HN LEU 770 -2.372 -2.602 -1.936 338 HA LEU 770 HA LEU 770 -2.070 -2.759 -4.818 339 HB2 LEU 770 HB2 LEU 770 -1.926 -0.365 -2.995 340 HB3 LEU 770 HB3 LEU 770 -0.904 -0.377 -4.382 341 HG LEU 770 HG LEU 770 -3.021 -0.533 -5.768 342 HD11 LEU 770 HD11 LEU 770 -4.251 -0.412 -3.060 343 HD12 LEU 770 HD12 LEU 770 -4.719 -1.462 -4.413 344 HD13 LEU 770 HD13 LEU 770 -5.074 0.252 -4.448 345 HD21 LEU 770 HD21 LEU 770 -3.678 1.788 -5.401 346 HD22 LEU 770 HD22 LEU 770 -1.927 1.597 -5.375 347 HD23 LEU 770 HD23 LEU 770 -2.815 1.789 -3.863 348 H THR 771 HN THR 771 -0.000 -3.395 -5.593 349 HA THR 771 HA THR 771 1.915 -3.964 -3.559 350 HB THR 771 HB THR 771 2.957 -5.374 -5.068 351 HG1 THR 771 HG1 THR 771 2.965 -5.123 -7.110 352 HG21 THR 771 HG21 THR 771 0.084 -5.192 -5.831 353 HG22 THR 771 HG22 THR 771 0.889 -6.297 -4.707 354 HG23 THR 771 HG23 THR 771 1.149 -6.466 -6.442 355 H GLU 772 HN GLU 772 4.329 -3.503 -4.151 356 HA GLU 772 HA GLU 772 4.785 -0.771 -4.202 357 HB2 GLU 772 HB2 GLU 772 6.212 -2.676 -3.274 358 HB3 GLU 772 HB3 GLU 772 6.785 -2.950 -4.896 359 HG2 GLU 772 HG2 GLU 772 7.041 -0.329 -3.528 360 HG3 GLU 772 HG3 GLU 772 8.273 -1.585 -3.379 361 H HIS 773 HN HIS 773 4.625 -3.225 -6.685 362 HA HIS 773 HA HIS 773 5.794 -1.620 -8.742 363 HB2 HIS 773 HB2 HIS 773 3.927 -3.985 -9.172 364 HB3 HIS 773 HB3 HIS 773 4.955 -3.243 -10.348 365 HD2 HIS 773 HD2 HIS 773 7.716 -3.513 -9.885 366 HE1 HIS 773 HE1 HIS 773 7.262 -6.937 -7.434 367 HE2 HIS 773 HE2 HIS 773 8.882 -5.350 -8.457 368 H GLU 774 HN GLU 774 2.536 -2.089 -7.618 369 HA GLU 774 HA GLU 774 1.417 -0.519 -9.774 370 HB2 GLU 774 HB2 GLU 774 0.003 -1.170 -7.154 371 HB3 GLU 774 HB3 GLU 774 -0.644 -0.703 -8.733 372 HG2 GLU 774 HG2 GLU 774 -0.057 -2.689 -9.765 373 HG3 GLU 774 HG3 GLU 774 0.949 -3.203 -8.429 374 H HIS 775 HN HIS 775 2.273 0.043 -6.454 375 HA HIS 775 HA HIS 775 1.380 2.684 -6.139 376 HB2 HIS 775 HB2 HIS 775 1.984 1.235 -4.268 377 HB3 HIS 775 HB3 HIS 775 3.632 1.139 -4.857 378 HD2 HIS 775 HD2 HIS 775 4.851 2.279 -2.786 379 HE1 HIS 775 HE1 HIS 775 2.753 5.968 -2.776 380 HE2 HIS 775 HE2 HIS 775 4.892 4.785 -2.164 381 H GLN 776 HN GLN 776 4.310 1.285 -7.446 382 HA GLN 776 HA GLN 776 5.859 3.522 -7.719 383 HB2 GLN 776 HB2 GLN 776 6.739 1.279 -8.097 384 HB3 GLN 776 HB3 GLN 776 5.750 1.142 -9.547 385 HG2 GLN 776 HG2 GLN 776 6.995 2.951 -10.595 386 HG3 GLN 776 HG3 GLN 776 7.985 3.121 -9.148 387 HE21 GLN 776 HE21 GLN 776 9.577 1.590 -8.732 388 HE22 GLN 776 HE22 GLN 776 10.087 0.467 -9.943 389 H GLN 777 HN GLN 777 3.328 2.340 -9.758 390 HA GLN 777 HA GLN 777 3.880 4.256 -11.875 391 HB2 GLN 777 HB2 GLN 777 1.427 2.528 -11.637 392 HB3 GLN 777 HB3 GLN 777 2.178 3.180 -13.078 393 HG2 GLN 777 HG2 GLN 777 3.758 1.579 -13.209 394 HG3 GLN 777 HG3 GLN 777 3.751 1.258 -11.474 395 HE21 GLN 777 HE21 GLN 777 0.859 1.005 -11.280 396 HE22 GLN 777 HE22 GLN 777 0.430 -0.489 -11.990 397 H MET 778 HN MET 778 1.441 3.767 -9.368 398 HA MET 778 HA MET 778 -0.300 5.718 -10.611 399 HB2 MET 778 HB2 MET 778 -0.755 3.863 -8.328 400 HB3 MET 778 HB3 MET 778 -1.974 5.063 -8.825 401 HG2 MET 778 HG2 MET 778 -2.214 4.139 -10.919 402 HG3 MET 778 HG3 MET 778 -0.875 3.031 -10.786 403 HE1 MET 778 HE1 MET 778 -4.549 3.893 -9.876 404 HE2 MET 778 HE2 MET 778 -3.827 3.957 -8.266 405 HE3 MET 778 HE3 MET 778 -4.971 2.678 -8.670 406 H ARG 779 HN ARG 779 0.308 5.843 -7.038 407 HA ARG 779 HA ARG 779 -0.287 8.599 -7.487 408 HB2 ARG 779 HB2 ARG 779 -0.016 7.046 -4.963 409 HB3 ARG 779 HB3 ARG 779 -0.246 8.786 -4.995 410 HG2 ARG 779 HG2 ARG 779 -2.273 8.360 -6.370 411 HG3 ARG 779 HG3 ARG 779 -2.043 6.652 -5.983 412 HD2 ARG 779 HD2 ARG 779 -2.630 8.951 -4.130 413 HD3 ARG 779 HD3 ARG 779 -3.601 7.510 -4.405 414 HE ARG 779 HE ARG 779 -0.934 7.296 -3.224 415 HH11 ARG 779 HH11 ARG 779 -4.369 6.557 -2.928 416 HH12 ARG 779 HH12 ARG 779 -4.273 6.055 -1.300 417 HH21 ARG 779 HH21 ARG 779 -0.785 6.610 -0.962 418 HH22 ARG 779 HH22 ARG 779 -2.216 6.134 -0.164 419 H ASP 780 HN ASP 780 0.723 10.098 -6.301 420 HA ASP 780 HA ASP 780 3.656 9.850 -6.477 421 HB2 ASP 780 HB2 ASP 780 2.057 12.276 -7.341 422 HB3 ASP 780 HB3 ASP 780 3.792 12.107 -7.441 423 H ASP 781 HN ASP 781 3.530 9.561 -4.150 424 HA ASP 781 HA ASP 781 2.434 11.699 -2.477 425 HB2 ASP 781 HB2 ASP 781 2.663 9.176 -1.798 426 HB3 ASP 781 HB3 ASP 781 4.334 9.589 -1.461 427 H LEU 782 HN LEU 782 5.604 10.495 -3.178 428 HA LEU 782 HA LEU 782 6.953 12.505 -1.542 429 HB2 LEU 782 HB2 LEU 782 7.772 10.137 -2.119 430 HB3 LEU 782 HB3 LEU 782 8.215 10.800 -3.672 431 HG LEU 782 HG LEU 782 9.689 12.446 -2.469 432 HD11 LEU 782 HD11 LEU 782 10.385 11.907 -0.225 433 HD12 LEU 782 HD12 LEU 782 9.139 10.668 -0.123 434 HD13 LEU 782 HD13 LEU 782 8.687 12.363 -0.286 435 HD21 LEU 782 HD21 LEU 782 10.174 9.504 -2.268 436 HD22 LEU 782 HD22 LEU 782 11.414 10.747 -2.039 437 HD23 LEU 782 HD23 LEU 782 10.624 10.570 -3.600 438 H GLU 783 HN GLU 783 5.875 12.262 -4.777 439 HA GLU 783 HA GLU 783 7.455 14.066 -6.148 440 HB2 GLU 783 HB2 GLU 783 5.440 12.812 -7.019 441 HB3 GLU 783 HB3 GLU 783 4.477 14.118 -6.400 442 HG2 GLU 783 HG2 GLU 783 5.580 15.765 -7.754 443 HG3 GLU 783 HG3 GLU 783 6.734 14.576 -8.340 444 H LYS 784 HN LYS 784 4.947 14.454 -3.682 445 HA LYS 784 HA LYS 784 5.225 17.266 -3.769 446 HB2 LYS 784 HB2 LYS 784 2.910 15.710 -4.420 447 HB3 LYS 784 HB3 LYS 784 2.550 17.019 -3.253 448 HG2 LYS 784 HG2 LYS 784 3.727 18.484 -4.952 449 HG3 LYS 784 HG3 LYS 784 3.650 17.091 -6.039 450 HD2 LYS 784 HD2 LYS 784 1.270 17.022 -5.878 451 HD3 LYS 784 HD3 LYS 784 1.290 18.281 -4.635 452 HE2 LYS 784 HE2 LYS 784 2.389 19.736 -6.212 453 HE3 LYS 784 HE3 LYS 784 2.146 18.548 -7.491 454 HZ1 LYS 784 HZ1 LYS 784 -0.277 18.683 -7.097 455 HZ2 LYS 784 HZ2 LYS 784 0.362 20.149 -7.582 456 HZ3 LYS 784 HZ3 LYS 784 -0.023 19.914 -5.962 457 H GLU 785 HN GLU 785 6.454 16.284 -1.837 458 HA GLU 785 HA GLU 785 5.261 16.761 0.715 459 HB2 GLU 785 HB2 GLU 785 4.286 14.446 0.012 460 HB3 GLU 785 HB3 GLU 785 5.903 13.817 0.297 461 HG2 GLU 785 HG2 GLU 785 4.201 15.214 2.353 462 HG3 GLU 785 HG3 GLU 785 4.136 13.475 2.094 463 H ARG 786 HN ARG 786 6.803 16.957 2.220 464 HA ARG 786 HA ARG 786 9.533 16.188 1.438 465 HB2 ARG 786 HB2 ARG 786 9.252 18.592 1.220 466 HB3 ARG 786 HB3 ARG 786 8.834 18.676 2.939 467 HG2 ARG 786 HG2 ARG 786 11.016 17.834 3.539 468 HG3 ARG 786 HG3 ARG 786 11.449 17.676 1.841 469 HD2 ARG 786 HD2 ARG 786 11.132 20.087 1.576 470 HD3 ARG 786 HD3 ARG 786 10.788 20.197 3.309 471 HE ARG 786 HE ARG 786 13.187 18.960 3.195 472 HH11 ARG 786 HH11 ARG 786 11.986 22.025 1.883 473 HH12 ARG 786 HH12 ARG 786 13.487 22.821 1.990 474 HH21 ARG 786 HH21 ARG 786 15.261 20.079 3.322 475 HH22 ARG 786 HH22 ARG 786 15.363 21.703 2.818 476 H GLU 787 HN GLU 787 10.336 14.767 2.755 477 HA GLU 787 HA GLU 787 9.286 14.344 5.410 478 HB2 GLU 787 HB2 GLU 787 11.603 13.077 3.981 479 HB3 GLU 787 HB3 GLU 787 11.043 12.589 5.576 480 HG2 GLU 787 HG2 GLU 787 8.817 12.103 4.466 481 HG3 GLU 787 HG3 GLU 787 9.659 12.314 2.932 482 H ASP 788 HN ASP 788 10.479 14.393 7.303 483 HA ASP 788 HA ASP 788 12.356 16.580 7.459 484 HB2 ASP 788 HB2 ASP 788 10.528 16.332 9.051 485 HB3 ASP 788 HB3 ASP 788 11.183 14.806 9.659 486 H LEU 789 HN LEU 789 14.431 16.030 8.948 487 HA LEU 789 HA LEU 789 15.670 13.695 7.734 488 HB2 LEU 789 HB2 LEU 789 16.446 16.190 8.012 489 HB3 LEU 789 HB3 LEU 789 17.045 15.583 9.535 490 HG LEU 789 HG LEU 789 18.390 13.829 8.271 491 HD11 LEU 789 HD11 LEU 789 17.501 15.402 5.882 492 HD12 LEU 789 HD12 LEU 789 17.053 13.734 6.251 493 HD13 LEU 789 HD13 LEU 789 18.731 14.142 5.908 494 HD21 LEU 789 HD21 LEU 789 19.403 15.900 9.042 495 HD22 LEU 789 HD22 LEU 789 18.815 16.675 7.567 496 HD23 LEU 789 HD23 LEU 789 20.031 15.379 7.463 497 H ASP 790 HN ASP 790 14.783 12.150 8.795 498 HA ASP 790 HA ASP 790 14.962 12.015 11.743 499 HB2 ASP 790 HB2 ASP 790 12.749 11.581 10.405 500 HB3 ASP 790 HB3 ASP 790 13.422 9.982 10.119 501 H LEU 791 HN LEU 791 15.137 9.454 12.367 502 HA LEU 791 HA LEU 791 17.593 8.608 11.035 503 HB2 LEU 791 HB2 LEU 791 17.795 9.410 13.421 504 HB3 LEU 791 HB3 LEU 791 16.871 8.027 13.917 505 HG LEU 791 HG LEU 791 19.654 8.080 12.749 506 HD11 LEU 791 HD11 LEU 791 19.588 8.906 14.975 507 HD12 LEU 791 HD12 LEU 791 20.295 7.285 14.973 508 HD13 LEU 791 HD13 LEU 791 18.634 7.518 15.506 509 HD21 LEU 791 HD21 LEU 791 17.978 5.693 13.577 510 HD22 LEU 791 HD22 LEU 791 19.727 5.675 13.576 511 HD23 LEU 791 HD23 LEU 791 18.886 5.922 12.061 512 H ASP 792 HN ASP 792 14.790 7.371 12.709 513 HA ASP 792 HA ASP 792 14.520 5.077 10.877 514 HB2 ASP 792 HB2 ASP 792 16.271 4.302 12.300 515 HB3 ASP 792 HB3 ASP 792 15.312 4.526 13.738 516 H HIS 793 HN HIS 793 13.584 5.110 14.222 517 HA HIS 793 HA HIS 793 10.767 5.861 13.682 518 HB2 HIS 793 HB2 HIS 793 11.103 3.349 13.982 519 HB3 HIS 793 HB3 HIS 793 11.737 3.690 15.591 520 HD2 HIS 793 HD2 HIS 793 8.383 3.362 13.732 521 HE1 HIS 793 HE1 HIS 793 7.540 4.352 17.750 522 HE2 HIS 793 HE2 HIS 793 6.683 3.302 15.671 523 H SER 794 HN SER 794 10.002 7.015 15.558 524 HA SER 794 HA SER 794 11.706 7.613 17.820 525 HB2 SER 794 HB2 SER 794 11.883 9.977 17.090 526 HB3 SER 794 HB3 SER 794 12.997 8.839 16.271 527 HG SER 794 HG SER 794 12.075 9.490 14.423 528 H SER 795 HN SER 795 9.066 6.819 17.401 529 HA SER 795 HA SER 795 7.464 9.146 17.871 530 HB2 SER 795 HB2 SER 795 6.702 6.246 18.247 531 HB3 SER 795 HB3 SER 795 5.632 7.655 18.294 532 HG SER 795 HG SER 795 5.618 7.762 16.271 533 H LEU 796 HN LEU 796 7.757 10.225 19.667 534 HA LEU 796 HA LEU 796 7.865 8.762 22.180 535 HB2 LEU 796 HB2 LEU 796 9.270 11.249 21.319 536 HB3 LEU 796 HB3 LEU 796 8.957 10.998 23.024 537 HG LEU 796 HG LEU 796 10.313 8.848 22.807 538 HD11 LEU 796 HD11 LEU 796 11.117 10.056 20.181 539 HD12 LEU 796 HD12 LEU 796 10.198 8.571 20.407 540 HD13 LEU 796 HD13 LEU 796 11.869 8.665 20.963 541 HD21 LEU 796 HD21 LEU 796 11.700 11.446 22.237 542 HD22 LEU 796 HD22 LEU 796 12.451 10.006 22.919 543 HD23 LEU 796 HD23 LEU 796 11.203 10.864 23.824 Start of MODEL 2 1 HA ASP 724 HA ASP 724 8.122 4.620 11.307 2 HB2 ASP 724 HB2 ASP 724 8.668 6.603 9.088 3 HB3 ASP 724 HB3 ASP 724 7.225 6.601 10.090 4 H ILE 725 HN ILE 725 8.845 4.627 7.809 5 HA ILE 725 HA ILE 725 6.278 3.774 7.003 6 HB ILE 725 HB ILE 725 8.902 3.664 5.484 7 HG12 ILE 725 HG12 ILE 725 6.749 5.796 5.500 8 HG13 ILE 725 HG13 ILE 725 8.309 5.931 6.296 9 HG21 ILE 725 HG21 ILE 725 6.048 3.514 4.526 10 HG22 ILE 725 HG22 ILE 725 7.272 2.247 4.383 11 HG23 ILE 725 HG23 ILE 725 7.436 3.741 3.467 12 HD11 ILE 725 HD11 ILE 725 7.853 5.662 3.332 13 HD12 ILE 725 HD12 ILE 725 9.424 5.809 4.127 14 HD13 ILE 725 HD13 ILE 725 8.276 7.146 4.188 15 H SER 726 HN SER 726 9.267 1.980 7.707 16 HA SER 726 HA SER 726 8.134 -0.445 6.596 17 HB2 SER 726 HB2 SER 726 10.496 0.242 6.073 18 HB3 SER 726 HB3 SER 726 10.883 0.050 7.781 19 HG SER 726 HG SER 726 10.695 -2.073 7.610 20 H GLU 727 HN GLU 727 7.252 -1.886 7.739 21 HA GLU 727 HA GLU 727 7.755 -1.920 10.591 22 HB2 GLU 727 HB2 GLU 727 5.140 -1.735 9.236 23 HB3 GLU 727 HB3 GLU 727 5.203 -2.776 10.697 24 HG2 GLU 727 HG2 GLU 727 6.004 -0.805 11.880 25 HG3 GLU 727 HG3 GLU 727 5.988 0.109 10.372 26 H SER 728 HN SER 728 5.692 -4.418 9.017 27 HA SER 728 HA SER 728 6.943 -6.410 10.472 28 HB2 SER 728 HB2 SER 728 5.331 -6.669 7.942 29 HB3 SER 728 HB3 SER 728 5.643 -7.962 9.109 30 HG SER 728 HG SER 728 3.986 -5.705 9.311 31 H LEU 729 HN LEU 729 7.170 -6.380 6.848 32 HA LEU 729 HA LEU 729 9.885 -6.295 6.507 33 HB2 LEU 729 HB2 LEU 729 9.579 -8.609 7.860 34 HB3 LEU 729 HB3 LEU 729 9.162 -9.210 6.277 35 HG LEU 729 HG LEU 729 11.460 -9.742 6.753 36 HD11 LEU 729 HD11 LEU 729 12.621 -8.868 4.872 37 HD12 LEU 729 HD12 LEU 729 11.546 -7.496 4.765 38 HD13 LEU 729 HD13 LEU 729 10.934 -9.122 4.412 39 HD21 LEU 729 HD21 LEU 729 11.926 -8.049 8.416 40 HD22 LEU 729 HD22 LEU 729 11.915 -6.794 7.174 41 HD23 LEU 729 HD23 LEU 729 13.160 -8.042 7.159 42 H ARG 730 HN ARG 730 7.789 -8.916 5.160 43 HA ARG 730 HA ARG 730 8.275 -7.868 2.566 44 HB2 ARG 730 HB2 ARG 730 6.278 -9.628 2.085 45 HB3 ARG 730 HB3 ARG 730 7.990 -10.035 2.046 46 HG2 ARG 730 HG2 ARG 730 7.765 -10.782 4.414 47 HG3 ARG 730 HG3 ARG 730 6.031 -10.452 4.310 48 HD2 ARG 730 HD2 ARG 730 5.753 -12.114 2.601 49 HD3 ARG 730 HD3 ARG 730 7.494 -12.341 2.460 50 HE ARG 730 HE ARG 730 7.259 -13.037 4.917 51 HH11 ARG 730 HH11 ARG 730 4.803 -13.744 2.441 52 HH12 ARG 730 HH12 ARG 730 4.345 -15.231 3.100 53 HH21 ARG 730 HH21 ARG 730 6.608 -15.125 5.834 54 HH22 ARG 730 HH22 ARG 730 5.405 -16.045 5.066 55 H GLN 731 HN GLN 731 5.476 -7.947 4.582 56 HA GLN 731 HA GLN 731 3.940 -6.334 2.760 57 HB2 GLN 731 HB2 GLN 731 2.736 -7.896 4.080 58 HB3 GLN 731 HB3 GLN 731 3.577 -7.413 5.529 59 HG2 GLN 731 HG2 GLN 731 1.252 -6.725 5.512 60 HG3 GLN 731 HG3 GLN 731 2.359 -5.367 5.658 61 HE21 GLN 731 HE21 GLN 731 1.539 -7.028 2.658 62 HE22 GLN 731 HE22 GLN 731 0.819 -5.621 1.937 63 H GLY 732 HN GLY 732 5.303 -6.082 5.917 64 HA2 GLY 732 HA3 GLY 732 4.761 -3.399 6.486 65 HA3 GLY 732 HA2 GLY 732 6.026 -4.343 7.231 66 H GLY 733 HN GLY 733 7.122 -4.615 4.287 67 HA2 GLY 733 HA3 GLY 733 8.242 -1.930 4.166 68 HA3 GLY 733 HA2 GLY 733 9.349 -3.288 4.278 69 H GLY 734 HN GLY 734 6.420 -2.621 2.403 70 HA2 GLY 734 HA3 GLY 734 7.890 -2.486 -0.012 71 HA3 GLY 734 HA2 GLY 734 7.187 -4.079 0.192 72 H LYS 735 HN LYS 735 4.780 -3.845 1.001 73 HA LYS 735 HA LYS 735 3.422 -1.788 -0.474 74 HB2 LYS 735 HB2 LYS 735 2.497 -3.033 -2.119 75 HB3 LYS 735 HB3 LYS 735 4.147 -3.569 -2.189 76 HG2 LYS 735 HG2 LYS 735 1.791 -5.118 -1.052 77 HG3 LYS 735 HG3 LYS 735 2.664 -5.463 -2.514 78 HD2 LYS 735 HD2 LYS 735 3.938 -5.598 0.216 79 HD3 LYS 735 HD3 LYS 735 3.202 -6.980 -0.588 80 HE2 LYS 735 HE2 LYS 735 4.789 -6.653 -2.470 81 HE3 LYS 735 HE3 LYS 735 5.559 -5.359 -1.555 82 HZ1 LYS 735 HZ1 LYS 735 6.075 -6.998 0.197 83 HZ2 LYS 735 HZ2 LYS 735 6.757 -7.420 -1.272 84 HZ3 LYS 735 HZ3 LYS 735 5.404 -8.221 -0.752 85 H LEU 736 HN LEU 736 1.007 -2.088 -0.289 86 HA LEU 736 HA LEU 736 0.348 -3.766 2.101 87 HB2 LEU 736 HB2 LEU 736 -1.220 -1.273 1.683 88 HB3 LEU 736 HB3 LEU 736 -0.954 -2.210 3.072 89 HG LEU 736 HG LEU 736 1.294 -0.534 2.014 90 HD11 LEU 736 HD11 LEU 736 -0.516 0.949 2.451 91 HD12 LEU 736 HD12 LEU 736 0.652 1.058 3.782 92 HD13 LEU 736 HD13 LEU 736 -0.857 0.169 3.999 93 HD21 LEU 736 HD21 LEU 736 1.959 -2.279 3.552 94 HD22 LEU 736 HD22 LEU 736 0.677 -1.818 4.665 95 HD23 LEU 736 HD23 LEU 736 2.018 -0.722 4.390 96 H ASN 737 HN ASN 737 -1.301 -5.047 1.827 97 HA ASN 737 HA ASN 737 -3.248 -4.470 -0.290 98 HB2 ASN 737 HB2 ASN 737 -1.989 -7.269 -0.051 99 HB3 ASN 737 HB3 ASN 737 -3.220 -6.905 -1.155 100 HD21 ASN 737 HD21 ASN 737 -0.448 -4.843 -0.756 101 HD22 ASN 737 HD22 ASN 737 0.171 -5.119 -2.339 102 H PHE 738 HN PHE 738 -5.423 -5.448 0.219 103 HA PHE 738 HA PHE 738 -6.105 -5.690 2.922 104 HB2 PHE 738 HB2 PHE 738 -7.710 -5.627 1.040 105 HB3 PHE 738 HB3 PHE 738 -7.097 -7.231 0.610 106 HD1 PHE 738 HD2 PHE 738 -8.444 -5.512 3.549 107 HD2 PHE 738 HD1 PHE 738 -8.436 -8.991 1.187 108 HE1 PHE 738 HE2 PHE 738 -10.116 -6.519 5.055 109 HE2 PHE 738 HE1 PHE 738 -10.103 -10.031 2.659 110 HZ PHE 738 HZ PHE 738 -10.948 -8.781 4.606 111 H ASP 739 HN ASP 739 -5.534 -8.579 0.861 112 HA ASP 739 HA ASP 739 -5.431 -10.361 3.084 113 HB2 ASP 739 HB2 ASP 739 -5.550 -10.748 0.346 114 HB3 ASP 739 HB3 ASP 739 -3.911 -11.129 0.628 115 H GLU 740 HN GLU 740 -2.996 -8.385 1.515 116 HA GLU 740 HA GLU 740 -0.842 -9.935 2.723 117 HB2 GLU 740 HB2 GLU 740 -0.982 -8.888 0.289 118 HB3 GLU 740 HB3 GLU 740 -0.444 -7.426 1.128 119 HG2 GLU 740 HG2 GLU 740 1.456 -8.387 0.209 120 HG3 GLU 740 HG3 GLU 740 1.509 -8.807 1.920 121 H LEU 741 HN LEU 741 -2.460 -6.826 3.007 122 HA LEU 741 HA LEU 741 -0.763 -5.481 4.716 123 HB2 LEU 741 HB2 LEU 741 -2.508 -4.331 3.818 124 HB3 LEU 741 HB3 LEU 741 -3.777 -5.384 4.421 125 HG LEU 741 HG LEU 741 -2.541 -4.484 6.693 126 HD11 LEU 741 HD11 LEU 741 -2.152 -2.103 6.497 127 HD12 LEU 741 HD12 LEU 741 -2.382 -2.205 4.758 128 HD13 LEU 741 HD13 LEU 741 -1.018 -3.024 5.510 129 HD21 LEU 741 HD21 LEU 741 -4.876 -4.512 6.386 130 HD22 LEU 741 HD22 LEU 741 -4.768 -3.315 5.142 131 HD23 LEU 741 HD23 LEU 741 -4.405 -2.868 6.815 132 H ARG 742 HN ARG 742 -3.035 -8.055 5.178 133 HA ARG 742 HA ARG 742 -3.350 -8.065 7.980 134 HB2 ARG 742 HB2 ARG 742 -2.990 -10.718 6.689 135 HB3 ARG 742 HB3 ARG 742 -4.146 -10.152 7.852 136 HG2 ARG 742 HG2 ARG 742 -4.277 -9.262 5.099 137 HG3 ARG 742 HG3 ARG 742 -4.999 -10.824 5.551 138 HD2 ARG 742 HD2 ARG 742 -6.058 -8.958 7.386 139 HD3 ARG 742 HD3 ARG 742 -5.825 -8.063 5.930 140 HE ARG 742 HE ARG 742 -7.510 -9.050 4.935 141 HH11 ARG 742 HH11 ARG 742 -6.404 -11.522 7.302 142 HH12 ARG 742 HH12 ARG 742 -7.813 -12.426 7.175 143 HH21 ARG 742 HH21 ARG 742 -9.471 -10.416 4.839 144 HH22 ARG 742 HH22 ARG 742 -9.539 -11.815 5.762 145 H GLN 743 HN GLN 743 -0.759 -9.168 5.959 146 HA GLN 743 HA GLN 743 0.626 -10.653 7.806 147 HB2 GLN 743 HB2 GLN 743 1.164 -9.553 5.325 148 HB3 GLN 743 HB3 GLN 743 2.369 -8.893 6.385 149 HG2 GLN 743 HG2 GLN 743 3.492 -10.829 6.643 150 HG3 GLN 743 HG3 GLN 743 2.025 -11.803 6.638 151 HE21 GLN 743 HE21 GLN 743 0.962 -10.745 4.255 152 HE22 GLN 743 HE22 GLN 743 1.907 -11.319 2.955 153 H ASP 744 HN ASP 744 0.247 -7.334 7.419 154 HA ASP 744 HA ASP 744 2.153 -6.549 9.392 155 HB2 ASP 744 HB2 ASP 744 0.817 -5.151 7.409 156 HB3 ASP 744 HB3 ASP 744 0.088 -4.599 8.870 157 H LEU 745 HN LEU 745 -1.376 -6.580 9.127 158 HA LEU 745 HA LEU 745 -1.607 -6.449 12.021 159 HB2 LEU 745 HB2 LEU 745 -3.969 -5.621 11.333 160 HB3 LEU 745 HB3 LEU 745 -2.622 -4.494 11.482 161 HG LEU 745 HG LEU 745 -2.429 -4.885 8.903 162 HD11 LEU 745 HD11 LEU 745 -3.990 -6.767 9.048 163 HD12 LEU 745 HD12 LEU 745 -4.287 -5.624 7.763 164 HD13 LEU 745 HD13 LEU 745 -5.326 -5.615 9.194 165 HD21 LEU 745 HD21 LEU 745 -4.465 -3.283 10.393 166 HD22 LEU 745 HD22 LEU 745 -4.382 -3.177 8.652 167 HD23 LEU 745 HD23 LEU 745 -2.968 -2.770 9.610 168 H LYS 746 HN LYS 746 -1.248 -8.912 10.887 169 HA LYS 746 HA LYS 746 -3.483 -10.304 10.250 170 HB2 LYS 746 HB2 LYS 746 -0.962 -11.265 11.563 171 HB3 LYS 746 HB3 LYS 746 -2.246 -12.445 11.265 172 HG2 LYS 746 HG2 LYS 746 -1.838 -11.354 8.761 173 HG3 LYS 746 HG3 LYS 746 -0.336 -11.057 9.525 174 HD2 LYS 746 HD2 LYS 746 0.098 -13.310 10.110 175 HD3 LYS 746 HD3 LYS 746 -1.488 -13.819 9.523 176 HE2 LYS 746 HE2 LYS 746 -0.881 -13.139 7.257 177 HE3 LYS 746 HE3 LYS 746 0.676 -12.574 7.855 178 HZ1 LYS 746 HZ1 LYS 746 1.309 -14.769 8.392 179 HZ2 LYS 746 HZ2 LYS 746 0.758 -14.777 6.794 180 HZ3 LYS 746 HZ3 LYS 746 -0.211 -15.392 8.019 181 H GLY 747 HN GLY 747 -5.262 -10.843 11.374 182 HA2 GLY 747 HA3 GLY 747 -6.487 -11.681 13.208 183 HA3 GLY 747 HA2 GLY 747 -5.138 -11.289 14.243 184 H LYS 748 HN LYS 748 -8.144 -10.114 13.125 185 HA LYS 748 HA LYS 748 -8.184 -7.866 14.782 186 HB2 LYS 748 HB2 LYS 748 -7.927 -5.911 13.352 187 HB3 LYS 748 HB3 LYS 748 -6.599 -6.990 13.041 188 HG2 LYS 748 HG2 LYS 748 -9.023 -6.831 11.237 189 HG3 LYS 748 HG3 LYS 748 -7.488 -6.007 10.982 190 HD2 LYS 748 HD2 LYS 748 -6.382 -7.881 10.421 191 HD3 LYS 748 HD3 LYS 748 -7.263 -8.870 11.563 192 HE2 LYS 748 HE2 LYS 748 -9.198 -8.717 10.098 193 HE3 LYS 748 HE3 LYS 748 -8.193 -7.922 8.889 194 HZ1 LYS 748 HZ1 LYS 748 -6.747 -9.942 8.976 195 HZ2 LYS 748 HZ2 LYS 748 -8.339 -10.316 8.498 196 HZ3 LYS 748 HZ3 LYS 748 -7.849 -10.625 10.030 197 H GLY 749 HN GLY 749 -9.507 -9.525 12.036 198 HA2 GLY 749 HA3 GLY 749 -12.051 -8.374 12.737 199 HA3 GLY 749 HA2 GLY 749 -11.661 -8.420 11.069 200 H HIS 750 HN HIS 750 -13.900 -9.666 11.644 201 HA HIS 750 HA HIS 750 -13.372 -12.489 12.050 202 HB2 HIS 750 HB2 HIS 750 -15.918 -10.932 11.725 203 HB3 HIS 750 HB3 HIS 750 -15.917 -12.694 11.715 204 HD2 HIS 750 HD2 HIS 750 -15.292 -9.706 14.190 205 HE1 HIS 750 HE1 HIS 750 -15.732 -13.239 16.472 206 HE2 HIS 750 HE2 HIS 750 -15.625 -10.737 16.525 207 H THR 751 HN THR 751 -15.490 -11.032 9.553 208 HA THR 751 HA THR 751 -14.326 -13.023 7.770 209 HB THR 751 HB THR 751 -16.246 -12.253 6.233 210 HG1 THR 751 HG1 THR 751 -17.107 -11.106 8.663 211 HG21 THR 751 HG21 THR 751 -16.431 -14.001 8.609 212 HG22 THR 751 HG22 THR 751 -16.349 -14.452 6.905 213 HG23 THR 751 HG23 THR 751 -17.848 -13.804 7.582 214 H ASP 752 HN ASP 752 -13.692 -12.542 5.670 215 HA ASP 752 HA ASP 752 -12.043 -10.308 5.349 216 HB2 ASP 752 HB2 ASP 752 -13.351 -12.064 3.240 217 HB3 ASP 752 HB3 ASP 752 -12.066 -10.910 2.899 218 H ALA 753 HN ALA 753 -15.392 -10.822 4.513 219 HA ALA 753 HA ALA 753 -15.713 -8.575 2.875 220 HB1 ALA 753 HB1 ALA 753 -17.877 -9.949 4.456 221 HB2 ALA 753 HB2 ALA 753 -17.212 -10.533 2.952 222 HB3 ALA 753 HB3 ALA 753 -18.061 -8.991 2.980 223 H GLU 754 HN GLU 754 -16.228 -8.975 6.293 224 HA GLU 754 HA GLU 754 -17.290 -6.432 6.809 225 HB2 GLU 754 HB2 GLU 754 -15.870 -8.523 8.378 226 HB3 GLU 754 HB3 GLU 754 -16.210 -6.980 9.148 227 HG2 GLU 754 HG2 GLU 754 -18.601 -7.474 8.838 228 HG3 GLU 754 HG3 GLU 754 -18.190 -8.926 7.930 229 H ILE 755 HN ILE 755 -14.034 -7.629 6.830 230 HA ILE 755 HA ILE 755 -12.855 -5.157 7.793 231 HB ILE 755 HB ILE 755 -11.527 -7.481 6.439 232 HG12 ILE 755 HG12 ILE 755 -11.790 -7.172 9.395 233 HG13 ILE 755 HG13 ILE 755 -13.083 -7.935 8.471 234 HG21 ILE 755 HG21 ILE 755 -10.228 -5.340 6.791 235 HG22 ILE 755 HG22 ILE 755 -9.576 -6.697 7.692 236 HG23 ILE 755 HG23 ILE 755 -10.540 -5.487 8.521 237 HD11 ILE 755 HD11 ILE 755 -10.218 -8.795 8.429 238 HD12 ILE 755 HD12 ILE 755 -11.580 -9.590 7.650 239 HD13 ILE 755 HD13 ILE 755 -11.481 -9.547 9.406 240 H GLU 756 HN GLU 756 -13.252 -6.758 4.689 241 HA GLU 756 HA GLU 756 -11.594 -5.085 3.239 242 HB2 GLU 756 HB2 GLU 756 -12.497 -7.305 2.482 243 HB3 GLU 756 HB3 GLU 756 -14.029 -6.465 2.194 244 HG2 GLU 756 HG2 GLU 756 -12.836 -4.979 0.548 245 HG3 GLU 756 HG3 GLU 756 -11.399 -5.931 0.846 246 H ALA 757 HN ALA 757 -15.052 -4.942 3.816 247 HA ALA 757 HA ALA 757 -15.572 -2.548 2.362 248 HB1 ALA 757 HB1 ALA 757 -17.071 -4.096 4.445 249 HB2 ALA 757 HB2 ALA 757 -17.505 -3.778 2.739 250 HB3 ALA 757 HB3 ALA 757 -17.628 -2.509 3.934 251 H ILE 758 HN ILE 758 -15.042 -3.174 5.826 252 HA ILE 758 HA ILE 758 -15.658 -0.657 6.745 253 HB ILE 758 HB ILE 758 -15.427 -2.643 8.208 254 HG12 ILE 758 HG12 ILE 758 -15.345 -0.212 9.093 255 HG13 ILE 758 HG13 ILE 758 -14.878 -1.520 10.186 256 HG21 ILE 758 HG21 ILE 758 -13.298 -3.419 7.299 257 HG22 ILE 758 HG22 ILE 758 -13.346 -3.433 9.066 258 HG23 ILE 758 HG23 ILE 758 -12.468 -2.157 8.204 259 HD11 ILE 758 HD11 ILE 758 -13.013 0.290 8.693 260 HD12 ILE 758 HD12 ILE 758 -12.547 -1.009 9.788 261 HD13 ILE 758 HD13 ILE 758 -13.436 0.381 10.409 262 H PHE 759 HN PHE 759 -12.500 -1.985 5.755 263 HA PHE 759 HA PHE 759 -11.042 0.272 6.442 264 HB2 PHE 759 HB2 PHE 759 -9.148 -0.889 5.568 265 HB3 PHE 759 HB3 PHE 759 -10.300 -2.141 5.851 266 HD1 PHE 759 HD2 PHE 759 -9.454 0.123 2.940 267 HD2 PHE 759 HD1 PHE 759 -10.410 -3.782 4.297 268 HE1 PHE 759 HE2 PHE 759 -9.255 -0.714 0.653 269 HE2 PHE 759 HE1 PHE 759 -10.169 -4.613 1.979 270 HZ PHE 759 HZ PHE 759 -9.607 -3.087 0.188 271 H THR 760 HN THR 760 -12.946 -0.392 3.680 272 HA THR 760 HA THR 760 -11.636 1.221 1.791 273 HB THR 760 HB THR 760 -14.581 0.470 1.963 274 HG1 THR 760 HG1 THR 760 -13.166 -1.436 1.846 275 HG21 THR 760 HG21 THR 760 -14.615 0.756 -0.438 276 HG22 THR 760 HG22 THR 760 -12.905 1.193 -0.377 277 HG23 THR 760 HG23 THR 760 -14.108 2.282 0.306 278 H LYS 761 HN LYS 761 -14.004 1.780 4.205 279 HA LYS 761 HA LYS 761 -14.196 4.651 3.574 280 HB2 LYS 761 HB2 LYS 761 -16.071 2.852 4.406 281 HB3 LYS 761 HB3 LYS 761 -15.600 3.631 5.930 282 HG2 LYS 761 HG2 LYS 761 -17.429 4.617 5.075 283 HG3 LYS 761 HG3 LYS 761 -16.198 5.834 4.791 284 HD2 LYS 761 HD2 LYS 761 -15.934 4.907 2.460 285 HD3 LYS 761 HD3 LYS 761 -17.347 3.904 2.771 286 HE2 LYS 761 HE2 LYS 761 -18.662 5.927 3.191 287 HE3 LYS 761 HE3 LYS 761 -17.245 6.913 2.823 288 HZ1 LYS 761 HZ1 LYS 761 -18.680 5.095 0.989 289 HZ2 LYS 761 HZ2 LYS 761 -17.234 5.844 0.604 290 HZ3 LYS 761 HZ3 LYS 761 -18.615 6.776 0.882 291 H TYR 762 HN TYR 762 -13.208 2.606 6.328 292 HA TYR 762 HA TYR 762 -12.271 5.000 7.777 293 HB2 TYR 762 HB2 TYR 762 -12.725 2.189 8.565 294 HB3 TYR 762 HB3 TYR 762 -11.732 3.246 9.556 295 HD1 TYR 762 HD1 TYR 762 -12.766 5.348 10.444 296 HD2 TYR 762 HD2 TYR 762 -15.071 2.244 8.693 297 HE1 TYR 762 HE1 TYR 762 -14.744 6.188 11.602 298 HE2 TYR 762 HE2 TYR 762 -17.078 3.087 9.853 299 HH TYR 762 HH TYR 762 -17.119 6.108 11.474 300 H ASP 763 HN ASP 763 -10.744 2.477 5.939 301 HA ASP 763 HA ASP 763 -8.264 2.462 7.276 302 HB2 ASP 763 HB2 ASP 763 -9.033 0.861 5.426 303 HB3 ASP 763 HB3 ASP 763 -8.651 2.087 4.305 304 H GLN 764 HN GLN 764 -6.322 3.427 6.667 305 HA GLN 764 HA GLN 764 -6.405 6.169 6.275 306 HB2 GLN 764 HB2 GLN 764 -4.150 4.203 5.981 307 HB3 GLN 764 HB3 GLN 764 -3.950 5.950 5.921 308 HG2 GLN 764 HG2 GLN 764 -4.657 6.210 8.142 309 HG3 GLN 764 HG3 GLN 764 -5.187 4.544 8.292 310 HE21 GLN 764 HE21 GLN 764 -2.156 5.522 6.749 311 HE22 GLN 764 HE22 GLN 764 -1.167 4.847 7.989 312 H ASP 765 HN ASP 765 -5.672 3.571 3.867 313 HA ASP 765 HA ASP 765 -5.759 5.749 1.881 314 HB2 ASP 765 HB2 ASP 765 -3.831 4.163 2.286 315 HB3 ASP 765 HB3 ASP 765 -4.766 2.980 1.397 316 H GLY 766 HN GLY 766 -7.660 3.189 3.062 317 HA2 GLY 766 HA3 GLY 766 -9.710 2.286 2.229 318 HA3 GLY 766 HA2 GLY 766 -9.739 3.785 1.307 319 H ASP 767 HN ASP 767 -7.062 1.796 0.820 320 HA ASP 767 HA ASP 767 -8.205 0.916 -1.746 321 HB2 ASP 767 HB2 ASP 767 -5.832 2.395 -1.236 322 HB3 ASP 767 HB3 ASP 767 -5.380 0.837 -1.923 323 H GLN 768 HN GLN 768 -5.473 0.143 0.302 324 HA GLN 768 HA GLN 768 -4.518 -1.861 1.039 325 HB2 GLN 768 HB2 GLN 768 -6.861 -1.206 2.239 326 HB3 GLN 768 HB3 GLN 768 -7.229 -2.836 1.787 327 HG2 GLN 768 HG2 GLN 768 -5.326 -3.626 2.964 328 HG3 GLN 768 HG3 GLN 768 -4.916 -1.964 3.412 329 HE21 GLN 768 HE21 GLN 768 -7.077 -4.611 4.008 330 HE22 GLN 768 HE22 GLN 768 -7.881 -3.869 5.345 331 H GLU 769 HN GLU 769 -3.781 -2.764 -0.861 332 HA GLU 769 HA GLU 769 -4.038 -5.227 -1.557 333 HB2 GLU 769 HB2 GLU 769 -5.620 -5.707 -3.338 334 HB3 GLU 769 HB3 GLU 769 -6.517 -4.982 -2.021 335 HG2 GLU 769 HG2 GLU 769 -6.900 -2.983 -3.279 336 HG3 GLU 769 HG3 GLU 769 -5.610 -3.400 -4.381 337 H LEU 770 HN LEU 770 -2.376 -2.736 -1.987 338 HA LEU 770 HA LEU 770 -2.034 -2.873 -4.875 339 HB2 LEU 770 HB2 LEU 770 -1.980 -0.522 -3.021 340 HB3 LEU 770 HB3 LEU 770 -0.929 -0.473 -4.391 341 HG LEU 770 HG LEU 770 -3.073 -0.661 -5.793 342 HD11 LEU 770 HD11 LEU 770 -4.319 -0.422 -3.079 343 HD12 LEU 770 HD12 LEU 770 -4.658 -1.667 -4.293 344 HD13 LEU 770 HD13 LEU 770 -5.135 -0.006 -4.562 345 HD21 LEU 770 HD21 LEU 770 -3.721 1.635 -5.422 346 HD22 LEU 770 HD22 LEU 770 -1.962 1.485 -5.326 347 HD23 LEU 770 HD23 LEU 770 -2.917 1.632 -3.856 348 H THR 771 HN THR 771 0.061 -3.506 -5.607 349 HA THR 771 HA THR 771 1.995 -3.911 -3.554 350 HB THR 771 HB THR 771 3.133 -5.325 -5.028 351 HG1 THR 771 HG1 THR 771 3.185 -5.126 -7.062 352 HG21 THR 771 HG21 THR 771 0.259 -5.318 -5.812 353 HG22 THR 771 HG22 THR 771 1.052 -6.286 -4.573 354 HG23 THR 771 HG23 THR 771 1.387 -6.596 -6.269 355 H GLU 772 HN GLU 772 4.381 -3.354 -4.087 356 HA GLU 772 HA GLU 772 4.755 -0.615 -4.219 357 HB2 GLU 772 HB2 GLU 772 6.247 -2.525 -3.329 358 HB3 GLU 772 HB3 GLU 772 6.815 -2.692 -4.968 359 HG2 GLU 772 HG2 GLU 772 7.516 -0.225 -4.840 360 HG3 GLU 772 HG3 GLU 772 7.211 -0.391 -3.119 361 H HIS 773 HN HIS 773 4.617 -3.153 -6.684 362 HA HIS 773 HA HIS 773 5.788 -1.625 -8.825 363 HB2 HIS 773 HB2 HIS 773 3.745 -3.844 -9.202 364 HB3 HIS 773 HB3 HIS 773 4.946 -3.269 -10.301 365 HD2 HIS 773 HD2 HIS 773 7.640 -3.918 -9.598 366 HE1 HIS 773 HE1 HIS 773 6.437 -7.215 -7.218 367 HE2 HIS 773 HE2 HIS 773 8.304 -6.184 -8.552 368 H GLU 774 HN GLU 774 2.501 -2.125 -7.657 369 HA GLU 774 HA GLU 774 1.365 -0.617 -9.830 370 HB2 GLU 774 HB2 GLU 774 -0.003 -1.214 -7.165 371 HB3 GLU 774 HB3 GLU 774 -0.685 -0.736 -8.720 372 HG2 GLU 774 HG2 GLU 774 -0.073 -2.756 -9.773 373 HG3 GLU 774 HG3 GLU 774 0.810 -3.291 -8.345 374 H HIS 775 HN HIS 775 2.169 0.046 -6.556 375 HA HIS 775 HA HIS 775 1.233 2.693 -6.315 376 HB2 HIS 775 HB2 HIS 775 1.692 1.230 -4.414 377 HB3 HIS 775 HB3 HIS 775 3.377 1.154 -4.908 378 HD2 HIS 775 HD2 HIS 775 4.699 2.470 -3.075 379 HE1 HIS 775 HE1 HIS 775 2.126 5.821 -2.654 380 HE2 HIS 775 HE2 HIS 775 4.214 4.697 -1.822 381 H GLN 776 HN GLN 776 4.174 1.306 -7.539 382 HA GLN 776 HA GLN 776 5.813 3.515 -7.573 383 HB2 GLN 776 HB2 GLN 776 6.595 1.247 -7.948 384 HB3 GLN 776 HB3 GLN 776 5.733 1.188 -9.471 385 HG2 GLN 776 HG2 GLN 776 7.185 2.941 -10.362 386 HG3 GLN 776 HG3 GLN 776 8.044 3.005 -8.825 387 HE21 GLN 776 HE21 GLN 776 9.950 2.437 -9.796 388 HE22 GLN 776 HE22 GLN 776 10.301 0.838 -10.316 389 H GLN 777 HN GLN 777 3.396 2.453 -9.805 390 HA GLN 777 HA GLN 777 4.181 4.318 -11.873 391 HB2 GLN 777 HB2 GLN 777 1.685 2.634 -11.784 392 HB3 GLN 777 HB3 GLN 777 2.523 3.259 -13.183 393 HG2 GLN 777 HG2 GLN 777 4.045 1.607 -13.245 394 HG3 GLN 777 HG3 GLN 777 4.044 1.387 -11.494 395 HE21 GLN 777 HE21 GLN 777 1.201 1.141 -11.210 396 HE22 GLN 777 HE22 GLN 777 0.728 -0.355 -11.824 397 H MET 778 HN MET 778 1.569 3.921 -9.554 398 HA MET 778 HA MET 778 0.038 5.977 -10.922 399 HB2 MET 778 HB2 MET 778 -0.716 4.285 -8.579 400 HB3 MET 778 HB3 MET 778 -1.822 5.421 -9.393 401 HG2 MET 778 HG2 MET 778 -0.540 2.988 -10.614 402 HG3 MET 778 HG3 MET 778 -2.238 3.167 -10.171 403 HE1 MET 778 HE1 MET 778 -2.900 2.358 -12.627 404 HE2 MET 778 HE2 MET 778 -1.194 2.229 -13.057 405 HE3 MET 778 HE3 MET 778 -2.301 3.124 -14.100 406 H ARG 779 HN ARG 779 0.279 5.969 -7.308 407 HA ARG 779 HA ARG 779 -0.020 8.762 -7.657 408 HB2 ARG 779 HB2 ARG 779 -0.162 6.953 -5.313 409 HB3 ARG 779 HB3 ARG 779 -0.021 8.685 -5.095 410 HG2 ARG 779 HG2 ARG 779 -2.045 9.063 -6.332 411 HG3 ARG 779 HG3 ARG 779 -2.157 7.340 -6.709 412 HD2 ARG 779 HD2 ARG 779 -2.171 8.507 -3.942 413 HD3 ARG 779 HD3 ARG 779 -3.611 8.000 -4.833 414 HE ARG 779 HE ARG 779 -1.971 5.893 -4.960 415 HH11 ARG 779 HH11 ARG 779 -2.951 7.795 -2.162 416 HH12 ARG 779 HH12 ARG 779 -3.315 6.427 -1.194 417 HH21 ARG 779 HH21 ARG 779 -2.521 4.005 -3.589 418 HH22 ARG 779 HH22 ARG 779 -3.161 4.299 -2.021 419 H ASP 780 HN ASP 780 1.120 10.018 -5.850 420 HA ASP 780 HA ASP 780 3.985 9.584 -6.130 421 HB2 ASP 780 HB2 ASP 780 2.723 12.294 -6.505 422 HB3 ASP 780 HB3 ASP 780 4.342 11.607 -6.868 423 H ASP 781 HN ASP 781 4.241 9.219 -3.899 424 HA ASP 781 HA ASP 781 3.029 11.056 -1.927 425 HB2 ASP 781 HB2 ASP 781 3.323 8.547 -1.467 426 HB3 ASP 781 HB3 ASP 781 5.044 8.850 -1.310 427 H LEU 782 HN LEU 782 6.197 10.153 -2.854 428 HA LEU 782 HA LEU 782 7.465 12.275 -1.166 429 HB2 LEU 782 HB2 LEU 782 8.459 9.952 -1.706 430 HB3 LEU 782 HB3 LEU 782 8.839 10.612 -3.272 431 HG LEU 782 HG LEU 782 10.255 12.351 -2.175 432 HD11 LEU 782 HD11 LEU 782 10.963 12.018 0.096 433 HD12 LEU 782 HD12 LEU 782 9.781 10.726 0.300 434 HD13 LEU 782 HD13 LEU 782 9.245 12.385 0.025 435 HD21 LEU 782 HD21 LEU 782 11.110 10.233 -3.133 436 HD22 LEU 782 HD22 LEU 782 11.043 9.525 -1.510 437 HD23 LEU 782 HD23 LEU 782 12.073 10.927 -1.842 438 H GLU 783 HN GLU 783 6.362 11.956 -4.385 439 HA GLU 783 HA GLU 783 7.811 13.875 -5.751 440 HB2 GLU 783 HB2 GLU 783 6.034 12.445 -6.660 441 HB3 GLU 783 HB3 GLU 783 4.851 13.524 -5.971 442 HG2 GLU 783 HG2 GLU 783 5.120 14.256 -8.347 443 HG3 GLU 783 HG3 GLU 783 5.817 15.408 -7.242 444 H LYS 784 HN LYS 784 5.271 14.079 -3.300 445 HA LYS 784 HA LYS 784 5.259 16.866 -3.521 446 HB2 LYS 784 HB2 LYS 784 3.102 15.142 -4.274 447 HB3 LYS 784 HB3 LYS 784 2.565 16.456 -3.199 448 HG2 LYS 784 HG2 LYS 784 3.779 17.995 -4.797 449 HG3 LYS 784 HG3 LYS 784 3.954 16.609 -5.870 450 HD2 LYS 784 HD2 LYS 784 1.561 16.372 -6.000 451 HD3 LYS 784 HD3 LYS 784 1.353 17.676 -4.821 452 HE2 LYS 784 HE2 LYS 784 2.495 19.201 -6.324 453 HE3 LYS 784 HE3 LYS 784 2.636 17.925 -7.526 454 HZ1 LYS 784 HZ1 LYS 784 0.054 19.019 -6.515 455 HZ2 LYS 784 HZ2 LYS 784 0.237 17.823 -7.684 456 HZ3 LYS 784 HZ3 LYS 784 0.769 19.377 -8.002 457 H GLU 785 HN GLU 785 6.402 16.391 -1.473 458 HA GLU 785 HA GLU 785 4.890 16.662 0.863 459 HB2 GLU 785 HB2 GLU 785 4.764 14.140 0.446 460 HB3 GLU 785 HB3 GLU 785 6.512 14.068 0.672 461 HG2 GLU 785 HG2 GLU 785 6.195 14.890 2.993 462 HG3 GLU 785 HG3 GLU 785 4.448 14.941 2.693 463 H ARG 786 HN ARG 786 6.212 17.656 2.224 464 HA ARG 786 HA ARG 786 8.913 18.089 1.241 465 HB2 ARG 786 HB2 ARG 786 7.550 20.085 1.463 466 HB3 ARG 786 HB3 ARG 786 7.199 19.663 3.139 467 HG2 ARG 786 HG2 ARG 786 9.642 19.827 3.583 468 HG3 ARG 786 HG3 ARG 786 9.832 20.520 1.976 469 HD2 ARG 786 HD2 ARG 786 9.595 22.329 3.540 470 HD3 ARG 786 HD3 ARG 786 8.102 22.166 2.595 471 HE ARG 786 HE ARG 786 8.196 20.745 5.102 472 HH11 ARG 786 HH11 ARG 786 7.193 23.754 3.558 473 HH12 ARG 786 HH12 ARG 786 5.933 24.067 4.643 474 HH21 ARG 786 HH21 ARG 786 6.492 21.164 6.608 475 HH22 ARG 786 HH22 ARG 786 5.539 22.565 6.463 476 H GLU 787 HN GLU 787 10.438 17.175 2.386 477 HA GLU 787 HA GLU 787 9.861 16.054 4.969 478 HB2 GLU 787 HB2 GLU 787 12.131 15.706 3.037 479 HB3 GLU 787 HB3 GLU 787 12.136 14.996 4.646 480 HG2 GLU 787 HG2 GLU 787 9.963 14.508 2.628 481 HG3 GLU 787 HG3 GLU 787 11.378 13.470 2.814 482 H ASP 788 HN ASP 788 11.179 16.510 6.781 483 HA ASP 788 HA ASP 788 12.217 19.212 6.843 484 HB2 ASP 788 HB2 ASP 788 10.934 18.354 8.698 485 HB3 ASP 788 HB3 ASP 788 12.088 17.043 8.964 486 H LEU 789 HN LEU 789 14.399 19.609 7.666 487 HA LEU 789 HA LEU 789 16.252 17.696 6.529 488 HB2 LEU 789 HB2 LEU 789 16.055 20.282 6.222 489 HB3 LEU 789 HB3 LEU 789 17.032 20.316 7.674 490 HG LEU 789 HG LEU 789 18.768 18.872 6.479 491 HD11 LEU 789 HD11 LEU 789 17.064 19.453 4.089 492 HD12 LEU 789 HD12 LEU 789 17.337 17.867 4.814 493 HD13 LEU 789 HD13 LEU 789 18.675 18.742 4.079 494 HD21 LEU 789 HD21 LEU 789 18.068 21.464 5.189 495 HD22 LEU 789 HD22 LEU 789 19.632 20.619 5.155 496 HD23 LEU 789 HD23 LEU 789 19.022 21.284 6.675 497 H ASP 790 HN ASP 790 16.441 16.199 8.038 498 HA ASP 790 HA ASP 790 16.713 16.966 10.863 499 HB2 ASP 790 HB2 ASP 790 15.036 15.130 10.146 500 HB3 ASP 790 HB3 ASP 790 16.437 14.096 9.896 501 H LEU 791 HN LEU 791 18.276 15.104 11.924 502 HA LEU 791 HA LEU 791 20.629 15.292 10.277 503 HB2 LEU 791 HB2 LEU 791 20.647 16.713 12.350 504 HB3 LEU 791 HB3 LEU 791 20.607 15.267 13.298 505 HG LEU 791 HG LEU 791 22.885 16.273 11.608 506 HD11 LEU 791 HD11 LEU 791 22.550 17.573 13.572 507 HD12 LEU 791 HD12 LEU 791 23.979 16.549 13.787 508 HD13 LEU 791 HD13 LEU 791 22.461 16.119 14.568 509 HD21 LEU 791 HD21 LEU 791 22.656 13.728 13.226 510 HD22 LEU 791 HD22 LEU 791 24.181 14.541 12.961 511 HD23 LEU 791 HD23 LEU 791 23.295 13.939 11.576 512 H ASP 792 HN ASP 792 19.098 13.338 12.710 513 HA ASP 792 HA ASP 792 19.973 10.843 11.441 514 HB2 ASP 792 HB2 ASP 792 21.930 11.389 12.695 515 HB3 ASP 792 HB3 ASP 792 21.015 11.580 14.170 516 H HIS 793 HN HIS 793 19.275 11.342 14.795 517 HA HIS 793 HA HIS 793 16.460 10.382 14.621 518 HB2 HIS 793 HB2 HIS 793 18.224 8.655 15.475 519 HB3 HIS 793 HB3 HIS 793 18.434 9.747 16.836 520 HD2 HIS 793 HD2 HIS 793 15.978 7.057 15.552 521 HE1 HIS 793 HE1 HIS 793 14.431 8.505 19.215 522 HE2 HIS 793 HE2 HIS 793 14.214 6.781 17.421 523 H SER 794 HN SER 794 15.302 11.463 16.344 524 HA SER 794 HA SER 794 16.540 13.572 17.954 525 HB2 SER 794 HB2 SER 794 15.269 15.317 16.711 526 HB3 SER 794 HB3 SER 794 16.708 14.692 15.884 527 HG SER 794 HG SER 794 15.242 14.539 14.290 528 H SER 795 HN SER 795 14.610 11.329 18.125 529 HA SER 795 HA SER 795 12.384 12.863 19.063 530 HB2 SER 795 HB2 SER 795 11.863 10.713 17.972 531 HB3 SER 795 HB3 SER 795 12.749 9.840 19.238 532 HG SER 795 HG SER 795 10.226 10.631 19.190 533 H LEU 796 HN LEU 796 13.218 13.942 20.844 534 HA LEU 796 HA LEU 796 14.029 12.370 23.159 535 HB2 LEU 796 HB2 LEU 796 16.163 13.149 22.047 536 HB3 LEU 796 HB3 LEU 796 15.632 14.804 22.234 537 HG LEU 796 HG LEU 796 15.650 14.468 24.686 538 HD11 LEU 796 HD11 LEU 796 16.967 11.860 23.954 539 HD12 LEU 796 HD12 LEU 796 15.411 12.061 24.767 540 HD13 LEU 796 HD13 LEU 796 16.896 12.561 25.569 541 HD21 LEU 796 HD21 LEU 796 18.094 14.569 24.870 542 HD22 LEU 796 HD22 LEU 796 17.498 15.546 23.530 543 HD23 LEU 796 HD23 LEU 796 18.238 13.976 23.215 Start of MODEL 3 1 HA ASP 724 HA ASP 724 4.475 -0.722 15.149 2 HB2 ASP 724 HB2 ASP 724 4.482 -1.611 17.480 3 HB3 ASP 724 HB3 ASP 724 6.133 -1.057 17.665 4 H ILE 725 HN ILE 725 7.873 -0.835 16.212 5 HA ILE 725 HA ILE 725 8.394 1.853 15.511 6 HB ILE 725 HB ILE 725 10.301 -0.517 15.741 7 HG12 ILE 725 HG12 ILE 725 9.729 1.571 17.907 8 HG13 ILE 725 HG13 ILE 725 8.892 0.020 17.804 9 HG21 ILE 725 HG21 ILE 725 10.851 2.453 15.831 10 HG22 ILE 725 HG22 ILE 725 11.309 1.343 14.534 11 HG23 ILE 725 HG23 ILE 725 12.025 1.176 16.137 12 HD11 ILE 725 HD11 ILE 725 10.955 -1.128 18.120 13 HD12 ILE 725 HD12 ILE 725 10.732 0.062 19.408 14 HD13 ILE 725 HD13 ILE 725 11.858 0.386 18.086 15 H SER 726 HN SER 726 9.227 -1.275 13.906 16 HA SER 726 HA SER 726 9.145 0.050 11.338 17 HB2 SER 726 HB2 SER 726 10.210 -2.667 12.180 18 HB3 SER 726 HB3 SER 726 10.417 -1.882 10.608 19 HG SER 726 HG SER 726 11.232 -0.139 12.189 20 H GLU 727 HN GLU 727 8.065 -1.488 9.711 21 HA GLU 727 HA GLU 727 5.773 -2.653 10.993 22 HB2 GLU 727 HB2 GLU 727 6.256 -2.091 8.017 23 HB3 GLU 727 HB3 GLU 727 4.809 -2.733 8.787 24 HG2 GLU 727 HG2 GLU 727 4.574 -0.370 8.088 25 HG3 GLU 727 HG3 GLU 727 4.261 -0.594 9.791 26 H SER 728 HN SER 728 5.262 -4.760 9.298 27 HA SER 728 HA SER 728 6.887 -6.557 10.637 28 HB2 SER 728 HB2 SER 728 5.172 -7.099 8.263 29 HB3 SER 728 HB3 SER 728 5.720 -8.233 9.516 30 HG SER 728 HG SER 728 4.027 -5.979 9.823 31 H LEU 729 HN LEU 729 6.923 -6.664 7.024 32 HA LEU 729 HA LEU 729 9.727 -6.585 6.736 33 HB2 LEU 729 HB2 LEU 729 8.547 -9.332 7.005 34 HB3 LEU 729 HB3 LEU 729 9.838 -9.093 5.856 35 HG LEU 729 HG LEU 729 10.019 -8.631 8.841 36 HD11 LEU 729 HD11 LEU 729 11.142 -10.832 7.112 37 HD12 LEU 729 HD12 LEU 729 9.822 -10.990 8.271 38 HD13 LEU 729 HD13 LEU 729 11.448 -10.608 8.833 39 HD21 LEU 729 HD21 LEU 729 12.118 -8.500 6.675 40 HD22 LEU 729 HD22 LEU 729 12.428 -8.449 8.407 41 HD23 LEU 729 HD23 LEU 729 11.523 -7.145 7.644 42 H ARG 730 HN ARG 730 7.832 -8.989 5.008 43 HA ARG 730 HA ARG 730 8.373 -7.590 2.627 44 HB2 ARG 730 HB2 ARG 730 6.576 -9.338 1.737 45 HB3 ARG 730 HB3 ARG 730 8.304 -9.696 1.845 46 HG2 ARG 730 HG2 ARG 730 7.810 -10.760 4.050 47 HG3 ARG 730 HG3 ARG 730 6.091 -10.481 3.759 48 HD2 ARG 730 HD2 ARG 730 6.174 -11.861 1.764 49 HD3 ARG 730 HD3 ARG 730 7.917 -12.028 1.906 50 HE ARG 730 HE ARG 730 6.757 -13.031 4.248 51 HH11 ARG 730 HH11 ARG 730 6.819 -13.882 0.805 52 HH12 ARG 730 HH12 ARG 730 6.673 -15.548 1.088 53 HH21 ARG 730 HH21 ARG 730 6.562 -15.283 4.604 54 HH22 ARG 730 HH22 ARG 730 6.509 -16.361 3.271 55 H GLN 731 HN GLN 731 5.511 -7.924 4.501 56 HA GLN 731 HA GLN 731 3.961 -6.326 2.710 57 HB2 GLN 731 HB2 GLN 731 2.788 -7.939 3.981 58 HB3 GLN 731 HB3 GLN 731 3.615 -7.469 5.450 59 HG2 GLN 731 HG2 GLN 731 1.265 -6.857 5.401 60 HG3 GLN 731 HG3 GLN 731 2.307 -5.465 5.642 61 HE21 GLN 731 HE21 GLN 731 1.606 -7.064 2.604 62 HE22 GLN 731 HE22 GLN 731 0.869 -5.667 1.872 63 H GLY 732 HN GLY 732 5.417 -6.118 5.813 64 HA2 GLY 732 HA3 GLY 732 4.709 -3.518 6.496 65 HA3 GLY 732 HA2 GLY 732 6.084 -4.371 7.174 66 H GLY 733 HN GLY 733 7.231 -4.617 4.408 67 HA2 GLY 733 HA3 GLY 733 8.085 -1.833 4.179 68 HA3 GLY 733 HA2 GLY 733 9.269 -3.132 4.274 69 H GLY 734 HN GLY 734 6.408 -2.233 2.398 70 HA2 GLY 734 HA3 GLY 734 7.868 -2.124 0.079 71 HA3 GLY 734 HA2 GLY 734 7.259 -3.761 0.193 72 H LYS 735 HN LYS 735 4.808 -3.711 0.964 73 HA LYS 735 HA LYS 735 3.377 -1.715 -0.499 74 HB2 LYS 735 HB2 LYS 735 2.470 -3.022 -2.132 75 HB3 LYS 735 HB3 LYS 735 4.145 -3.434 -2.286 76 HG2 LYS 735 HG2 LYS 735 1.919 -5.145 -1.140 77 HG3 LYS 735 HG3 LYS 735 2.838 -5.416 -2.582 78 HD2 LYS 735 HD2 LYS 735 4.103 -5.491 0.161 79 HD3 LYS 735 HD3 LYS 735 3.495 -6.916 -0.671 80 HE2 LYS 735 HE2 LYS 735 5.067 -6.473 -2.524 81 HE3 LYS 735 HE3 LYS 735 5.699 -5.083 -1.639 82 HZ1 LYS 735 HZ1 LYS 735 7.116 -7.027 -1.321 83 HZ2 LYS 735 HZ2 LYS 735 5.830 -7.928 -0.775 84 HZ3 LYS 735 HZ3 LYS 735 6.385 -6.638 0.141 85 H LEU 736 HN LEU 736 0.996 -2.074 -0.275 86 HA LEU 736 HA LEU 736 0.399 -3.815 2.079 87 HB2 LEU 736 HB2 LEU 736 -1.198 -1.332 1.707 88 HB3 LEU 736 HB3 LEU 736 -0.912 -2.282 3.088 89 HG LEU 736 HG LEU 736 1.288 -0.544 2.012 90 HD11 LEU 736 HD11 LEU 736 -0.552 0.882 2.547 91 HD12 LEU 736 HD12 LEU 736 0.667 0.999 3.823 92 HD13 LEU 736 HD13 LEU 736 -0.801 0.057 4.087 93 HD21 LEU 736 HD21 LEU 736 2.031 -2.325 3.482 94 HD22 LEU 736 HD22 LEU 736 0.794 -1.896 4.660 95 HD23 LEU 736 HD23 LEU 736 2.115 -0.783 4.338 96 H ASN 737 HN ASN 737 -1.247 -5.093 1.817 97 HA ASN 737 HA ASN 737 -3.218 -4.520 -0.292 98 HB2 ASN 737 HB2 ASN 737 -2.078 -7.327 -0.015 99 HB3 ASN 737 HB3 ASN 737 -3.095 -6.810 -1.301 100 HD21 ASN 737 HD21 ASN 737 -1.177 -4.365 -1.625 101 HD22 ASN 737 HD22 ASN 737 0.116 -5.072 -2.495 102 H PHE 738 HN PHE 738 -5.332 -5.460 0.199 103 HA PHE 738 HA PHE 738 -6.009 -5.674 2.912 104 HB2 PHE 738 HB2 PHE 738 -7.608 -5.571 1.037 105 HB3 PHE 738 HB3 PHE 738 -7.062 -7.192 0.597 106 HD1 PHE 738 HD2 PHE 738 -8.222 -5.489 3.650 107 HD2 PHE 738 HD1 PHE 738 -8.556 -8.830 1.134 108 HE1 PHE 738 HE2 PHE 738 -9.892 -6.436 5.180 109 HE2 PHE 738 HE1 PHE 738 -10.260 -9.802 2.646 110 HZ PHE 738 HZ PHE 738 -10.913 -8.605 4.666 111 H ASP 739 HN ASP 739 -5.547 -8.573 0.886 112 HA ASP 739 HA ASP 739 -5.363 -10.300 3.132 113 HB2 ASP 739 HB2 ASP 739 -4.777 -10.620 0.233 114 HB3 ASP 739 HB3 ASP 739 -4.275 -11.879 1.354 115 H GLU 740 HN GLU 740 -2.975 -8.491 1.405 116 HA GLU 740 HA GLU 740 -0.758 -9.946 2.678 117 HB2 GLU 740 HB2 GLU 740 -0.873 -8.803 0.268 118 HB3 GLU 740 HB3 GLU 740 -0.341 -7.401 1.199 119 HG2 GLU 740 HG2 GLU 740 1.563 -8.365 0.317 120 HG3 GLU 740 HG3 GLU 740 1.524 -8.919 1.998 121 H LEU 741 HN LEU 741 -2.378 -6.835 2.986 122 HA LEU 741 HA LEU 741 -0.690 -5.539 4.717 123 HB2 LEU 741 HB2 LEU 741 -2.415 -4.377 3.833 124 HB3 LEU 741 HB3 LEU 741 -3.699 -5.425 4.412 125 HG LEU 741 HG LEU 741 -2.489 -4.574 6.710 126 HD11 LEU 741 HD11 LEU 741 -2.058 -2.204 6.556 127 HD12 LEU 741 HD12 LEU 741 -2.253 -2.270 4.811 128 HD13 LEU 741 HD13 LEU 741 -0.916 -3.121 5.577 129 HD21 LEU 741 HD21 LEU 741 -4.817 -4.546 6.371 130 HD22 LEU 741 HD22 LEU 741 -4.664 -3.344 5.132 131 HD23 LEU 741 HD23 LEU 741 -4.329 -2.910 6.807 132 H ARG 742 HN ARG 742 -2.956 -8.089 5.141 133 HA ARG 742 HA ARG 742 -3.286 -8.125 7.946 134 HB2 ARG 742 HB2 ARG 742 -2.923 -10.760 6.638 135 HB3 ARG 742 HB3 ARG 742 -4.097 -10.188 7.788 136 HG2 ARG 742 HG2 ARG 742 -4.193 -9.285 5.030 137 HG3 ARG 742 HG3 ARG 742 -4.909 -10.850 5.480 138 HD2 ARG 742 HD2 ARG 742 -6.027 -9.044 7.300 139 HD3 ARG 742 HD3 ARG 742 -5.732 -8.090 5.893 140 HE ARG 742 HE ARG 742 -7.424 -8.975 4.875 141 HH11 ARG 742 HH11 ARG 742 -6.272 -11.637 7.063 142 HH12 ARG 742 HH12 ARG 742 -7.486 -12.680 6.534 143 HH21 ARG 742 HH21 ARG 742 -9.018 -10.587 4.167 144 HH22 ARG 742 HH22 ARG 742 -9.058 -12.070 4.946 145 H GLN 743 HN GLN 743 -0.683 -9.231 5.907 146 HA GLN 743 HA GLN 743 0.664 -10.756 7.727 147 HB2 GLN 743 HB2 GLN 743 1.232 -9.644 5.260 148 HB3 GLN 743 HB3 GLN 743 2.421 -8.971 6.325 149 HG2 GLN 743 HG2 GLN 743 3.610 -10.890 6.564 150 HG3 GLN 743 HG3 GLN 743 2.153 -11.885 6.609 151 HE21 GLN 743 HE21 GLN 743 1.103 -10.886 4.220 152 HE22 GLN 743 HE22 GLN 743 1.975 -11.495 2.913 153 H ASP 744 HN ASP 744 0.315 -7.429 7.389 154 HA ASP 744 HA ASP 744 2.204 -6.692 9.382 155 HB2 ASP 744 HB2 ASP 744 0.905 -5.227 7.439 156 HB3 ASP 744 HB3 ASP 744 0.157 -4.712 8.897 157 H LEU 745 HN LEU 745 -1.299 -6.684 9.112 158 HA LEU 745 HA LEU 745 -1.565 -6.582 12.010 159 HB2 LEU 745 HB2 LEU 745 -3.907 -5.707 11.322 160 HB3 LEU 745 HB3 LEU 745 -2.546 -4.599 11.483 161 HG LEU 745 HG LEU 745 -2.352 -4.970 8.901 162 HD11 LEU 745 HD11 LEU 745 -3.929 -6.843 9.026 163 HD12 LEU 745 HD12 LEU 745 -4.222 -5.684 7.751 164 HD13 LEU 745 HD13 LEU 745 -5.255 -5.684 9.185 165 HD21 LEU 745 HD21 LEU 745 -4.436 -3.397 10.358 166 HD22 LEU 745 HD22 LEU 745 -4.229 -3.215 8.632 167 HD23 LEU 745 HD23 LEU 745 -2.883 -2.869 9.716 168 H LYS 746 HN LYS 746 -1.229 -9.028 10.829 169 HA LYS 746 HA LYS 746 -3.448 -10.397 10.187 170 HB2 LYS 746 HB2 LYS 746 -0.928 -11.355 11.498 171 HB3 LYS 746 HB3 LYS 746 -2.212 -12.525 11.221 172 HG2 LYS 746 HG2 LYS 746 -1.850 -11.407 8.699 173 HG3 LYS 746 HG3 LYS 746 -0.307 -11.227 9.411 174 HD2 LYS 746 HD2 LYS 746 -0.026 -13.513 9.876 175 HD3 LYS 746 HD3 LYS 746 -1.723 -13.862 9.543 176 HE2 LYS 746 HE2 LYS 746 -1.347 -13.183 7.191 177 HE3 LYS 746 HE3 LYS 746 0.369 -12.997 7.559 178 HZ1 LYS 746 HZ1 LYS 746 -0.084 -15.167 6.589 179 HZ2 LYS 746 HZ2 LYS 746 -1.192 -15.507 7.799 180 HZ3 LYS 746 HZ3 LYS 746 0.423 -15.344 8.189 181 H GLY 747 HN GLY 747 -5.189 -11.211 11.271 182 HA2 GLY 747 HA3 GLY 747 -6.512 -11.976 13.061 183 HA3 GLY 747 HA2 GLY 747 -5.169 -11.645 14.124 184 H LYS 748 HN LYS 748 -8.144 -10.312 12.937 185 HA LYS 748 HA LYS 748 -8.041 -8.137 14.764 186 HB2 LYS 748 HB2 LYS 748 -7.719 -6.169 13.414 187 HB3 LYS 748 HB3 LYS 748 -6.457 -7.310 13.041 188 HG2 LYS 748 HG2 LYS 748 -8.899 -6.960 11.290 189 HG3 LYS 748 HG3 LYS 748 -7.343 -6.169 11.039 190 HD2 LYS 748 HD2 LYS 748 -6.331 -8.038 10.328 191 HD3 LYS 748 HD3 LYS 748 -7.211 -9.089 11.417 192 HE2 LYS 748 HE2 LYS 748 -9.178 -8.741 10.039 193 HE3 LYS 748 HE3 LYS 748 -8.204 -7.837 8.881 194 HZ1 LYS 748 HZ1 LYS 748 -6.841 -9.932 8.658 195 HZ2 LYS 748 HZ2 LYS 748 -8.462 -10.163 8.190 196 HZ3 LYS 748 HZ3 LYS 748 -7.943 -10.690 9.658 197 H GLY 749 HN GLY 749 -9.588 -9.659 12.071 198 HA2 GLY 749 HA3 GLY 749 -12.000 -8.231 12.782 199 HA3 GLY 749 HA2 GLY 749 -11.607 -8.435 11.113 200 H HIS 750 HN HIS 750 -13.973 -9.434 11.743 201 HA HIS 750 HA HIS 750 -13.705 -12.256 12.385 202 HB2 HIS 750 HB2 HIS 750 -16.136 -10.566 11.802 203 HB3 HIS 750 HB3 HIS 750 -16.226 -12.315 11.952 204 HD2 HIS 750 HD2 HIS 750 -15.638 -9.152 14.216 205 HE1 HIS 750 HE1 HIS 750 -16.378 -12.484 16.694 206 HE2 HIS 750 HE2 HIS 750 -15.830 -10.044 16.596 207 H THR 751 HN THR 751 -15.565 -10.755 9.718 208 HA THR 751 HA THR 751 -14.400 -12.857 8.084 209 HB THR 751 HB THR 751 -16.317 -12.103 6.482 210 HG1 THR 751 HG1 THR 751 -17.177 -10.945 8.911 211 HG21 THR 751 HG21 THR 751 -16.505 -13.885 8.846 212 HG22 THR 751 HG22 THR 751 -16.237 -14.328 7.158 213 HG23 THR 751 HG23 THR 751 -17.832 -13.777 7.692 214 H ASP 752 HN ASP 752 -13.645 -12.464 6.077 215 HA ASP 752 HA ASP 752 -11.997 -10.205 5.701 216 HB2 ASP 752 HB2 ASP 752 -13.125 -12.088 3.616 217 HB3 ASP 752 HB3 ASP 752 -11.714 -11.044 3.427 218 H ALA 753 HN ALA 753 -15.286 -10.839 4.691 219 HA ALA 753 HA ALA 753 -15.553 -8.704 2.888 220 HB1 ALA 753 HB1 ALA 753 -17.728 -10.008 4.523 221 HB2 ALA 753 HB2 ALA 753 -17.085 -10.623 3.018 222 HB3 ALA 753 HB3 ALA 753 -17.933 -9.076 3.040 223 H GLU 754 HN GLU 754 -16.214 -8.899 6.311 224 HA GLU 754 HA GLU 754 -17.268 -6.343 6.668 225 HB2 GLU 754 HB2 GLU 754 -15.902 -8.365 8.338 226 HB3 GLU 754 HB3 GLU 754 -16.240 -6.786 9.040 227 HG2 GLU 754 HG2 GLU 754 -18.638 -7.302 8.585 228 HG3 GLU 754 HG3 GLU 754 -18.151 -8.868 7.940 229 H ILE 755 HN ILE 755 -14.020 -7.556 6.823 230 HA ILE 755 HA ILE 755 -12.826 -5.085 7.735 231 HB ILE 755 HB ILE 755 -11.498 -7.458 6.472 232 HG12 ILE 755 HG12 ILE 755 -11.826 -7.090 9.414 233 HG13 ILE 755 HG13 ILE 755 -13.126 -7.835 8.487 234 HG21 ILE 755 HG21 ILE 755 -10.257 -5.254 6.864 235 HG22 ILE 755 HG22 ILE 755 -9.567 -6.664 7.621 236 HG23 ILE 755 HG23 ILE 755 -10.500 -5.530 8.596 237 HD11 ILE 755 HD11 ILE 755 -10.285 -8.777 8.511 238 HD12 ILE 755 HD12 ILE 755 -11.647 -9.542 7.717 239 HD13 ILE 755 HD13 ILE 755 -11.585 -9.491 9.470 240 H GLU 756 HN GLU 756 -13.190 -6.747 4.675 241 HA GLU 756 HA GLU 756 -11.508 -5.147 3.179 242 HB2 GLU 756 HB2 GLU 756 -12.419 -7.384 2.551 243 HB3 GLU 756 HB3 GLU 756 -13.958 -6.568 2.214 244 HG2 GLU 756 HG2 GLU 756 -12.765 -5.288 0.416 245 HG3 GLU 756 HG3 GLU 756 -11.331 -6.229 0.760 246 H ALA 757 HN ALA 757 -14.947 -4.948 3.748 247 HA ALA 757 HA ALA 757 -15.412 -2.598 2.192 248 HB1 ALA 757 HB1 ALA 757 -16.974 -4.084 4.271 249 HB2 ALA 757 HB2 ALA 757 -17.374 -3.778 2.554 250 HB3 ALA 757 HB3 ALA 757 -17.496 -2.495 3.736 251 H ILE 758 HN ILE 758 -14.968 -3.121 5.689 252 HA ILE 758 HA ILE 758 -15.574 -0.583 6.554 253 HB ILE 758 HB ILE 758 -15.368 -2.527 8.073 254 HG12 ILE 758 HG12 ILE 758 -15.207 -0.074 8.933 255 HG13 ILE 758 HG13 ILE 758 -14.782 -1.402 10.034 256 HG21 ILE 758 HG21 ILE 758 -13.287 -3.380 7.172 257 HG22 ILE 758 HG22 ILE 758 -13.308 -3.341 8.940 258 HG23 ILE 758 HG23 ILE 758 -12.399 -2.126 8.032 259 HD11 ILE 758 HD11 ILE 758 -12.850 0.344 8.526 260 HD12 ILE 758 HD12 ILE 758 -12.435 -0.946 9.652 261 HD13 ILE 758 HD13 ILE 758 -13.272 0.490 10.235 262 H PHE 759 HN PHE 759 -12.434 -1.937 5.603 263 HA PHE 759 HA PHE 759 -10.970 0.343 6.293 264 HB2 PHE 759 HB2 PHE 759 -9.080 -0.799 5.441 265 HB3 PHE 759 HB3 PHE 759 -10.204 -2.082 5.773 266 HD1 PHE 759 HD2 PHE 759 -9.344 0.107 2.796 267 HD2 PHE 759 HD1 PHE 759 -10.341 -3.769 4.226 268 HE1 PHE 759 HE2 PHE 759 -9.162 -0.768 0.534 269 HE2 PHE 759 HE1 PHE 759 -10.106 -4.645 1.918 270 HZ PHE 759 HZ PHE 759 -9.534 -3.151 0.095 271 H THR 760 HN THR 760 -12.813 -0.404 3.499 272 HA THR 760 HA THR 760 -11.467 1.231 1.635 273 HB THR 760 HB THR 760 -14.385 0.371 1.729 274 HG1 THR 760 HG1 THR 760 -13.040 -1.506 1.661 275 HG21 THR 760 HG21 THR 760 -14.369 0.633 -0.669 276 HG22 THR 760 HG22 THR 760 -12.671 1.092 -0.576 277 HG23 THR 760 HG23 THR 760 -13.903 2.188 0.049 278 H LYS 761 HN LYS 761 -13.928 1.792 3.954 279 HA LYS 761 HA LYS 761 -14.136 4.652 3.223 280 HB2 LYS 761 HB2 LYS 761 -16.020 2.879 3.915 281 HB3 LYS 761 HB3 LYS 761 -15.597 3.524 5.488 282 HG2 LYS 761 HG2 LYS 761 -17.484 4.482 4.597 283 HG3 LYS 761 HG3 LYS 761 -16.397 5.820 4.724 284 HD2 LYS 761 HD2 LYS 761 -15.823 5.512 2.289 285 HD3 LYS 761 HD3 LYS 761 -17.092 4.286 2.218 286 HE2 LYS 761 HE2 LYS 761 -18.750 5.914 2.861 287 HE3 LYS 761 HE3 LYS 761 -17.510 7.145 3.080 288 HZ1 LYS 761 HZ1 LYS 761 -17.066 7.093 0.719 289 HZ2 LYS 761 HZ2 LYS 761 -18.720 7.337 0.978 290 HZ3 LYS 761 HZ3 LYS 761 -18.166 5.826 0.501 291 H TYR 762 HN TYR 762 -13.222 2.680 6.038 292 HA TYR 762 HA TYR 762 -12.386 5.124 7.494 293 HB2 TYR 762 HB2 TYR 762 -12.756 2.294 8.300 294 HB3 TYR 762 HB3 TYR 762 -11.980 3.480 9.336 295 HD1 TYR 762 HD1 TYR 762 -13.354 5.529 9.952 296 HD2 TYR 762 HD2 TYR 762 -15.084 2.080 8.220 297 HE1 TYR 762 HE1 TYR 762 -15.548 6.191 10.841 298 HE2 TYR 762 HE2 TYR 762 -17.308 2.727 9.165 299 HH TYR 762 HH TYR 762 -17.967 5.723 10.177 300 H ASP 763 HN ASP 763 -10.744 2.560 5.801 301 HA ASP 763 HA ASP 763 -8.335 2.611 7.240 302 HB2 ASP 763 HB2 ASP 763 -9.017 0.953 5.429 303 HB3 ASP 763 HB3 ASP 763 -8.566 2.144 4.293 304 H GLN 764 HN GLN 764 -6.338 3.530 6.693 305 HA GLN 764 HA GLN 764 -6.354 6.233 6.240 306 HB2 GLN 764 HB2 GLN 764 -4.082 4.270 6.004 307 HB3 GLN 764 HB3 GLN 764 -3.868 6.006 5.893 308 HG2 GLN 764 HG2 GLN 764 -3.257 5.336 8.099 309 HG3 GLN 764 HG3 GLN 764 -4.788 6.197 8.179 310 HE21 GLN 764 HE21 GLN 764 -6.599 5.129 8.876 311 HE22 GLN 764 HE22 GLN 764 -6.556 3.554 9.582 312 H ASP 765 HN ASP 765 -5.585 3.623 3.913 313 HA ASP 765 HA ASP 765 -5.633 5.775 1.874 314 HB2 ASP 765 HB2 ASP 765 -3.690 4.171 2.289 315 HB3 ASP 765 HB3 ASP 765 -4.639 3.019 1.371 316 H GLY 766 HN GLY 766 -7.536 3.235 3.046 317 HA2 GLY 766 HA3 GLY 766 -9.589 2.323 2.231 318 HA3 GLY 766 HA2 GLY 766 -9.581 3.769 1.225 319 H ASP 767 HN ASP 767 -6.836 1.976 0.673 320 HA ASP 767 HA ASP 767 -8.072 0.894 -1.742 321 HB2 ASP 767 HB2 ASP 767 -5.653 2.338 -1.363 322 HB3 ASP 767 HB3 ASP 767 -5.261 0.740 -1.998 323 H GLN 768 HN GLN 768 -5.387 0.121 0.413 324 HA GLN 768 HA GLN 768 -4.468 -1.879 1.088 325 HB2 GLN 768 HB2 GLN 768 -6.805 -1.235 2.262 326 HB3 GLN 768 HB3 GLN 768 -7.180 -2.865 1.831 327 HG2 GLN 768 HG2 GLN 768 -5.326 -3.667 3.025 328 HG3 GLN 768 HG3 GLN 768 -4.814 -2.014 3.387 329 HE21 GLN 768 HE21 GLN 768 -7.079 -4.501 4.144 330 HE22 GLN 768 HE22 GLN 768 -7.813 -3.681 5.479 331 H GLU 769 HN GLU 769 -3.748 -2.756 -0.827 332 HA GLU 769 HA GLU 769 -4.025 -5.214 -1.571 333 HB2 GLU 769 HB2 GLU 769 -5.566 -5.577 -3.482 334 HB3 GLU 769 HB3 GLU 769 -6.477 -4.986 -2.111 335 HG2 GLU 769 HG2 GLU 769 -6.909 -2.858 -3.213 336 HG3 GLU 769 HG3 GLU 769 -5.541 -3.146 -4.264 337 H LEU 770 HN LEU 770 -2.382 -2.638 -1.944 338 HA LEU 770 HA LEU 770 -2.014 -2.779 -4.832 339 HB2 LEU 770 HB2 LEU 770 -2.005 -0.385 -3.030 340 HB3 LEU 770 HB3 LEU 770 -0.876 -0.374 -4.327 341 HG LEU 770 HG LEU 770 -2.776 -0.551 -5.928 342 HD11 LEU 770 HD11 LEU 770 -4.137 -1.802 -4.229 343 HD12 LEU 770 HD12 LEU 770 -4.884 -0.727 -5.374 344 HD13 LEU 770 HD13 LEU 770 -4.674 -0.196 -3.684 345 HD21 LEU 770 HD21 LEU 770 -3.704 1.651 -5.533 346 HD22 LEU 770 HD22 LEU 770 -1.964 1.644 -5.242 347 HD23 LEU 770 HD23 LEU 770 -3.085 1.631 -3.881 348 H THR 771 HN THR 771 -0.025 -3.387 -5.587 349 HA THR 771 HA THR 771 1.972 -3.882 -3.586 350 HB THR 771 HB THR 771 3.063 -5.252 -5.096 351 HG1 THR 771 HG1 THR 771 2.999 -5.013 -7.166 352 HG21 THR 771 HG21 THR 771 0.175 -5.184 -5.850 353 HG22 THR 771 HG22 THR 771 1.027 -6.263 -4.728 354 HG23 THR 771 HG23 THR 771 1.285 -6.414 -6.457 355 H GLU 772 HN GLU 772 4.356 -3.343 -4.170 356 HA GLU 772 HA GLU 772 4.718 -0.583 -4.271 357 HB2 GLU 772 HB2 GLU 772 6.195 -2.445 -3.291 358 HB3 GLU 772 HB3 GLU 772 6.804 -2.710 -4.902 359 HG2 GLU 772 HG2 GLU 772 6.941 -0.046 -3.612 360 HG3 GLU 772 HG3 GLU 772 8.190 -1.264 -3.339 361 H HIS 773 HN HIS 773 4.673 -3.071 -6.732 362 HA HIS 773 HA HIS 773 5.764 -1.329 -8.711 363 HB2 HIS 773 HB2 HIS 773 4.240 -3.917 -9.123 364 HB3 HIS 773 HB3 HIS 773 5.011 -3.011 -10.396 365 HD2 HIS 773 HD2 HIS 773 7.859 -2.596 -9.838 366 HE1 HIS 773 HE1 HIS 773 8.114 -6.375 -7.946 367 HE2 HIS 773 HE2 HIS 773 9.343 -4.309 -8.597 368 H GLU 774 HN GLU 774 2.513 -2.052 -7.670 369 HA GLU 774 HA GLU 774 1.374 -0.544 -9.836 370 HB2 GLU 774 HB2 GLU 774 -0.084 -1.225 -7.232 371 HB3 GLU 774 HB3 GLU 774 -0.701 -0.782 -8.826 372 HG2 GLU 774 HG2 GLU 774 0.040 -2.799 -9.854 373 HG3 GLU 774 HG3 GLU 774 0.932 -3.240 -8.442 374 H HIS 775 HN HIS 775 2.170 0.088 -6.547 375 HA HIS 775 HA HIS 775 1.207 2.779 -6.266 376 HB2 HIS 775 HB2 HIS 775 1.673 1.243 -4.380 377 HB3 HIS 775 HB3 HIS 775 3.373 1.254 -4.802 378 HD2 HIS 775 HD2 HIS 775 4.457 2.554 -2.778 379 HE1 HIS 775 HE1 HIS 775 1.805 5.870 -2.631 380 HE2 HIS 775 HE2 HIS 775 3.667 4.664 -1.481 381 H GLN 776 HN GLN 776 4.174 1.402 -7.506 382 HA GLN 776 HA GLN 776 5.689 3.714 -7.666 383 HB2 GLN 776 HB2 GLN 776 6.584 1.452 -8.091 384 HB3 GLN 776 HB3 GLN 776 5.695 1.410 -9.609 385 HG2 GLN 776 HG2 GLN 776 6.998 3.259 -10.466 386 HG3 GLN 776 HG3 GLN 776 7.835 3.414 -8.927 387 HE21 GLN 776 HE21 GLN 776 9.391 1.897 -8.375 388 HE22 GLN 776 HE22 GLN 776 10.096 0.840 -9.529 389 H GLN 777 HN GLN 777 3.240 2.445 -9.765 390 HA GLN 777 HA GLN 777 3.621 4.473 -11.812 391 HB2 GLN 777 HB2 GLN 777 1.328 2.544 -11.542 392 HB3 GLN 777 HB3 GLN 777 1.913 3.319 -12.992 393 HG2 GLN 777 HG2 GLN 777 3.650 1.855 -13.267 394 HG3 GLN 777 HG3 GLN 777 3.734 1.466 -11.548 395 HE21 GLN 777 HE21 GLN 777 0.872 0.972 -11.261 396 HE22 GLN 777 HE22 GLN 777 0.541 -0.514 -12.021 397 H MET 778 HN MET 778 1.318 3.675 -9.272 398 HA MET 778 HA MET 778 -0.475 5.704 -10.207 399 HB2 MET 778 HB2 MET 778 -0.778 3.418 -8.362 400 HB3 MET 778 HB3 MET 778 -2.051 4.591 -8.586 401 HG2 MET 778 HG2 MET 778 -2.391 4.007 -10.832 402 HG3 MET 778 HG3 MET 778 -0.951 3.025 -10.957 403 HE1 MET 778 HE1 MET 778 -4.739 1.857 -8.550 404 HE2 MET 778 HE2 MET 778 -4.555 3.367 -9.448 405 HE3 MET 778 HE3 MET 778 -3.596 3.078 -7.995 406 H ARG 779 HN ARG 779 0.135 7.569 -9.155 407 HA ARG 779 HA ARG 779 -0.211 9.009 -7.677 408 HB2 ARG 779 HB2 ARG 779 -0.255 6.917 -5.572 409 HB3 ARG 779 HB3 ARG 779 -0.115 8.611 -5.152 410 HG2 ARG 779 HG2 ARG 779 -2.209 9.114 -6.313 411 HG3 ARG 779 HG3 ARG 779 -2.346 7.411 -6.766 412 HD2 ARG 779 HD2 ARG 779 -2.202 8.434 -3.954 413 HD3 ARG 779 HD3 ARG 779 -3.689 7.987 -4.798 414 HE ARG 779 HE ARG 779 -2.082 5.878 -5.114 415 HH11 ARG 779 HH11 ARG 779 -2.978 7.652 -2.207 416 HH12 ARG 779 HH12 ARG 779 -3.242 6.266 -1.255 417 HH21 ARG 779 HH21 ARG 779 -2.486 3.912 -3.747 418 HH22 ARG 779 HH22 ARG 779 -3.052 4.173 -2.138 419 H ASP 780 HN ASP 780 0.852 10.147 -5.996 420 HA ASP 780 HA ASP 780 3.757 9.867 -6.145 421 HB2 ASP 780 HB2 ASP 780 2.268 12.379 -7.019 422 HB3 ASP 780 HB3 ASP 780 3.988 12.174 -6.921 423 H ASP 781 HN ASP 781 3.597 9.505 -3.828 424 HA ASP 781 HA ASP 781 2.477 11.605 -2.106 425 HB2 ASP 781 HB2 ASP 781 2.426 9.161 -1.449 426 HB3 ASP 781 HB3 ASP 781 4.160 9.222 -1.212 427 H LEU 782 HN LEU 782 5.655 10.371 -2.756 428 HA LEU 782 HA LEU 782 7.000 12.358 -1.063 429 HB2 LEU 782 HB2 LEU 782 7.833 9.989 -1.680 430 HB3 LEU 782 HB3 LEU 782 8.261 10.684 -3.216 431 HG LEU 782 HG LEU 782 9.761 12.291 -2.077 432 HD11 LEU 782 HD11 LEU 782 9.159 10.617 0.349 433 HD12 LEU 782 HD12 LEU 782 8.818 12.341 0.156 434 HD13 LEU 782 HD13 LEU 782 10.477 11.767 0.206 435 HD21 LEU 782 HD21 LEU 782 10.532 10.205 -3.107 436 HD22 LEU 782 HD22 LEU 782 10.368 9.394 -1.540 437 HD23 LEU 782 HD23 LEU 782 11.501 10.735 -1.743 438 H GLU 783 HN GLU 783 5.903 12.206 -4.299 439 HA GLU 783 HA GLU 783 7.469 13.959 -5.726 440 HB2 GLU 783 HB2 GLU 783 5.559 12.931 -6.583 441 HB3 GLU 783 HB3 GLU 783 4.464 13.958 -5.668 442 HG2 GLU 783 HG2 GLU 783 5.456 15.944 -6.879 443 HG3 GLU 783 HG3 GLU 783 6.324 14.805 -7.890 444 H LYS 784 HN LYS 784 5.073 14.500 -3.153 445 HA LYS 784 HA LYS 784 5.619 17.294 -3.259 446 HB2 LYS 784 HB2 LYS 784 3.219 15.980 -3.968 447 HB3 LYS 784 HB3 LYS 784 2.923 17.328 -2.832 448 HG2 LYS 784 HG2 LYS 784 4.335 18.700 -4.374 449 HG3 LYS 784 HG3 LYS 784 4.300 17.347 -5.502 450 HD2 LYS 784 HD2 LYS 784 1.931 17.473 -5.652 451 HD3 LYS 784 HD3 LYS 784 1.904 18.681 -4.357 452 HE2 LYS 784 HE2 LYS 784 3.247 20.138 -5.681 453 HE3 LYS 784 HE3 LYS 784 3.241 19.001 -7.023 454 HZ1 LYS 784 HZ1 LYS 784 0.841 19.174 -7.162 455 HZ2 LYS 784 HZ2 LYS 784 1.521 20.703 -7.358 456 HZ3 LYS 784 HZ3 LYS 784 0.799 20.285 -5.898 457 H GLU 785 HN GLU 785 6.632 15.932 -1.389 458 HA GLU 785 HA GLU 785 5.482 17.002 1.010 459 HB2 GLU 785 HB2 GLU 785 4.338 14.822 0.882 460 HB3 GLU 785 HB3 GLU 785 5.891 13.981 0.913 461 HG2 GLU 785 HG2 GLU 785 6.265 15.031 3.195 462 HG3 GLU 785 HG3 GLU 785 4.614 15.650 3.076 463 H ARG 786 HN ARG 786 7.098 17.638 2.277 464 HA ARG 786 HA ARG 786 9.762 16.671 1.565 465 HB2 ARG 786 HB2 ARG 786 9.411 19.027 1.047 466 HB3 ARG 786 HB3 ARG 786 8.922 19.325 2.706 467 HG2 ARG 786 HG2 ARG 786 11.128 18.936 3.514 468 HG3 ARG 786 HG3 ARG 786 11.657 18.335 1.938 469 HD2 ARG 786 HD2 ARG 786 10.695 21.133 2.505 470 HD3 ARG 786 HD3 ARG 786 12.386 20.653 2.334 471 HE ARG 786 HE ARG 786 11.584 19.799 0.068 472 HH11 ARG 786 HH11 ARG 786 10.385 22.767 1.599 473 HH12 ARG 786 HH12 ARG 786 10.056 23.553 0.135 474 HH21 ARG 786 HH21 ARG 786 11.093 20.866 -1.957 475 HH22 ARG 786 HH22 ARG 786 10.448 22.436 -1.940 476 H GLU 787 HN GLU 787 10.915 15.711 3.086 477 HA GLU 787 HA GLU 787 9.792 14.985 5.507 478 HB2 GLU 787 HB2 GLU 787 12.606 14.886 4.461 479 HB3 GLU 787 HB3 GLU 787 12.142 14.201 6.013 480 HG2 GLU 787 HG2 GLU 787 10.848 13.433 3.422 481 HG3 GLU 787 HG3 GLU 787 12.243 12.589 4.103 482 H ASP 788 HN ASP 788 10.538 15.523 7.624 483 HA ASP 788 HA ASP 788 11.261 18.304 7.933 484 HB2 ASP 788 HB2 ASP 788 9.529 17.498 9.348 485 HB3 ASP 788 HB3 ASP 788 10.510 16.143 9.930 486 H LEU 789 HN LEU 789 13.047 18.785 9.574 487 HA LEU 789 HA LEU 789 15.322 17.158 8.818 488 HB2 LEU 789 HB2 LEU 789 15.082 19.730 8.881 489 HB3 LEU 789 HB3 LEU 789 15.409 19.562 10.586 490 HG LEU 789 HG LEU 789 17.592 18.411 10.049 491 HD11 LEU 789 HD11 LEU 789 16.929 19.199 7.233 492 HD12 LEU 789 HD12 LEU 789 17.081 17.555 7.851 493 HD13 LEU 789 HD13 LEU 789 18.485 18.616 7.804 494 HD21 LEU 789 HD21 LEU 789 18.757 20.346 9.393 495 HD22 LEU 789 HD22 LEU 789 17.502 20.802 10.557 496 HD23 LEU 789 HD23 LEU 789 17.285 21.137 8.831 497 H ASP 790 HN ASP 790 14.989 15.414 9.914 498 HA ASP 790 HA ASP 790 14.295 15.380 12.774 499 HB2 ASP 790 HB2 ASP 790 13.386 13.876 10.696 500 HB3 ASP 790 HB3 ASP 790 14.726 12.876 11.250 501 H LEU 791 HN LEU 791 15.570 14.035 14.239 502 HA LEU 791 HA LEU 791 18.376 14.041 13.412 503 HB2 LEU 791 HB2 LEU 791 17.642 15.520 15.338 504 HB3 LEU 791 HB3 LEU 791 17.340 14.116 16.286 505 HG LEU 791 HG LEU 791 19.958 15.167 15.281 506 HD11 LEU 791 HD11 LEU 791 19.138 16.379 17.133 507 HD12 LEU 791 HD12 LEU 791 20.431 15.307 17.707 508 HD13 LEU 791 HD13 LEU 791 18.749 14.892 18.002 509 HD21 LEU 791 HD21 LEU 791 19.456 12.561 16.736 510 HD22 LEU 791 HD22 LEU 791 20.989 13.405 16.774 511 HD23 LEU 791 HD23 LEU 791 20.386 12.813 15.240 512 H ASP 792 HN ASP 792 16.030 12.176 15.155 513 HA ASP 792 HA ASP 792 17.430 9.738 14.292 514 HB2 ASP 792 HB2 ASP 792 18.605 10.289 16.266 515 HB3 ASP 792 HB3 ASP 792 17.137 10.350 17.219 516 H HIS 793 HN HIS 793 15.151 10.362 16.819 517 HA HIS 793 HA HIS 793 12.953 8.735 15.495 518 HB2 HIS 793 HB2 HIS 793 14.399 7.537 17.272 519 HB3 HIS 793 HB3 HIS 793 13.671 8.573 18.466 520 HD2 HIS 793 HD2 HIS 793 12.694 5.642 16.068 521 HE1 HIS 793 HE1 HIS 793 9.601 6.128 18.914 522 HE2 HIS 793 HE2 HIS 793 10.304 5.070 16.755 523 H SER 794 HN SER 794 11.522 9.222 18.074 524 HA SER 794 HA SER 794 10.892 12.138 17.956 525 HB2 SER 794 HB2 SER 794 8.765 9.980 17.595 526 HB3 SER 794 HB3 SER 794 8.608 11.714 17.431 527 HG SER 794 HG SER 794 9.981 11.617 15.651 528 H SER 795 HN SER 795 12.200 10.856 19.894 529 HA SER 795 HA SER 795 10.315 10.079 21.808 530 HB2 SER 795 HB2 SER 795 12.464 8.941 21.829 531 HB3 SER 795 HB3 SER 795 13.300 10.470 22.102 532 HG SER 795 HG SER 795 13.079 9.392 24.026 533 H LEU 796 HN LEU 796 9.120 11.881 22.503 534 HA LEU 796 HA LEU 796 10.635 14.069 23.704 535 HB2 LEU 796 HB2 LEU 796 9.701 14.825 21.469 536 HB3 LEU 796 HB3 LEU 796 8.092 14.473 22.052 537 HG LEU 796 HG LEU 796 8.413 16.167 23.842 538 HD11 LEU 796 HD11 LEU 796 10.189 17.818 23.574 539 HD12 LEU 796 HD12 LEU 796 10.889 16.855 22.273 540 HD13 LEU 796 HD13 LEU 796 10.840 16.214 23.913 541 HD21 LEU 796 HD21 LEU 796 8.085 18.079 22.342 542 HD22 LEU 796 HD22 LEU 796 7.169 16.669 21.817 543 HD23 LEU 796 HD23 LEU 796 8.663 17.110 20.987 Start of MODEL 4 1 HA ASP 724 HA ASP 724 4.685 1.888 9.659 2 HB2 ASP 724 HB2 ASP 724 3.614 3.897 10.517 3 HB3 ASP 724 HB3 ASP 724 4.957 4.169 11.609 4 H ILE 725 HN ILE 725 6.329 1.973 12.794 5 HA ILE 725 HA ILE 725 8.731 2.815 11.680 6 HB ILE 725 HB ILE 725 8.168 1.680 14.426 7 HG12 ILE 725 HG12 ILE 725 8.818 4.081 15.099 8 HG13 ILE 725 HG13 ILE 725 8.708 4.449 13.386 9 HG21 ILE 725 HG21 ILE 725 10.476 1.105 13.896 10 HG22 ILE 725 HG22 ILE 725 10.422 2.370 15.120 11 HG23 ILE 725 HG23 ILE 725 10.805 2.780 13.452 12 HD11 ILE 725 HD11 ILE 725 6.459 3.438 15.109 13 HD12 ILE 725 HD12 ILE 725 6.350 3.859 13.400 14 HD13 ILE 725 HD13 ILE 725 6.696 5.106 14.594 15 H SER 726 HN SER 726 7.847 -0.360 12.845 16 HA SER 726 HA SER 726 10.315 -1.327 11.566 17 HB2 SER 726 HB2 SER 726 8.567 -2.820 13.533 18 HB3 SER 726 HB3 SER 726 10.156 -3.298 12.953 19 HG SER 726 HG SER 726 9.604 -1.835 15.034 20 H GLU 727 HN GLU 727 6.973 -2.401 12.106 21 HA GLU 727 HA GLU 727 5.588 -3.517 11.096 22 HB2 GLU 727 HB2 GLU 727 6.826 -2.477 8.544 23 HB3 GLU 727 HB3 GLU 727 5.216 -3.189 8.703 24 HG2 GLU 727 HG2 GLU 727 4.645 -1.422 10.342 25 HG3 GLU 727 HG3 GLU 727 6.196 -0.664 10.009 26 H SER 728 HN SER 728 5.330 -5.197 9.116 27 HA SER 728 HA SER 728 6.495 -7.493 10.244 28 HB2 SER 728 HB2 SER 728 5.349 -8.537 8.154 29 HB3 SER 728 HB3 SER 728 4.369 -7.811 9.436 30 HG SER 728 HG SER 728 4.006 -6.033 8.220 31 H LEU 729 HN LEU 729 7.171 -6.626 6.846 32 HA LEU 729 HA LEU 729 9.805 -7.157 6.783 33 HB2 LEU 729 HB2 LEU 729 9.274 -9.399 7.762 34 HB3 LEU 729 HB3 LEU 729 8.264 -9.758 6.386 35 HG LEU 729 HG LEU 729 10.290 -9.654 4.942 36 HD11 LEU 729 HD11 LEU 729 12.487 -9.714 6.003 37 HD12 LEU 729 HD12 LEU 729 11.738 -9.401 7.569 38 HD13 LEU 729 HD13 LEU 729 11.657 -8.188 6.290 39 HD21 LEU 729 HD21 LEU 729 11.226 -11.780 5.710 40 HD22 LEU 729 HD22 LEU 729 9.462 -11.778 5.773 41 HD23 LEU 729 HD23 LEU 729 10.401 -11.583 7.255 42 H ARG 730 HN ARG 730 7.659 -9.172 4.829 43 HA ARG 730 HA ARG 730 8.377 -7.654 2.622 44 HB2 ARG 730 HB2 ARG 730 6.412 -9.011 1.517 45 HB3 ARG 730 HB3 ARG 730 8.034 -9.691 1.683 46 HG2 ARG 730 HG2 ARG 730 7.193 -10.835 3.738 47 HG3 ARG 730 HG3 ARG 730 5.580 -10.195 3.393 48 HD2 ARG 730 HD2 ARG 730 5.793 -12.475 2.544 49 HD3 ARG 730 HD3 ARG 730 5.609 -11.312 1.227 50 HE ARG 730 HE ARG 730 8.330 -11.721 1.654 51 HH11 ARG 730 HH11 ARG 730 5.529 -13.589 0.549 52 HH12 ARG 730 HH12 ARG 730 6.416 -14.464 -0.619 53 HH21 ARG 730 HH21 ARG 730 9.508 -12.932 0.045 54 HH22 ARG 730 HH22 ARG 730 8.697 -14.132 -0.867 55 H GLN 731 HN GLN 731 5.276 -8.034 4.204 56 HA GLN 731 HA GLN 731 3.815 -6.142 2.759 57 HB2 GLN 731 HB2 GLN 731 2.663 -7.678 4.159 58 HB3 GLN 731 HB3 GLN 731 3.640 -7.244 5.544 59 HG2 GLN 731 HG2 GLN 731 1.328 -6.477 5.675 60 HG3 GLN 731 HG3 GLN 731 2.492 -5.153 5.791 61 HE21 GLN 731 HE21 GLN 731 1.432 -6.786 2.876 62 HE22 GLN 731 HE22 GLN 731 0.755 -5.369 2.126 63 H GLY 732 HN GLY 732 5.502 -5.908 5.795 64 HA2 GLY 732 HA3 GLY 732 5.036 -3.151 6.217 65 HA3 GLY 732 HA2 GLY 732 6.234 -4.123 7.048 66 H GLY 733 HN GLY 733 7.225 -4.709 4.145 67 HA2 GLY 733 HA3 GLY 733 8.649 -2.203 3.856 68 HA3 GLY 733 HA2 GLY 733 9.557 -3.702 3.950 69 H GLY 734 HN GLY 734 6.636 -2.731 2.222 70 HA2 GLY 734 HA3 GLY 734 7.986 -2.802 -0.181 71 HA3 GLY 734 HA2 GLY 734 7.200 -4.348 0.018 72 H LYS 735 HN LYS 735 4.818 -4.024 0.858 73 HA LYS 735 HA LYS 735 3.553 -1.870 -0.538 74 HB2 LYS 735 HB2 LYS 735 2.446 -3.043 -2.152 75 HB3 LYS 735 HB3 LYS 735 4.101 -3.612 -2.264 76 HG2 LYS 735 HG2 LYS 735 1.725 -5.131 -1.138 77 HG3 LYS 735 HG3 LYS 735 2.522 -5.439 -2.654 78 HD2 LYS 735 HD2 LYS 735 4.636 -5.860 -1.143 79 HD3 LYS 735 HD3 LYS 735 3.431 -6.029 0.108 80 HE2 LYS 735 HE2 LYS 735 2.245 -7.767 -1.077 81 HE3 LYS 735 HE3 LYS 735 3.259 -7.554 -2.479 82 HZ1 LYS 735 HZ1 LYS 735 4.271 -8.537 0.142 83 HZ2 LYS 735 HZ2 LYS 735 5.130 -8.394 -1.308 84 HZ3 LYS 735 HZ3 LYS 735 3.884 -9.499 -1.181 85 H LEU 736 HN LEU 736 1.097 -2.054 -0.301 86 HA LEU 736 HA LEU 736 0.393 -3.683 2.075 87 HB2 LEU 736 HB2 LEU 736 -1.120 -1.158 1.686 88 HB3 LEU 736 HB3 LEU 736 -0.953 -2.140 3.068 89 HG LEU 736 HG LEU 736 1.566 -1.363 3.067 90 HD11 LEU 736 HD11 LEU 736 0.203 1.043 1.902 91 HD12 LEU 736 HD12 LEU 736 1.285 -0.022 0.986 92 HD13 LEU 736 HD13 LEU 736 1.903 0.892 2.362 93 HD21 LEU 736 HD21 LEU 736 0.953 0.359 4.674 94 HD22 LEU 736 HD22 LEU 736 -0.038 -1.081 4.883 95 HD23 LEU 736 HD23 LEU 736 -0.704 0.339 4.080 96 H ASN 737 HN ASN 737 -1.346 -4.924 1.909 97 HA ASN 737 HA ASN 737 -3.194 -4.462 -0.304 98 HB2 ASN 737 HB2 ASN 737 -1.998 -7.262 0.123 99 HB3 ASN 737 HB3 ASN 737 -2.977 -6.824 -1.200 100 HD21 ASN 737 HD21 ASN 737 -1.220 -4.303 -1.592 101 HD22 ASN 737 HD22 ASN 737 0.119 -4.958 -2.417 102 H PHE 738 HN PHE 738 -5.331 -5.503 0.155 103 HA PHE 738 HA PHE 738 -6.064 -5.594 2.878 104 HB2 PHE 738 HB2 PHE 738 -7.685 -5.648 1.006 105 HB3 PHE 738 HB3 PHE 738 -7.018 -7.245 0.627 106 HD1 PHE 738 HD2 PHE 738 -8.411 -5.573 3.631 107 HD2 PHE 738 HD1 PHE 738 -8.340 -8.984 1.148 108 HE1 PHE 738 HE2 PHE 738 -10.040 -6.647 5.091 109 HE2 PHE 738 HE1 PHE 738 -9.997 -10.089 2.619 110 HZ PHE 738 HZ PHE 738 -10.834 -8.907 4.589 111 H ASP 739 HN ASP 739 -5.419 -8.462 0.874 112 HA ASP 739 HA ASP 739 -5.342 -10.277 3.058 113 HB2 ASP 739 HB2 ASP 739 -5.396 -10.558 0.305 114 HB3 ASP 739 HB3 ASP 739 -3.803 -11.051 0.662 115 H GLU 740 HN GLU 740 -2.892 -8.285 1.555 116 HA GLU 740 HA GLU 740 -0.810 -9.831 2.898 117 HB2 GLU 740 HB2 GLU 740 -0.708 -8.920 0.470 118 HB3 GLU 740 HB3 GLU 740 -0.342 -7.373 1.229 119 HG2 GLU 740 HG2 GLU 740 1.786 -8.253 0.710 120 HG3 GLU 740 HG3 GLU 740 1.577 -8.535 2.438 121 H LEU 741 HN LEU 741 -2.428 -6.711 3.053 122 HA LEU 741 HA LEU 741 -0.803 -5.327 4.782 123 HB2 LEU 741 HB2 LEU 741 -2.597 -4.243 3.864 124 HB3 LEU 741 HB3 LEU 741 -3.823 -5.318 4.489 125 HG LEU 741 HG LEU 741 -2.677 -4.352 6.763 126 HD11 LEU 741 HD11 LEU 741 -2.295 -1.977 6.540 127 HD12 LEU 741 HD12 LEU 741 -2.454 -2.108 4.792 128 HD13 LEU 741 HD13 LEU 741 -1.117 -2.903 5.615 129 HD21 LEU 741 HD21 LEU 741 -4.992 -4.383 6.389 130 HD22 LEU 741 HD22 LEU 741 -4.853 -3.213 5.113 131 HD23 LEU 741 HD23 LEU 741 -4.544 -2.724 6.783 132 H ARG 742 HN ARG 742 -3.020 -7.971 5.219 133 HA ARG 742 HA ARG 742 -3.386 -7.963 8.030 134 HB2 ARG 742 HB2 ARG 742 -2.981 -10.604 6.724 135 HB3 ARG 742 HB3 ARG 742 -4.133 -10.073 7.896 136 HG2 ARG 742 HG2 ARG 742 -4.265 -9.139 5.148 137 HG3 ARG 742 HG3 ARG 742 -5.014 -10.685 5.606 138 HD2 ARG 742 HD2 ARG 742 -5.872 -8.637 7.449 139 HD3 ARG 742 HD3 ARG 742 -5.958 -7.997 5.837 140 HE ARG 742 HE ARG 742 -7.246 -9.927 5.160 141 HH11 ARG 742 HH11 ARG 742 -7.158 -9.196 8.591 142 HH12 ARG 742 HH12 ARG 742 -8.660 -9.942 8.929 143 HH21 ARG 742 HH21 ARG 742 -9.312 -10.989 5.640 144 HH22 ARG 742 HH22 ARG 742 -9.891 -10.948 7.225 145 H GLN 743 HN GLN 743 -0.756 -9.045 6.039 146 HA GLN 743 HA GLN 743 0.670 -10.462 7.912 147 HB2 GLN 743 HB2 GLN 743 1.199 -9.429 5.415 148 HB3 GLN 743 HB3 GLN 743 2.310 -8.598 6.458 149 HG2 GLN 743 HG2 GLN 743 3.689 -10.385 6.738 150 HG3 GLN 743 HG3 GLN 743 2.321 -11.474 6.966 151 HE21 GLN 743 HE21 GLN 743 1.067 -10.862 4.531 152 HE22 GLN 743 HE22 GLN 743 1.962 -11.566 3.265 153 H ASP 744 HN ASP 744 0.174 -7.168 7.504 154 HA ASP 744 HA ASP 744 1.952 -6.344 9.563 155 HB2 ASP 744 HB2 ASP 744 0.749 -5.021 7.505 156 HB3 ASP 744 HB3 ASP 744 -0.010 -4.398 8.940 157 H LEU 745 HN LEU 745 -1.535 -6.464 9.203 158 HA LEU 745 HA LEU 745 -1.806 -6.265 12.081 159 HB2 LEU 745 HB2 LEU 745 -4.195 -5.517 11.319 160 HB3 LEU 745 HB3 LEU 745 -2.888 -4.364 11.525 161 HG LEU 745 HG LEU 745 -2.547 -4.826 8.950 162 HD11 LEU 745 HD11 LEU 745 -4.376 -6.663 9.119 163 HD12 LEU 745 HD12 LEU 745 -4.340 -5.570 7.762 164 HD13 LEU 745 HD13 LEU 745 -5.504 -5.284 9.017 165 HD21 LEU 745 HD21 LEU 745 -4.546 -3.115 10.363 166 HD22 LEU 745 HD22 LEU 745 -4.450 -3.058 8.628 167 HD23 LEU 745 HD23 LEU 745 -3.025 -2.667 9.581 168 H LYS 746 HN LYS 746 -1.382 -8.757 10.957 169 HA LYS 746 HA LYS 746 -3.498 -10.274 10.258 170 HB2 LYS 746 HB2 LYS 746 -0.982 -11.097 11.655 171 HB3 LYS 746 HB3 LYS 746 -2.202 -12.330 11.332 172 HG2 LYS 746 HG2 LYS 746 -1.804 -11.238 8.826 173 HG3 LYS 746 HG3 LYS 746 -0.319 -10.880 9.617 174 HD2 LYS 746 HD2 LYS 746 0.190 -13.115 10.213 175 HD3 LYS 746 HD3 LYS 746 -1.368 -13.686 9.614 176 HE2 LYS 746 HE2 LYS 746 -0.767 -13.030 7.353 177 HE3 LYS 746 HE3 LYS 746 0.766 -12.380 7.931 178 HZ1 LYS 746 HZ1 LYS 746 0.977 -14.554 6.925 179 HZ2 LYS 746 HZ2 LYS 746 -0.024 -15.232 8.095 180 HZ3 LYS 746 HZ3 LYS 746 1.465 -14.557 8.529 181 H GLY 747 HN GLY 747 -5.410 -10.196 11.279 182 HA2 GLY 747 HA3 GLY 747 -6.771 -11.575 12.710 183 HA3 GLY 747 HA2 GLY 747 -5.458 -11.563 13.866 184 H LYS 748 HN LYS 748 -8.078 -9.751 12.533 185 HA LYS 748 HA LYS 748 -8.209 -8.398 15.018 186 HB2 LYS 748 HB2 LYS 748 -7.940 -6.161 14.442 187 HB3 LYS 748 HB3 LYS 748 -6.656 -6.993 13.571 188 HG2 LYS 748 HG2 LYS 748 -9.272 -6.283 12.249 189 HG3 LYS 748 HG3 LYS 748 -7.789 -5.234 12.284 190 HD2 LYS 748 HD2 LYS 748 -6.851 -6.494 10.856 191 HD3 LYS 748 HD3 LYS 748 -7.739 -7.987 11.246 192 HE2 LYS 748 HE2 LYS 748 -8.634 -7.043 9.236 193 HE3 LYS 748 HE3 LYS 748 -9.712 -6.783 10.532 194 HZ1 LYS 748 HZ1 LYS 748 -7.816 -4.605 9.757 195 HZ2 LYS 748 HZ2 LYS 748 -9.072 -4.529 10.872 196 HZ3 LYS 748 HZ3 LYS 748 -9.414 -4.673 9.267 197 H GLY 749 HN GLY 749 -9.600 -9.063 11.973 198 HA2 GLY 749 HA3 GLY 749 -12.135 -8.027 12.936 199 HA3 GLY 749 HA2 GLY 749 -11.670 -8.108 11.253 200 H HIS 750 HN HIS 750 -13.919 -9.331 11.618 201 HA HIS 750 HA HIS 750 -13.414 -12.088 12.387 202 HB2 HIS 750 HB2 HIS 750 -15.985 -10.647 11.808 203 HB3 HIS 750 HB3 HIS 750 -15.921 -12.398 11.980 204 HD2 HIS 750 HD2 HIS 750 -15.575 -9.150 14.165 205 HE1 HIS 750 HE1 HIS 750 -15.795 -12.472 16.768 206 HE2 HIS 750 HE2 HIS 750 -16.037 -10.005 16.548 207 H THR 751 HN THR 751 -15.423 -10.941 9.699 208 HA THR 751 HA THR 751 -14.031 -12.969 8.121 209 HB THR 751 HB THR 751 -15.919 -12.517 6.455 210 HG1 THR 751 HG1 THR 751 -17.070 -11.275 8.710 211 HG21 THR 751 HG21 THR 751 -16.101 -14.029 8.976 212 HG22 THR 751 HG22 THR 751 -15.912 -14.630 7.326 213 HG23 THR 751 HG23 THR 751 -17.478 -14.015 7.876 214 H ASP 752 HN ASP 752 -13.382 -12.588 6.000 215 HA ASP 752 HA ASP 752 -11.871 -10.263 5.655 216 HB2 ASP 752 HB2 ASP 752 -12.936 -12.190 3.606 217 HB3 ASP 752 HB3 ASP 752 -11.837 -10.882 3.193 218 H ALA 753 HN ALA 753 -15.155 -11.002 4.684 219 HA ALA 753 HA ALA 753 -15.556 -8.824 2.988 220 HB1 ALA 753 HB1 ALA 753 -17.656 -10.207 4.642 221 HB2 ALA 753 HB2 ALA 753 -17.062 -10.749 3.088 222 HB3 ALA 753 HB3 ALA 753 -17.943 -9.226 3.207 223 H GLU 754 HN GLU 754 -16.105 -9.096 6.394 224 HA GLU 754 HA GLU 754 -17.205 -6.564 6.878 225 HB2 GLU 754 HB2 GLU 754 -15.730 -8.620 8.402 226 HB3 GLU 754 HB3 GLU 754 -16.028 -7.095 9.203 227 HG2 GLU 754 HG2 GLU 754 -18.431 -7.585 8.960 228 HG3 GLU 754 HG3 GLU 754 -18.044 -9.050 8.057 229 H ILE 755 HN ILE 755 -13.934 -7.694 6.889 230 HA ILE 755 HA ILE 755 -12.773 -5.217 7.797 231 HB ILE 755 HB ILE 755 -11.422 -7.608 6.523 232 HG12 ILE 755 HG12 ILE 755 -11.938 -6.919 9.395 233 HG13 ILE 755 HG13 ILE 755 -12.928 -8.060 8.491 234 HG21 ILE 755 HG21 ILE 755 -9.492 -6.751 7.130 235 HG22 ILE 755 HG22 ILE 755 -10.181 -6.018 8.520 236 HG23 ILE 755 HG23 ILE 755 -10.258 -5.155 7.008 237 HD11 ILE 755 HD11 ILE 755 -10.013 -8.257 8.892 238 HD12 ILE 755 HD12 ILE 755 -11.052 -9.435 8.155 239 HD13 ILE 755 HD13 ILE 755 -11.183 -9.163 9.864 240 H GLU 756 HN GLU 756 -13.111 -6.863 4.775 241 HA GLU 756 HA GLU 756 -11.560 -5.213 3.237 242 HB2 GLU 756 HB2 GLU 756 -12.430 -7.441 2.530 243 HB3 GLU 756 HB3 GLU 756 -14.020 -6.698 2.316 244 HG2 GLU 756 HG2 GLU 756 -12.689 -5.120 0.682 245 HG3 GLU 756 HG3 GLU 756 -11.560 -6.465 0.674 246 H ALA 757 HN ALA 757 -15.012 -5.092 3.868 247 HA ALA 757 HA ALA 757 -15.622 -2.750 2.363 248 HB1 ALA 757 HB1 ALA 757 -17.044 -4.243 4.538 249 HB2 ALA 757 HB2 ALA 757 -17.456 -4.050 2.811 250 HB3 ALA 757 HB3 ALA 757 -17.658 -2.709 3.919 251 H ILE 758 HN ILE 758 -15.010 -3.278 5.819 252 HA ILE 758 HA ILE 758 -15.648 -0.759 6.709 253 HB ILE 758 HB ILE 758 -15.350 -2.720 8.203 254 HG12 ILE 758 HG12 ILE 758 -15.298 -0.262 9.014 255 HG13 ILE 758 HG13 ILE 758 -14.827 -1.534 10.143 256 HG21 ILE 758 HG21 ILE 758 -13.150 -3.485 7.292 257 HG22 ILE 758 HG22 ILE 758 -13.229 -3.436 9.052 258 HG23 ILE 758 HG23 ILE 758 -12.398 -2.155 8.171 259 HD11 ILE 758 HD11 ILE 758 -13.387 0.424 10.312 260 HD12 ILE 758 HD12 ILE 758 -12.935 0.237 8.607 261 HD13 ILE 758 HD13 ILE 758 -12.488 -0.993 9.778 262 H PHE 759 HN PHE 759 -12.535 -2.051 5.627 263 HA PHE 759 HA PHE 759 -11.047 0.192 6.335 264 HB2 PHE 759 HB2 PHE 759 -9.167 -0.932 5.394 265 HB3 PHE 759 HB3 PHE 759 -10.281 -2.216 5.729 266 HD1 PHE 759 HD2 PHE 759 -9.528 0.035 2.772 267 HD2 PHE 759 HD1 PHE 759 -10.427 -3.867 4.179 268 HE1 PHE 759 HE2 PHE 759 -9.373 -0.808 0.498 269 HE2 PHE 759 HE1 PHE 759 -10.224 -4.719 1.855 270 HZ PHE 759 HZ PHE 759 -9.711 -3.189 0.034 271 H THR 760 HN THR 760 -12.971 -0.497 3.594 272 HA THR 760 HA THR 760 -11.718 1.205 1.733 273 HB THR 760 HB THR 760 -14.635 0.351 1.878 274 HG1 THR 760 HG1 THR 760 -13.376 -1.523 1.666 275 HG21 THR 760 HG21 THR 760 -14.155 2.277 0.347 276 HG22 THR 760 HG22 THR 760 -14.772 0.841 -0.441 277 HG23 THR 760 HG23 THR 760 -13.045 1.226 -0.548 278 H LYS 761 HN LYS 761 -14.104 1.659 4.180 279 HA LYS 761 HA LYS 761 -14.331 4.498 3.488 280 HB2 LYS 761 HB2 LYS 761 -16.339 2.976 4.152 281 HB3 LYS 761 HB3 LYS 761 -15.799 3.249 5.785 282 HG2 LYS 761 HG2 LYS 761 -16.204 5.695 5.599 283 HG3 LYS 761 HG3 LYS 761 -16.502 5.472 3.894 284 HD2 LYS 761 HD2 LYS 761 -18.517 4.220 4.389 285 HD3 LYS 761 HD3 LYS 761 -18.222 4.334 6.118 286 HE2 LYS 761 HE2 LYS 761 -18.639 6.664 4.263 287 HE3 LYS 761 HE3 LYS 761 -19.856 5.978 5.329 288 HZ1 LYS 761 HZ1 LYS 761 -17.319 7.281 6.203 289 HZ2 LYS 761 HZ2 LYS 761 -18.485 6.610 7.222 290 HZ3 LYS 761 HZ3 LYS 761 -18.873 7.932 6.274 291 H TYR 762 HN TYR 762 -13.203 2.507 6.249 292 HA TYR 762 HA TYR 762 -12.445 4.933 7.639 293 HB2 TYR 762 HB2 TYR 762 -13.051 2.201 8.464 294 HB3 TYR 762 HB3 TYR 762 -11.819 3.033 9.405 295 HD1 TYR 762 HD1 TYR 762 -15.388 3.114 8.371 296 HD2 TYR 762 HD2 TYR 762 -12.360 4.808 10.812 297 HE1 TYR 762 HE1 TYR 762 -17.110 4.325 9.690 298 HE2 TYR 762 HE2 TYR 762 -14.043 5.999 12.106 299 HH TYR 762 HH TYR 762 -17.346 5.324 11.886 300 H ASP 763 HN ASP 763 -10.812 2.420 5.858 301 HA ASP 763 HA ASP 763 -8.344 2.479 7.220 302 HB2 ASP 763 HB2 ASP 763 -9.085 0.820 5.401 303 HB3 ASP 763 HB3 ASP 763 -8.665 2.028 4.272 304 H GLN 764 HN GLN 764 -6.381 3.433 6.596 305 HA GLN 764 HA GLN 764 -6.439 6.163 6.142 306 HB2 GLN 764 HB2 GLN 764 -4.129 4.284 5.648 307 HB3 GLN 764 HB3 GLN 764 -4.014 6.029 5.786 308 HG2 GLN 764 HG2 GLN 764 -4.749 4.077 7.957 309 HG3 GLN 764 HG3 GLN 764 -3.274 5.035 7.835 310 HE21 GLN 764 HE21 GLN 764 -6.569 4.988 8.719 311 HE22 GLN 764 HE22 GLN 764 -6.666 6.553 9.407 312 H ASP 765 HN ASP 765 -5.759 3.532 3.785 313 HA ASP 765 HA ASP 765 -5.800 5.627 1.694 314 HB2 ASP 765 HB2 ASP 765 -3.923 3.943 2.218 315 HB3 ASP 765 HB3 ASP 765 -4.886 2.817 1.302 316 H GLY 766 HN GLY 766 -7.735 3.161 2.992 317 HA2 GLY 766 HA3 GLY 766 -9.782 2.219 2.236 318 HA3 GLY 766 HA2 GLY 766 -9.819 3.669 1.223 319 H ASP 767 HN ASP 767 -7.114 1.877 0.566 320 HA ASP 767 HA ASP 767 -8.430 0.731 -1.762 321 HB2 ASP 767 HB2 ASP 767 -6.008 2.269 -1.528 322 HB3 ASP 767 HB3 ASP 767 -5.729 0.729 -2.348 323 H GLN 768 HN GLN 768 -5.556 0.106 0.253 324 HA GLN 768 HA GLN 768 -4.574 -1.894 0.966 325 HB2 GLN 768 HB2 GLN 768 -7.096 -1.443 1.988 326 HB3 GLN 768 HB3 GLN 768 -7.119 -3.128 1.501 327 HG2 GLN 768 HG2 GLN 768 -5.319 -3.642 2.891 328 HG3 GLN 768 HG3 GLN 768 -5.025 -1.940 3.241 329 HE21 GLN 768 HE21 GLN 768 -7.033 -4.686 3.974 330 HE22 GLN 768 HE22 GLN 768 -7.905 -3.905 5.230 331 H GLU 769 HN GLU 769 -3.777 -2.768 -0.923 332 HA GLU 769 HA GLU 769 -3.907 -5.221 -1.612 333 HB2 GLU 769 HB2 GLU 769 -5.448 -5.800 -3.501 334 HB3 GLU 769 HB3 GLU 769 -6.371 -5.222 -2.147 335 HG2 GLU 769 HG2 GLU 769 -7.446 -4.434 -4.016 336 HG3 GLU 769 HG3 GLU 769 -6.609 -3.018 -3.450 337 H LEU 770 HN LEU 770 -2.423 -2.594 -1.986 338 HA LEU 770 HA LEU 770 -1.985 -2.658 -4.861 339 HB2 LEU 770 HB2 LEU 770 -1.859 -0.361 -2.921 340 HB3 LEU 770 HB3 LEU 770 -0.848 -0.300 -4.329 341 HG LEU 770 HG LEU 770 -3.027 -0.403 -5.633 342 HD11 LEU 770 HD11 LEU 770 -4.127 -0.326 -2.861 343 HD12 LEU 770 HD12 LEU 770 -4.637 -1.364 -4.223 344 HD13 LEU 770 HD13 LEU 770 -4.989 0.344 -4.226 345 HD21 LEU 770 HD21 LEU 770 -3.603 1.906 -5.171 346 HD22 LEU 770 HD22 LEU 770 -1.854 1.682 -5.208 347 HD23 LEU 770 HD23 LEU 770 -2.691 1.842 -3.663 348 H THR 771 HN THR 771 0.010 -3.369 -5.625 349 HA THR 771 HA THR 771 1.975 -3.886 -3.646 350 HB THR 771 HB THR 771 3.070 -5.265 -5.204 351 HG1 THR 771 HG1 THR 771 3.073 -5.000 -7.179 352 HG21 THR 771 HG21 THR 771 0.165 -5.261 -5.863 353 HG22 THR 771 HG22 THR 771 1.025 -6.185 -4.634 354 HG23 THR 771 HG23 THR 771 1.287 -6.547 -6.341 355 H GLU 772 HN GLU 772 4.411 -3.359 -4.220 356 HA GLU 772 HA GLU 772 4.812 -0.621 -4.315 357 HB2 GLU 772 HB2 GLU 772 6.330 -2.444 -3.386 358 HB3 GLU 772 HB3 GLU 772 6.842 -2.791 -5.012 359 HG2 GLU 772 HG2 GLU 772 7.135 -0.085 -3.810 360 HG3 GLU 772 HG3 GLU 772 8.366 -1.334 -3.633 361 H HIS 773 HN HIS 773 4.680 -3.098 -6.786 362 HA HIS 773 HA HIS 773 5.780 -1.400 -8.821 363 HB2 HIS 773 HB2 HIS 773 4.083 -3.883 -9.227 364 HB3 HIS 773 HB3 HIS 773 4.884 -2.981 -10.477 365 HD2 HIS 773 HD2 HIS 773 7.744 -2.828 -10.112 366 HE1 HIS 773 HE1 HIS 773 7.865 -6.643 -8.260 367 HE2 HIS 773 HE2 HIS 773 9.213 -4.692 -9.062 368 H GLU 774 HN GLU 774 2.538 -1.965 -7.661 369 HA GLU 774 HA GLU 774 1.387 -0.400 -9.806 370 HB2 GLU 774 HB2 GLU 774 -0.005 -0.945 -7.137 371 HB3 GLU 774 HB3 GLU 774 -0.624 -0.480 -8.733 372 HG2 GLU 774 HG2 GLU 774 -0.185 -2.515 -9.708 373 HG3 GLU 774 HG3 GLU 774 0.823 -3.038 -8.384 374 H HIS 775 HN HIS 775 2.268 0.178 -6.523 375 HA HIS 775 HA HIS 775 1.407 2.887 -6.165 376 HB2 HIS 775 HB2 HIS 775 1.903 1.335 -4.326 377 HB3 HIS 775 HB3 HIS 775 3.567 1.240 -4.870 378 HD2 HIS 775 HD2 HIS 775 4.849 2.368 -2.827 379 HE1 HIS 775 HE1 HIS 775 2.543 5.920 -2.508 380 HE2 HIS 775 HE2 HIS 775 4.309 4.484 -1.449 381 H GLN 776 HN GLN 776 4.280 1.433 -7.493 382 HA GLN 776 HA GLN 776 5.994 3.575 -7.575 383 HB2 GLN 776 HB2 GLN 776 6.383 1.107 -8.062 384 HB3 GLN 776 HB3 GLN 776 5.751 1.414 -9.658 385 HG2 GLN 776 HG2 GLN 776 8.243 2.674 -8.510 386 HG3 GLN 776 HG3 GLN 776 8.228 1.255 -9.538 387 HE21 GLN 776 HE21 GLN 776 7.564 1.535 -11.715 388 HE22 GLN 776 HE22 GLN 776 7.762 3.076 -12.483 389 H GLN 777 HN GLN 777 3.412 2.627 -9.680 390 HA GLN 777 HA GLN 777 4.187 4.455 -11.780 391 HB2 GLN 777 HB2 GLN 777 1.679 2.777 -11.613 392 HB3 GLN 777 HB3 GLN 777 2.401 3.471 -13.047 393 HG2 GLN 777 HG2 GLN 777 4.015 1.888 -13.222 394 HG3 GLN 777 HG3 GLN 777 4.010 1.541 -11.496 395 HE21 GLN 777 HE21 GLN 777 1.178 1.216 -11.228 396 HE22 GLN 777 HE22 GLN 777 0.744 -0.287 -11.930 397 H MET 778 HN MET 778 1.713 4.182 -9.359 398 HA MET 778 HA MET 778 0.145 6.272 -10.652 399 HB2 MET 778 HB2 MET 778 -0.544 4.613 -8.273 400 HB3 MET 778 HB3 MET 778 -1.665 5.754 -9.067 401 HG2 MET 778 HG2 MET 778 -0.507 3.212 -10.198 402 HG3 MET 778 HG3 MET 778 -2.200 3.577 -9.846 403 HE1 MET 778 HE1 MET 778 -0.871 2.478 -12.682 404 HE2 MET 778 HE2 MET 778 -1.983 3.306 -13.774 405 HE3 MET 778 HE3 MET 778 -2.583 2.556 -12.295 406 H ARG 779 HN ARG 779 0.561 6.202 -7.055 407 HA ARG 779 HA ARG 779 0.390 8.990 -7.352 408 HB2 ARG 779 HB2 ARG 779 0.276 7.164 -5.033 409 HB3 ARG 779 HB3 ARG 779 0.583 8.876 -4.781 410 HG2 ARG 779 HG2 ARG 779 -1.484 9.459 -5.861 411 HG3 ARG 779 HG3 ARG 779 -1.770 7.766 -6.278 412 HD2 ARG 779 HD2 ARG 779 -1.457 8.819 -3.501 413 HD3 ARG 779 HD3 ARG 779 -3.021 8.497 -4.279 414 HE ARG 779 HE ARG 779 -1.367 6.277 -4.514 415 HH11 ARG 779 HH11 ARG 779 -2.983 8.008 -1.876 416 HH12 ARG 779 HH12 ARG 779 -3.433 6.569 -1.058 417 HH21 ARG 779 HH21 ARG 779 -2.052 4.319 -3.363 418 HH22 ARG 779 HH22 ARG 779 -2.982 4.472 -1.928 419 H ASP 780 HN ASP 780 1.668 10.295 -5.958 420 HA ASP 780 HA ASP 780 4.491 9.570 -5.874 421 HB2 ASP 780 HB2 ASP 780 3.325 12.004 -7.269 422 HB3 ASP 780 HB3 ASP 780 4.949 11.953 -6.726 423 H ASP 781 HN ASP 781 4.336 9.422 -3.613 424 HA ASP 781 HA ASP 781 3.315 11.653 -2.001 425 HB2 ASP 781 HB2 ASP 781 3.164 9.131 -1.374 426 HB3 ASP 781 HB3 ASP 781 4.839 9.286 -0.881 427 H LEU 782 HN LEU 782 6.405 10.234 -2.646 428 HA LEU 782 HA LEU 782 7.830 12.152 -0.945 429 HB2 LEU 782 HB2 LEU 782 8.527 9.737 -1.517 430 HB3 LEU 782 HB3 LEU 782 9.069 10.402 -3.033 431 HG LEU 782 HG LEU 782 10.588 11.926 -1.819 432 HD11 LEU 782 HD11 LEU 782 11.165 11.416 0.498 433 HD12 LEU 782 HD12 LEU 782 9.801 10.306 0.592 434 HD13 LEU 782 HD13 LEU 782 9.524 12.030 0.356 435 HD21 LEU 782 HD21 LEU 782 11.312 9.814 -2.802 436 HD22 LEU 782 HD22 LEU 782 11.019 9.003 -1.253 437 HD23 LEU 782 HD23 LEU 782 12.231 10.286 -1.385 438 H GLU 783 HN GLU 783 6.803 12.020 -4.166 439 HA GLU 783 HA GLU 783 8.457 13.689 -5.600 440 HB2 GLU 783 HB2 GLU 783 6.559 12.694 -6.525 441 HB3 GLU 783 HB3 GLU 783 5.447 13.723 -5.636 442 HG2 GLU 783 HG2 GLU 783 6.435 15.682 -6.870 443 HG3 GLU 783 HG3 GLU 783 7.328 14.527 -7.845 444 H LYS 784 HN LYS 784 6.073 14.363 -3.093 445 HA LYS 784 HA LYS 784 6.703 17.098 -3.258 446 HB2 LYS 784 HB2 LYS 784 4.307 15.911 -4.058 447 HB3 LYS 784 HB3 LYS 784 3.936 17.054 -2.748 448 HG2 LYS 784 HG2 LYS 784 4.279 18.795 -4.123 449 HG3 LYS 784 HG3 LYS 784 5.814 18.135 -4.660 450 HD2 LYS 784 HD2 LYS 784 4.286 18.388 -6.530 451 HD3 LYS 784 HD3 LYS 784 4.702 16.702 -6.256 452 HE2 LYS 784 HE2 LYS 784 2.563 16.418 -5.027 453 HE3 LYS 784 HE3 LYS 784 2.149 18.077 -5.445 454 HZ1 LYS 784 HZ1 LYS 784 2.785 15.959 -7.383 455 HZ2 LYS 784 HZ2 LYS 784 2.207 17.506 -7.768 456 HZ3 LYS 784 HZ3 LYS 784 1.213 16.393 -6.969 457 H GLU 785 HN GLU 785 7.835 16.281 -1.285 458 HA GLU 785 HA GLU 785 6.542 16.934 1.098 459 HB2 GLU 785 HB2 GLU 785 5.644 14.621 0.946 460 HB3 GLU 785 HB3 GLU 785 7.273 13.949 0.825 461 HG2 GLU 785 HG2 GLU 785 7.684 14.902 3.151 462 HG3 GLU 785 HG3 GLU 785 5.962 15.310 3.162 463 H ARG 786 HN ARG 786 8.175 17.623 2.430 464 HA ARG 786 HA ARG 786 10.840 16.899 1.524 465 HB2 ARG 786 HB2 ARG 786 10.425 19.297 1.318 466 HB3 ARG 786 HB3 ARG 786 9.949 19.369 3.010 467 HG2 ARG 786 HG2 ARG 786 12.195 18.871 3.718 468 HG3 ARG 786 HG3 ARG 786 12.713 18.645 2.052 469 HD2 ARG 786 HD2 ARG 786 11.635 21.217 3.194 470 HD3 ARG 786 HD3 ARG 786 13.346 20.853 2.986 471 HE ARG 786 HE ARG 786 12.450 20.480 0.527 472 HH11 ARG 786 HH11 ARG 786 11.789 23.179 2.755 473 HH12 ARG 786 HH12 ARG 786 11.637 24.338 1.518 474 HH21 ARG 786 HH21 ARG 786 12.304 22.098 -1.155 475 HH22 ARG 786 HH22 ARG 786 11.957 23.713 -0.754 476 H GLU 787 HN GLU 787 12.157 15.853 2.876 477 HA GLU 787 HA GLU 787 11.168 14.860 5.327 478 HB2 GLU 787 HB2 GLU 787 14.032 14.749 4.371 479 HB3 GLU 787 HB3 GLU 787 13.252 13.642 5.493 480 HG2 GLU 787 HG2 GLU 787 13.298 12.365 3.607 481 HG3 GLU 787 HG3 GLU 787 11.755 13.177 3.344 482 H ASP 788 HN ASP 788 11.930 15.333 7.410 483 HA ASP 788 HA ASP 788 12.731 18.012 7.922 484 HB2 ASP 788 HB2 ASP 788 11.304 16.861 9.464 485 HB3 ASP 788 HB3 ASP 788 12.506 15.578 9.696 486 H LEU 789 HN LEU 789 14.724 18.502 9.305 487 HA LEU 789 HA LEU 789 17.047 17.177 8.156 488 HB2 LEU 789 HB2 LEU 789 16.465 19.720 8.443 489 HB3 LEU 789 HB3 LEU 789 17.153 19.463 10.028 490 HG LEU 789 HG LEU 789 19.292 18.639 8.910 491 HD11 LEU 789 HD11 LEU 789 17.962 19.637 6.432 492 HD12 LEU 789 HD12 LEU 789 18.353 17.956 6.793 493 HD13 LEU 789 HD13 LEU 789 19.642 19.138 6.601 494 HD21 LEU 789 HD21 LEU 789 18.379 21.358 8.152 495 HD22 LEU 789 HD22 LEU 789 20.045 20.739 8.313 496 HD23 LEU 789 HD23 LEU 789 19.027 20.919 9.749 497 H ASP 790 HN ASP 790 17.043 15.371 9.201 498 HA ASP 790 HA ASP 790 17.049 15.289 12.185 499 HB2 ASP 790 HB2 ASP 790 15.348 13.904 10.693 500 HB3 ASP 790 HB3 ASP 790 16.732 12.826 10.501 501 H LEU 791 HN LEU 791 18.339 13.022 12.796 502 HA LEU 791 HA LEU 791 20.920 13.510 11.581 503 HB2 LEU 791 HB2 LEU 791 20.601 14.101 14.099 504 HB3 LEU 791 HB3 LEU 791 20.654 12.398 14.396 505 HG LEU 791 HG LEU 791 22.854 14.169 13.373 506 HD11 LEU 791 HD11 LEU 791 22.449 14.387 15.710 507 HD12 LEU 791 HD12 LEU 791 23.972 13.539 15.447 508 HD13 LEU 791 HD13 LEU 791 22.533 12.639 15.927 509 HD21 LEU 791 HD21 LEU 791 22.873 11.145 13.636 510 HD22 LEU 791 HD22 LEU 791 24.309 12.125 13.728 511 HD23 LEU 791 HD23 LEU 791 23.387 12.131 12.242 512 H ASP 792 HN ASP 792 19.288 10.986 13.327 513 HA ASP 792 HA ASP 792 20.266 9.008 11.308 514 HB2 ASP 792 HB2 ASP 792 21.643 8.900 13.221 515 HB3 ASP 792 HB3 ASP 792 20.277 8.768 14.293 516 H HIS 793 HN HIS 793 18.474 8.507 14.186 517 HA HIS 793 HA HIS 793 15.858 8.217 12.808 518 HB2 HIS 793 HB2 HIS 793 17.265 6.021 13.410 519 HB3 HIS 793 HB3 HIS 793 16.728 6.401 15.042 520 HD2 HIS 793 HD2 HIS 793 15.146 5.478 11.580 521 HE1 HIS 793 HE1 HIS 793 12.372 4.559 14.625 522 HE2 HIS 793 HE2 HIS 793 12.964 4.288 12.215 523 H SER 794 HN SER 794 14.202 8.471 14.606 524 HA SER 794 HA SER 794 15.014 9.682 17.149 525 HB2 SER 794 HB2 SER 794 13.931 11.834 16.492 526 HB3 SER 794 HB3 SER 794 15.531 11.542 15.802 527 HG SER 794 HG SER 794 14.493 12.046 14.034 528 H SER 795 HN SER 795 13.200 7.639 16.062 529 HA SER 795 HA SER 795 10.706 8.826 16.695 530 HB2 SER 795 HB2 SER 795 10.598 7.171 14.915 531 HB3 SER 795 HB3 SER 795 11.217 5.898 15.987 532 HG SER 795 HG SER 795 8.743 6.812 15.545 533 H LEU 796 HN LEU 796 10.372 9.137 18.891 534 HA LEU 796 HA LEU 796 11.256 7.047 20.754 535 HB2 LEU 796 HB2 LEU 796 11.876 9.627 20.849 536 HB3 LEU 796 HB3 LEU 796 10.278 9.779 21.543 537 HG LEU 796 HG LEU 796 11.910 9.760 23.270 538 HD11 LEU 796 HD11 LEU 796 10.387 7.161 23.290 539 HD12 LEU 796 HD12 LEU 796 9.801 8.721 23.856 540 HD13 LEU 796 HD13 LEU 796 11.124 7.919 24.699 541 HD21 LEU 796 HD21 LEU 796 12.790 7.067 22.260 542 HD22 LEU 796 HD22 LEU 796 13.350 7.834 23.743 543 HD23 LEU 796 HD23 LEU 796 13.702 8.574 22.181 Start of MODEL 5 1 HA ASP 724 HA ASP 724 5.621 0.330 15.672 2 HB2 ASP 724 HB2 ASP 724 6.166 1.636 17.666 3 HB3 ASP 724 HB3 ASP 724 7.522 2.369 16.843 4 H ILE 725 HN ILE 725 8.834 1.767 15.107 5 HA ILE 725 HA ILE 725 8.221 2.941 12.648 6 HB ILE 725 HB ILE 725 10.923 2.297 13.859 7 HG12 ILE 725 HG12 ILE 725 9.264 4.823 13.984 8 HG13 ILE 725 HG13 ILE 725 9.405 3.657 15.293 9 HG21 ILE 725 HG21 ILE 725 10.042 4.165 11.692 10 HG22 ILE 725 HG22 ILE 725 11.139 2.797 11.505 11 HG23 ILE 725 HG23 ILE 725 11.649 4.229 12.421 12 HD11 ILE 725 HD11 ILE 725 11.770 4.115 15.456 13 HD12 ILE 725 HD12 ILE 725 10.830 5.599 15.631 14 HD13 ILE 725 HD13 ILE 725 11.663 5.254 14.115 15 H SER 726 HN SER 726 9.106 -0.218 13.485 16 HA SER 726 HA SER 726 10.574 -0.918 11.053 17 HB2 SER 726 HB2 SER 726 9.736 -2.775 13.263 18 HB3 SER 726 HB3 SER 726 11.117 -2.879 12.184 19 HG SER 726 HG SER 726 12.203 -1.528 13.343 20 H GLU 727 HN GLU 727 10.118 -2.658 9.771 21 HA GLU 727 HA GLU 727 7.329 -2.836 9.041 22 HB2 GLU 727 HB2 GLU 727 9.403 -4.244 7.524 23 HB3 GLU 727 HB3 GLU 727 8.065 -3.280 6.959 24 HG2 GLU 727 HG2 GLU 727 9.808 -1.997 6.244 25 HG3 GLU 727 HG3 GLU 727 9.514 -1.304 7.846 26 H SER 728 HN SER 728 6.378 -4.788 8.901 27 HA SER 728 HA SER 728 7.134 -6.910 10.530 28 HB2 SER 728 HB2 SER 728 5.447 -7.018 8.031 29 HB3 SER 728 HB3 SER 728 5.524 -8.215 9.340 30 HG SER 728 HG SER 728 4.999 -5.694 10.256 31 H LEU 729 HN LEU 729 7.212 -6.906 6.981 32 HA LEU 729 HA LEU 729 9.886 -7.396 6.683 33 HB2 LEU 729 HB2 LEU 729 9.298 -9.702 7.603 34 HB3 LEU 729 HB3 LEU 729 8.226 -9.889 6.257 35 HG LEU 729 HG LEU 729 10.099 -9.818 4.693 36 HD11 LEU 729 HD11 LEU 729 12.401 -9.936 5.535 37 HD12 LEU 729 HD12 LEU 729 11.808 -9.630 7.169 38 HD13 LEU 729 HD13 LEU 729 11.630 -8.401 5.918 39 HD21 LEU 729 HD21 LEU 729 9.336 -11.953 5.567 40 HD22 LEU 729 HD22 LEU 729 10.441 -11.804 6.932 41 HD23 LEU 729 HD23 LEU 729 11.077 -11.968 5.295 42 H ARG 730 HN ARG 730 7.683 -9.282 4.755 43 HA ARG 730 HA ARG 730 8.387 -7.702 2.582 44 HB2 ARG 730 HB2 ARG 730 6.521 -9.072 1.453 45 HB3 ARG 730 HB3 ARG 730 8.146 -9.749 1.689 46 HG2 ARG 730 HG2 ARG 730 7.224 -10.924 3.671 47 HG3 ARG 730 HG3 ARG 730 5.622 -10.249 3.305 48 HD2 ARG 730 HD2 ARG 730 5.690 -11.274 1.139 49 HD3 ARG 730 HD3 ARG 730 7.279 -11.958 1.461 50 HE ARG 730 HE ARG 730 6.001 -13.105 3.382 51 HH11 ARG 730 HH11 ARG 730 4.672 -12.436 0.174 52 HH12 ARG 730 HH12 ARG 730 3.696 -13.834 0.129 53 HH21 ARG 730 HH21 ARG 730 4.658 -15.007 3.321 54 HH22 ARG 730 HH22 ARG 730 3.691 -15.338 1.953 55 H GLN 731 HN GLN 731 5.477 -7.950 4.398 56 HA GLN 731 HA GLN 731 3.903 -6.227 2.738 57 HB2 GLN 731 HB2 GLN 731 2.700 -7.778 4.067 58 HB3 GLN 731 HB3 GLN 731 3.627 -7.359 5.499 59 HG2 GLN 731 HG2 GLN 731 1.330 -6.603 5.587 60 HG3 GLN 731 HG3 GLN 731 2.471 -5.266 5.700 61 HE21 GLN 731 HE21 GLN 731 1.525 -6.929 2.800 62 HE22 GLN 731 HE22 GLN 731 0.826 -5.543 2.007 63 H GLY 732 HN GLY 732 5.580 -6.006 5.732 64 HA2 GLY 732 HA3 GLY 732 4.840 -3.341 6.356 65 HA3 GLY 732 HA2 GLY 732 6.184 -4.198 7.068 66 H GLY 733 HN GLY 733 7.347 -4.679 4.347 67 HA2 GLY 733 HA3 GLY 733 8.338 -1.953 3.992 68 HA3 GLY 733 HA2 GLY 733 9.452 -3.301 4.111 69 H GLY 734 HN GLY 734 6.455 -2.749 2.314 70 HA2 GLY 734 HA3 GLY 734 7.926 -2.745 -0.119 71 HA3 GLY 734 HA2 GLY 734 7.100 -4.262 0.130 72 H LYS 735 HN LYS 735 4.740 -3.927 0.828 73 HA LYS 735 HA LYS 735 3.402 -1.800 -0.599 74 HB2 LYS 735 HB2 LYS 735 2.425 -3.057 -2.276 75 HB3 LYS 735 HB3 LYS 735 4.092 -3.530 -2.368 76 HG2 LYS 735 HG2 LYS 735 1.786 -5.182 -1.275 77 HG3 LYS 735 HG3 LYS 735 2.695 -5.471 -2.723 78 HD2 LYS 735 HD2 LYS 735 3.869 -5.677 0.063 79 HD3 LYS 735 HD3 LYS 735 3.318 -7.025 -0.939 80 HE2 LYS 735 HE2 LYS 735 4.988 -6.517 -2.609 81 HE3 LYS 735 HE3 LYS 735 5.500 -5.092 -1.697 82 HZ1 LYS 735 HZ1 LYS 735 6.228 -6.630 0.113 83 HZ2 LYS 735 HZ2 LYS 735 7.008 -6.921 -1.335 84 HZ3 LYS 735 HZ3 LYS 735 5.779 -7.936 -0.864 85 H LEU 736 HN LEU 736 0.963 -2.100 -0.411 86 HA LEU 736 HA LEU 736 0.354 -3.711 2.049 87 HB2 LEU 736 HB2 LEU 736 -1.408 -1.420 1.455 88 HB3 LEU 736 HB3 LEU 736 -1.019 -2.200 2.900 89 HG LEU 736 HG LEU 736 1.080 -0.470 1.688 90 HD11 LEU 736 HD11 LEU 736 -0.863 0.898 1.881 91 HD12 LEU 736 HD12 LEU 736 0.240 1.280 3.212 92 HD13 LEU 736 HD13 LEU 736 -1.198 0.293 3.503 93 HD21 LEU 736 HD21 LEU 736 1.699 -0.312 4.053 94 HD22 LEU 736 HD22 LEU 736 1.805 -1.957 3.421 95 HD23 LEU 736 HD23 LEU 736 0.448 -1.484 4.450 96 H ASN 737 HN ASN 737 -1.288 -5.092 1.838 97 HA ASN 737 HA ASN 737 -3.214 -4.634 -0.317 98 HB2 ASN 737 HB2 ASN 737 -2.039 -7.416 0.080 99 HB3 ASN 737 HB3 ASN 737 -3.074 -6.949 -1.220 100 HD21 ASN 737 HD21 ASN 737 -1.258 -4.488 -1.690 101 HD22 ASN 737 HD22 ASN 737 0.082 -5.183 -2.498 102 H PHE 738 HN PHE 738 -5.341 -5.570 0.197 103 HA PHE 738 HA PHE 738 -6.050 -5.739 2.908 104 HB2 PHE 738 HB2 PHE 738 -7.648 -5.709 1.030 105 HB3 PHE 738 HB3 PHE 738 -7.060 -7.316 0.591 106 HD1 PHE 738 HD2 PHE 738 -8.315 -5.587 3.570 107 HD2 PHE 738 HD1 PHE 738 -8.473 -9.020 1.157 108 HE1 PHE 738 HE2 PHE 738 -10.007 -6.550 5.094 109 HE2 PHE 738 HE1 PHE 738 -10.164 -10.016 2.635 110 HZ PHE 738 HZ PHE 738 -10.938 -8.774 4.616 111 H ASP 739 HN ASP 739 -5.473 -8.647 0.903 112 HA ASP 739 HA ASP 739 -5.261 -10.339 3.177 113 HB2 ASP 739 HB2 ASP 739 -4.819 -10.677 0.259 114 HB3 ASP 739 HB3 ASP 739 -4.159 -11.893 1.344 115 H GLU 740 HN GLU 740 -2.889 -8.488 1.491 116 HA GLU 740 HA GLU 740 -0.657 -9.921 2.836 117 HB2 GLU 740 HB2 GLU 740 -0.676 -8.928 0.378 118 HB3 GLU 740 HB3 GLU 740 -0.300 -7.427 1.216 119 HG2 GLU 740 HG2 GLU 740 1.756 -8.279 0.544 120 HG3 GLU 740 HG3 GLU 740 1.653 -8.725 2.249 121 H LEU 741 HN LEU 741 -2.385 -6.853 3.031 122 HA LEU 741 HA LEU 741 -0.741 -5.447 4.718 123 HB2 LEU 741 HB2 LEU 741 -2.530 -4.375 3.794 124 HB3 LEU 741 HB3 LEU 741 -3.755 -5.449 4.424 125 HG LEU 741 HG LEU 741 -2.560 -4.479 6.681 126 HD11 LEU 741 HD11 LEU 741 -2.240 -2.097 6.444 127 HD12 LEU 741 HD12 LEU 741 -2.450 -2.232 4.704 128 HD13 LEU 741 HD13 LEU 741 -1.069 -2.994 5.481 129 HD21 LEU 741 HD21 LEU 741 -4.889 -4.578 6.354 130 HD22 LEU 741 HD22 LEU 741 -4.793 -3.384 5.090 131 HD23 LEU 741 HD23 LEU 741 -4.477 -2.908 6.748 132 H ARG 742 HN ARG 742 -2.932 -8.075 5.215 133 HA ARG 742 HA ARG 742 -3.293 -8.033 8.011 134 HB2 ARG 742 HB2 ARG 742 -2.838 -10.707 6.836 135 HB3 ARG 742 HB3 ARG 742 -4.068 -10.108 7.896 136 HG2 ARG 742 HG2 ARG 742 -4.090 -9.313 5.095 137 HG3 ARG 742 HG3 ARG 742 -4.706 -10.909 5.558 138 HD2 ARG 742 HD2 ARG 742 -6.115 -9.223 7.239 139 HD3 ARG 742 HD3 ARG 742 -5.714 -8.184 5.936 140 HE ARG 742 HE ARG 742 -7.435 -9.027 4.890 141 HH11 ARG 742 HH11 ARG 742 -6.037 -11.939 6.489 142 HH12 ARG 742 HH12 ARG 742 -6.774 -13.005 5.404 143 HH21 ARG 742 HH21 ARG 742 -8.376 -10.642 3.394 144 HH22 ARG 742 HH22 ARG 742 -8.145 -12.267 3.703 145 H GLN 743 HN GLN 743 -0.623 -9.134 6.022 146 HA GLN 743 HA GLN 743 0.723 -10.538 7.915 147 HB2 GLN 743 HB2 GLN 743 1.285 -9.530 5.407 148 HB3 GLN 743 HB3 GLN 743 2.460 -8.801 6.445 149 HG2 GLN 743 HG2 GLN 743 3.654 -10.658 6.812 150 HG3 GLN 743 HG3 GLN 743 2.222 -11.678 6.956 151 HE21 GLN 743 HE21 GLN 743 1.148 -10.944 4.468 152 HE22 GLN 743 HE22 GLN 743 2.058 -11.634 3.218 153 H ASP 744 HN ASP 744 0.288 -7.243 7.464 154 HA ASP 744 HA ASP 744 2.164 -6.341 9.430 155 HB2 ASP 744 HB2 ASP 744 0.800 -5.023 7.430 156 HB3 ASP 744 HB3 ASP 744 -0.019 -4.499 8.859 157 H LEU 745 HN LEU 745 -1.369 -6.502 9.162 158 HA LEU 745 HA LEU 745 -1.610 -6.335 12.046 159 HB2 LEU 745 HB2 LEU 745 -3.990 -5.586 11.348 160 HB3 LEU 745 HB3 LEU 745 -2.680 -4.415 11.467 161 HG LEU 745 HG LEU 745 -2.483 -4.817 8.889 162 HD11 LEU 745 HD11 LEU 745 -3.928 -6.801 9.113 163 HD12 LEU 745 HD12 LEU 745 -4.311 -5.730 7.772 164 HD13 LEU 745 HD13 LEU 745 -5.332 -5.734 9.206 165 HD21 LEU 745 HD21 LEU 745 -4.315 -3.197 8.547 166 HD22 LEU 745 HD22 LEU 745 -3.233 -2.774 9.866 167 HD23 LEU 745 HD23 LEU 745 -4.820 -3.467 10.213 168 H LYS 746 HN LYS 746 -1.183 -8.803 10.944 169 HA LYS 746 HA LYS 746 -3.388 -10.233 10.346 170 HB2 LYS 746 HB2 LYS 746 -0.852 -11.129 11.661 171 HB3 LYS 746 HB3 LYS 746 -2.117 -12.336 11.393 172 HG2 LYS 746 HG2 LYS 746 -1.747 -11.274 8.865 173 HG3 LYS 746 HG3 LYS 746 -0.238 -10.956 9.616 174 HD2 LYS 746 HD2 LYS 746 0.233 -13.185 10.178 175 HD3 LYS 746 HD3 LYS 746 -1.388 -13.714 9.729 176 HE2 LYS 746 HE2 LYS 746 -0.958 -13.144 7.410 177 HE3 LYS 746 HE3 LYS 746 0.644 -12.545 7.839 178 HZ1 LYS 746 HZ1 LYS 746 -0.255 -15.350 8.176 179 HZ2 LYS 746 HZ2 LYS 746 1.311 -14.746 8.443 180 HZ3 LYS 746 HZ3 LYS 746 0.672 -14.775 6.898 181 H GLY 747 HN GLY 747 -5.135 -10.865 11.475 182 HA2 GLY 747 HA3 GLY 747 -6.353 -11.708 13.289 183 HA3 GLY 747 HA2 GLY 747 -5.020 -11.290 14.336 184 H LYS 748 HN LYS 748 -7.971 -10.113 13.040 185 HA LYS 748 HA LYS 748 -8.010 -7.854 14.770 186 HB2 LYS 748 HB2 LYS 748 -7.822 -5.962 13.256 187 HB3 LYS 748 HB3 LYS 748 -6.521 -7.053 12.916 188 HG2 LYS 748 HG2 LYS 748 -9.027 -6.968 11.227 189 HG3 LYS 748 HG3 LYS 748 -7.532 -6.125 10.868 190 HD2 LYS 748 HD2 LYS 748 -6.398 -7.979 10.273 191 HD3 LYS 748 HD3 LYS 748 -7.192 -9.005 11.450 192 HE2 LYS 748 HE2 LYS 748 -9.192 -8.944 10.030 193 HE3 LYS 748 HE3 LYS 748 -8.303 -8.041 8.807 194 HZ1 LYS 748 HZ1 LYS 748 -7.865 -10.838 9.733 195 HZ2 LYS 748 HZ2 LYS 748 -6.736 -10.087 8.818 196 HZ3 LYS 748 HZ3 LYS 748 -8.288 -10.370 8.194 197 H GLY 749 HN GLY 749 -9.468 -9.490 12.027 198 HA2 GLY 749 HA3 GLY 749 -11.979 -8.260 12.827 199 HA3 GLY 749 HA2 GLY 749 -11.618 -8.480 11.147 200 H HIS 750 HN HIS 750 -13.845 -9.539 11.663 201 HA HIS 750 HA HIS 750 -13.471 -12.332 12.374 202 HB2 HIS 750 HB2 HIS 750 -15.965 -10.701 11.957 203 HB3 HIS 750 HB3 HIS 750 -16.009 -12.455 12.059 204 HD2 HIS 750 HD2 HIS 750 -15.106 -13.460 14.625 205 HE1 HIS 750 HE1 HIS 750 -15.997 -9.823 16.598 206 HE2 HIS 750 HE2 HIS 750 -15.973 -12.324 16.735 207 H THR 751 HN THR 751 -15.387 -10.809 9.783 208 HA THR 751 HA THR 751 -14.490 -13.025 8.041 209 HB THR 751 HB THR 751 -16.746 -11.330 7.221 210 HG1 THR 751 HG1 THR 751 -17.483 -11.325 9.271 211 HG21 THR 751 HG21 THR 751 -16.457 -14.312 7.641 212 HG22 THR 751 HG22 THR 751 -16.223 -13.468 6.112 213 HG23 THR 751 HG23 THR 751 -17.816 -13.528 6.852 214 H ASP 752 HN ASP 752 -13.689 -12.514 6.030 215 HA ASP 752 HA ASP 752 -12.079 -10.213 5.694 216 HB2 ASP 752 HB2 ASP 752 -13.173 -12.035 3.514 217 HB3 ASP 752 HB3 ASP 752 -11.806 -10.948 3.395 218 H ALA 753 HN ALA 753 -15.369 -10.835 4.688 219 HA ALA 753 HA ALA 753 -15.664 -8.621 2.993 220 HB1 ALA 753 HB1 ALA 753 -17.853 -9.922 4.614 221 HB2 ALA 753 HB2 ALA 753 -17.233 -10.516 3.090 222 HB3 ALA 753 HB3 ALA 753 -18.036 -8.946 3.162 223 H GLU 754 HN GLU 754 -16.207 -8.901 6.413 224 HA GLU 754 HA GLU 754 -17.253 -6.330 6.811 225 HB2 GLU 754 HB2 GLU 754 -15.944 -8.374 8.488 226 HB3 GLU 754 HB3 GLU 754 -16.206 -6.774 9.162 227 HG2 GLU 754 HG2 GLU 754 -18.590 -7.036 8.823 228 HG3 GLU 754 HG3 GLU 754 -18.330 -8.539 7.943 229 H ILE 755 HN ILE 755 -14.020 -7.548 6.863 230 HA ILE 755 HA ILE 755 -12.825 -5.059 7.769 231 HB ILE 755 HB ILE 755 -11.514 -7.448 6.507 232 HG12 ILE 755 HG12 ILE 755 -11.719 -7.072 9.449 233 HG13 ILE 755 HG13 ILE 755 -13.124 -7.705 8.594 234 HG21 ILE 755 HG21 ILE 755 -10.246 -5.275 6.808 235 HG22 ILE 755 HG22 ILE 755 -9.555 -6.646 7.633 236 HG23 ILE 755 HG23 ILE 755 -10.488 -5.450 8.548 237 HD11 ILE 755 HD11 ILE 755 -10.366 -8.869 8.504 238 HD12 ILE 755 HD12 ILE 755 -11.812 -9.510 7.731 239 HD13 ILE 755 HD13 ILE 755 -11.701 -9.485 9.482 240 H GLU 756 HN GLU 756 -13.216 -6.753 4.704 241 HA GLU 756 HA GLU 756 -11.552 -5.165 3.213 242 HB2 GLU 756 HB2 GLU 756 -12.465 -7.345 2.486 243 HB3 GLU 756 HB3 GLU 756 -14.027 -6.545 2.217 244 HG2 GLU 756 HG2 GLU 756 -12.774 -5.018 0.551 245 HG3 GLU 756 HG3 GLU 756 -11.434 -6.121 0.737 246 H ALA 757 HN ALA 757 -14.996 -4.970 3.802 247 HA ALA 757 HA ALA 757 -15.565 -2.662 2.260 248 HB1 ALA 757 HB1 ALA 757 -17.031 -4.094 4.441 249 HB2 ALA 757 HB2 ALA 757 -17.478 -3.857 2.722 250 HB3 ALA 757 HB3 ALA 757 -17.585 -2.537 3.854 251 H ILE 758 HN ILE 758 -14.986 -3.125 5.751 252 HA ILE 758 HA ILE 758 -15.601 -0.568 6.566 253 HB ILE 758 HB ILE 758 -15.349 -2.486 8.104 254 HG12 ILE 758 HG12 ILE 758 -15.212 -0.002 8.874 255 HG13 ILE 758 HG13 ILE 758 -14.801 -1.298 10.018 256 HG21 ILE 758 HG21 ILE 758 -13.262 -3.339 7.209 257 HG22 ILE 758 HG22 ILE 758 -13.236 -3.220 8.973 258 HG23 ILE 758 HG23 ILE 758 -12.387 -2.025 7.988 259 HD11 ILE 758 HD11 ILE 758 -12.853 0.421 8.498 260 HD12 ILE 758 HD12 ILE 758 -12.437 -0.873 9.616 261 HD13 ILE 758 HD13 ILE 758 -13.261 0.560 10.217 262 H PHE 759 HN PHE 759 -12.444 -1.931 5.597 263 HA PHE 759 HA PHE 759 -11.000 0.375 6.204 264 HB2 PHE 759 HB2 PHE 759 -9.111 -0.775 5.359 265 HB3 PHE 759 HB3 PHE 759 -10.228 -2.059 5.717 266 HD1 PHE 759 HD2 PHE 759 -9.433 0.079 2.691 267 HD2 PHE 759 HD1 PHE 759 -10.377 -3.772 4.211 268 HE1 PHE 759 HE2 PHE 759 -9.283 -0.837 0.441 269 HE2 PHE 759 HE1 PHE 759 -10.175 -4.689 1.916 270 HZ PHE 759 HZ PHE 759 -9.646 -3.219 0.054 271 H THR 760 HN THR 760 -12.896 -0.443 3.464 272 HA THR 760 HA THR 760 -11.622 1.120 1.532 273 HB THR 760 HB THR 760 -14.505 0.237 1.778 274 HG1 THR 760 HG1 THR 760 -13.265 -1.599 1.445 275 HG21 THR 760 HG21 THR 760 -14.307 2.148 0.237 276 HG22 THR 760 HG22 THR 760 -14.721 0.658 -0.605 277 HG23 THR 760 HG23 THR 760 -13.065 1.276 -0.664 278 H LYS 761 HN LYS 761 -14.023 1.744 3.928 279 HA LYS 761 HA LYS 761 -14.214 4.537 3.085 280 HB2 LYS 761 HB2 LYS 761 -16.227 2.977 3.801 281 HB3 LYS 761 HB3 LYS 761 -15.689 3.444 5.383 282 HG2 LYS 761 HG2 LYS 761 -16.247 5.770 5.077 283 HG3 LYS 761 HG3 LYS 761 -16.308 5.537 3.341 284 HD2 LYS 761 HD2 LYS 761 -18.521 5.781 4.322 285 HD3 LYS 761 HD3 LYS 761 -18.310 4.216 3.548 286 HE2 LYS 761 HE2 LYS 761 -17.897 3.206 5.755 287 HE3 LYS 761 HE3 LYS 761 -18.147 4.778 6.511 288 HZ1 LYS 761 HZ1 LYS 761 -20.396 4.784 5.634 289 HZ2 LYS 761 HZ2 LYS 761 -20.131 3.435 6.613 290 HZ3 LYS 761 HZ3 LYS 761 -20.141 3.270 4.931 291 H TYR 762 HN TYR 762 -13.182 2.672 5.980 292 HA TYR 762 HA TYR 762 -12.468 5.166 7.302 293 HB2 TYR 762 HB2 TYR 762 -12.658 2.338 8.200 294 HB3 TYR 762 HB3 TYR 762 -11.842 3.541 9.185 295 HD1 TYR 762 HD1 TYR 762 -13.168 5.258 10.201 296 HD2 TYR 762 HD2 TYR 762 -15.019 2.166 8.005 297 HE1 TYR 762 HE1 TYR 762 -15.321 5.727 11.373 298 HE2 TYR 762 HE2 TYR 762 -17.175 2.607 9.173 299 HH TYR 762 HH TYR 762 -17.711 5.364 11.024 300 H ASP 763 HN ASP 763 -10.771 2.579 5.655 301 HA ASP 763 HA ASP 763 -8.319 2.761 6.982 302 HB2 ASP 763 HB2 ASP 763 -9.039 0.999 5.252 303 HB3 ASP 763 HB3 ASP 763 -8.610 2.159 4.076 304 H GLN 764 HN GLN 764 -6.380 3.720 6.293 305 HA GLN 764 HA GLN 764 -6.494 6.412 5.699 306 HB2 GLN 764 HB2 GLN 764 -4.136 4.560 5.404 307 HB3 GLN 764 HB3 GLN 764 -4.054 6.319 5.472 308 HG2 GLN 764 HG2 GLN 764 -5.104 4.519 7.621 309 HG3 GLN 764 HG3 GLN 764 -3.517 5.291 7.627 310 HE21 GLN 764 HE21 GLN 764 -4.461 7.819 6.551 311 HE22 GLN 764 HE22 GLN 764 -5.331 8.589 7.811 312 H ASP 765 HN ASP 765 -5.711 3.729 3.461 313 HA ASP 765 HA ASP 765 -6.018 5.772 1.369 314 HB2 ASP 765 HB2 ASP 765 -4.297 3.376 1.510 315 HB3 ASP 765 HB3 ASP 765 -4.865 3.894 -0.088 316 H GLY 766 HN GLY 766 -7.705 3.220 2.719 317 HA2 GLY 766 HA3 GLY 766 -9.704 2.137 2.026 318 HA3 GLY 766 HA2 GLY 766 -9.876 3.506 0.956 319 H ASP 767 HN ASP 767 -7.035 1.790 0.465 320 HA ASP 767 HA ASP 767 -8.130 0.675 -2.013 321 HB2 ASP 767 HB2 ASP 767 -5.518 1.829 -1.251 322 HB3 ASP 767 HB3 ASP 767 -5.470 0.481 -2.382 323 H GLN 768 HN GLN 768 -5.508 0.013 0.209 324 HA GLN 768 HA GLN 768 -4.534 -1.948 0.988 325 HB2 GLN 768 HB2 GLN 768 -6.933 -1.319 2.117 326 HB3 GLN 768 HB3 GLN 768 -7.217 -2.981 1.749 327 HG2 GLN 768 HG2 GLN 768 -5.323 -3.631 2.995 328 HG3 GLN 768 HG3 GLN 768 -4.944 -1.936 3.328 329 HE21 GLN 768 HE21 GLN 768 -7.101 -4.563 4.049 330 HE22 GLN 768 HE22 GLN 768 -7.879 -3.781 5.378 331 H GLU 769 HN GLU 769 -3.791 -2.880 -0.892 332 HA GLU 769 HA GLU 769 -4.013 -5.365 -1.570 333 HB2 GLU 769 HB2 GLU 769 -5.575 -5.828 -3.422 334 HB3 GLU 769 HB3 GLU 769 -6.490 -5.174 -2.081 335 HG2 GLU 769 HG2 GLU 769 -6.873 -3.058 -3.304 336 HG3 GLU 769 HG3 GLU 769 -5.580 -3.510 -4.410 337 H LEU 770 HN LEU 770 -2.424 -2.767 -2.014 338 HA LEU 770 HA LEU 770 -2.156 -2.904 -4.907 339 HB2 LEU 770 HB2 LEU 770 -2.118 -0.530 -3.062 340 HB3 LEU 770 HB3 LEU 770 -1.101 -0.473 -4.450 341 HG LEU 770 HG LEU 770 -3.229 -0.694 -5.831 342 HD11 LEU 770 HD11 LEU 770 -4.423 -0.900 -3.150 343 HD12 LEU 770 HD12 LEU 770 -4.932 -1.678 -4.672 344 HD13 LEU 770 HD13 LEU 770 -5.259 0.006 -4.385 345 HD21 LEU 770 HD21 LEU 770 -3.999 1.567 -5.407 346 HD22 LEU 770 HD22 LEU 770 -2.237 1.487 -5.359 347 HD23 LEU 770 HD23 LEU 770 -3.158 1.574 -3.859 348 H THR 771 HN THR 771 -0.135 -3.458 -5.732 349 HA THR 771 HA THR 771 1.863 -4.013 -3.781 350 HB THR 771 HB THR 771 2.650 -5.580 -5.218 351 HG1 THR 771 HG1 THR 771 3.214 -5.218 -7.188 352 HG21 THR 771 HG21 THR 771 0.148 -5.768 -5.453 353 HG22 THR 771 HG22 THR 771 1.112 -6.518 -6.709 354 HG23 THR 771 HG23 THR 771 0.319 -4.967 -7.011 355 H GLU 772 HN GLU 772 4.169 -3.552 -4.376 356 HA GLU 772 HA GLU 772 4.713 -0.789 -4.343 357 HB2 GLU 772 HB2 GLU 772 6.086 -2.855 -3.552 358 HB3 GLU 772 HB3 GLU 772 6.678 -2.903 -5.197 359 HG2 GLU 772 HG2 GLU 772 7.449 -0.517 -4.887 360 HG3 GLU 772 HG3 GLU 772 7.017 -0.704 -3.195 361 H HIS 773 HN HIS 773 4.452 -3.134 -6.931 362 HA HIS 773 HA HIS 773 5.684 -1.586 -8.983 363 HB2 HIS 773 HB2 HIS 773 3.542 -3.731 -9.244 364 HB3 HIS 773 HB3 HIS 773 4.558 -3.117 -10.533 365 HD2 HIS 773 HD2 HIS 773 7.365 -3.792 -10.105 366 HE1 HIS 773 HE1 HIS 773 6.350 -7.251 -7.873 367 HE2 HIS 773 HE2 HIS 773 8.111 -6.137 -9.244 368 H GLU 774 HN GLU 774 2.398 -1.890 -7.799 369 HA GLU 774 HA GLU 774 1.334 -0.122 -9.841 370 HB2 GLU 774 HB2 GLU 774 -0.174 -0.855 -7.281 371 HB3 GLU 774 HB3 GLU 774 -0.720 -0.364 -8.888 372 HG2 GLU 774 HG2 GLU 774 -0.165 -2.436 -9.869 373 HG3 GLU 774 HG3 GLU 774 0.697 -2.952 -8.419 374 H HIS 775 HN HIS 775 2.067 0.095 -6.459 375 HA HIS 775 HA HIS 775 1.182 2.701 -5.985 376 HB2 HIS 775 HB2 HIS 775 1.513 1.054 -4.187 377 HB3 HIS 775 HB3 HIS 775 3.236 1.024 -4.503 378 HD2 HIS 775 HD2 HIS 775 4.411 2.284 -2.473 379 HE1 HIS 775 HE1 HIS 775 1.624 5.443 -1.949 380 HE2 HIS 775 HE2 HIS 775 3.606 4.283 -0.995 381 H GLN 776 HN GLN 776 4.111 1.414 -7.295 382 HA GLN 776 HA GLN 776 5.908 3.446 -7.055 383 HB2 GLN 776 HB2 GLN 776 6.165 1.112 -8.057 384 HB3 GLN 776 HB3 GLN 776 5.496 1.763 -9.529 385 HG2 GLN 776 HG2 GLN 776 8.064 2.710 -8.259 386 HG3 GLN 776 HG3 GLN 776 7.977 1.483 -9.509 387 HE21 GLN 776 HE21 GLN 776 7.427 2.138 -11.634 388 HE22 GLN 776 HE22 GLN 776 7.548 3.783 -12.113 389 H GLN 777 HN GLN 777 3.375 2.892 -9.361 390 HA GLN 777 HA GLN 777 3.917 5.272 -10.955 391 HB2 GLN 777 HB2 GLN 777 1.547 3.435 -11.205 392 HB3 GLN 777 HB3 GLN 777 2.309 4.401 -12.444 393 HG2 GLN 777 HG2 GLN 777 3.901 2.858 -12.887 394 HG3 GLN 777 HG3 GLN 777 3.985 2.295 -11.221 395 HE21 GLN 777 HE21 GLN 777 1.119 1.818 -10.962 396 HE22 GLN 777 HE22 GLN 777 0.779 0.417 -11.892 397 H MET 778 HN MET 778 1.500 4.061 -8.712 398 HA MET 778 HA MET 778 -0.216 6.238 -9.376 399 HB2 MET 778 HB2 MET 778 -0.628 3.673 -8.011 400 HB3 MET 778 HB3 MET 778 -1.896 4.874 -8.054 401 HG2 MET 778 HG2 MET 778 -2.163 4.739 -10.378 402 HG3 MET 778 HG3 MET 778 -0.688 3.862 -10.668 403 HE1 MET 778 HE1 MET 778 -4.505 2.066 -8.747 404 HE2 MET 778 HE2 MET 778 -4.397 3.712 -9.362 405 HE3 MET 778 HE3 MET 778 -3.498 3.251 -7.915 406 H ARG 779 HN ARG 779 0.299 7.888 -8.061 407 HA ARG 779 HA ARG 779 -0.076 9.145 -6.480 408 HB2 ARG 779 HB2 ARG 779 -0.461 6.873 -4.583 409 HB3 ARG 779 HB3 ARG 779 -0.396 8.545 -4.041 410 HG2 ARG 779 HG2 ARG 779 -2.175 9.079 -5.676 411 HG3 ARG 779 HG3 ARG 779 -2.307 7.355 -5.989 412 HD2 ARG 779 HD2 ARG 779 -2.802 8.798 -3.391 413 HD3 ARG 779 HD3 ARG 779 -4.015 8.062 -4.428 414 HE ARG 779 HE ARG 779 -2.127 6.737 -2.662 415 HH11 ARG 779 HH11 ARG 779 -4.604 6.230 -5.163 416 HH12 ARG 779 HH12 ARG 779 -5.162 4.777 -4.460 417 HH21 ARG 779 HH21 ARG 779 -2.973 4.769 -1.737 418 HH22 ARG 779 HH22 ARG 779 -4.277 3.962 -2.549 419 H ASP 780 HN ASP 780 0.825 10.242 -4.942 420 HA ASP 780 HA ASP 780 3.709 9.627 -4.565 421 HB2 ASP 780 HB2 ASP 780 2.550 12.321 -5.359 422 HB3 ASP 780 HB3 ASP 780 4.232 11.969 -5.056 423 H ASP 781 HN ASP 781 3.126 8.943 -2.491 424 HA ASP 781 HA ASP 781 1.945 10.887 -0.636 425 HB2 ASP 781 HB2 ASP 781 1.802 8.175 -0.665 426 HB3 ASP 781 HB3 ASP 781 3.195 8.405 0.384 427 H LEU 782 HN LEU 782 5.043 9.332 -1.116 428 HA LEU 782 HA LEU 782 6.316 10.677 1.161 429 HB2 LEU 782 HB2 LEU 782 6.997 8.431 0.039 430 HB3 LEU 782 HB3 LEU 782 7.762 9.439 -1.165 431 HG LEU 782 HG LEU 782 9.135 10.490 0.588 432 HD11 LEU 782 HD11 LEU 782 9.350 9.326 2.744 433 HD12 LEU 782 HD12 LEU 782 7.959 8.327 2.333 434 HD13 LEU 782 HD13 LEU 782 7.765 10.066 2.553 435 HD21 LEU 782 HD21 LEU 782 9.929 8.655 -0.832 436 HD22 LEU 782 HD22 LEU 782 9.400 7.494 0.396 437 HD23 LEU 782 HD23 LEU 782 10.663 8.674 0.764 438 H GLU 783 HN GLU 783 5.760 11.390 -2.152 439 HA GLU 783 HA GLU 783 7.667 13.235 -2.842 440 HB2 GLU 783 HB2 GLU 783 5.785 12.407 -4.186 441 HB3 GLU 783 HB3 GLU 783 4.747 13.560 -3.389 442 HG2 GLU 783 HG2 GLU 783 6.146 15.404 -4.207 443 HG3 GLU 783 HG3 GLU 783 7.157 14.245 -5.064 444 H LYS 784 HN LYS 784 4.839 13.434 -0.735 445 HA LYS 784 HA LYS 784 5.554 16.047 -0.049 446 HB2 LYS 784 HB2 LYS 784 3.285 15.321 -1.521 447 HB3 LYS 784 HB3 LYS 784 2.741 16.124 -0.019 448 HG2 LYS 784 HG2 LYS 784 4.514 17.890 -0.637 449 HG3 LYS 784 HG3 LYS 784 4.511 17.138 -2.227 450 HD2 LYS 784 HD2 LYS 784 2.175 17.611 -2.494 451 HD3 LYS 784 HD3 LYS 784 2.075 18.228 -0.840 452 HE2 LYS 784 HE2 LYS 784 3.722 19.958 -1.427 453 HE3 LYS 784 HE3 LYS 784 3.702 19.399 -3.092 454 HZ1 LYS 784 HZ1 LYS 784 1.392 20.504 -1.599 455 HZ2 LYS 784 HZ2 LYS 784 1.347 19.955 -3.212 456 HZ3 LYS 784 HZ3 LYS 784 2.275 21.295 -2.800 457 H GLU 785 HN GLU 785 6.289 14.470 1.685 458 HA GLU 785 HA GLU 785 4.456 14.297 3.923 459 HB2 GLU 785 HB2 GLU 785 4.168 12.104 2.859 460 HB3 GLU 785 HB3 GLU 785 5.913 11.785 2.826 461 HG2 GLU 785 HG2 GLU 785 5.773 11.819 5.361 462 HG3 GLU 785 HG3 GLU 785 4.010 11.834 5.156 463 H ARG 786 HN ARG 786 5.682 14.615 5.792 464 HA ARG 786 HA ARG 786 8.512 15.087 5.253 465 HB2 ARG 786 HB2 ARG 786 7.351 17.075 5.969 466 HB3 ARG 786 HB3 ARG 786 6.646 16.234 7.336 467 HG2 ARG 786 HG2 ARG 786 8.995 15.897 8.188 468 HG3 ARG 786 HG3 ARG 786 9.532 17.026 6.954 469 HD2 ARG 786 HD2 ARG 786 9.208 18.176 9.080 470 HD3 ARG 786 HD3 ARG 786 7.987 18.729 7.928 471 HE ARG 786 HE ARG 786 6.604 16.861 9.075 472 HH11 ARG 786 HH11 ARG 786 8.788 19.093 10.746 473 HH12 ARG 786 HH12 ARG 786 7.970 19.035 12.227 474 HH21 ARG 786 HH21 ARG 786 5.458 16.779 11.079 475 HH22 ARG 786 HH22 ARG 786 5.986 17.662 12.413 476 H GLU 787 HN GLU 787 9.990 13.935 6.396 477 HA GLU 787 HA GLU 787 9.203 11.781 8.033 478 HB2 GLU 787 HB2 GLU 787 11.901 13.049 7.541 479 HB3 GLU 787 HB3 GLU 787 11.682 11.611 8.520 480 HG2 GLU 787 HG2 GLU 787 10.847 11.808 5.635 481 HG3 GLU 787 HG3 GLU 787 12.410 11.191 6.166 482 H ASP 788 HN ASP 788 9.503 11.543 10.281 483 HA ASP 788 HA ASP 788 9.185 14.001 11.782 484 HB2 ASP 788 HB2 ASP 788 7.789 12.109 12.333 485 HB3 ASP 788 HB3 ASP 788 9.192 11.089 12.656 486 H LEU 789 HN LEU 789 10.515 14.373 13.702 487 HA LEU 789 HA LEU 789 13.302 13.947 12.979 488 HB2 LEU 789 HB2 LEU 789 12.011 16.087 13.805 489 HB3 LEU 789 HB3 LEU 789 12.446 15.451 15.372 490 HG LEU 789 HG LEU 789 14.898 15.460 14.596 491 HD11 LEU 789 HD11 LEU 789 14.490 15.489 12.200 492 HD12 LEU 789 HD12 LEU 789 15.475 16.834 12.748 493 HD13 LEU 789 HD13 LEU 789 13.776 17.094 12.364 494 HD21 LEU 789 HD21 LEU 789 13.992 17.148 16.071 495 HD22 LEU 789 HD22 LEU 789 13.340 17.962 14.646 496 HD23 LEU 789 HD23 LEU 789 15.107 17.830 14.862 497 H ASP 790 HN ASP 790 13.498 11.875 13.480 498 HA ASP 790 HA ASP 790 12.915 10.984 16.252 499 HB2 ASP 790 HB2 ASP 790 11.717 9.843 14.278 500 HB3 ASP 790 HB3 ASP 790 13.292 9.092 14.011 501 H LEU 791 HN LEU 791 14.461 9.933 17.304 502 HA LEU 791 HA LEU 791 17.191 10.382 16.431 503 HB2 LEU 791 HB2 LEU 791 16.419 11.074 18.635 504 HB3 LEU 791 HB3 LEU 791 16.021 9.404 18.989 505 HG LEU 791 HG LEU 791 18.464 8.850 18.798 506 HD11 LEU 791 HD11 LEU 791 19.107 10.587 17.308 507 HD12 LEU 791 HD12 LEU 791 20.032 10.610 18.804 508 HD13 LEU 791 HD13 LEU 791 18.722 11.791 18.542 509 HD21 LEU 791 HD21 LEU 791 17.218 9.487 20.927 510 HD22 LEU 791 HD22 LEU 791 18.070 11.048 20.795 511 HD23 LEU 791 HD23 LEU 791 18.959 9.513 20.861 512 H ASP 792 HN ASP 792 15.074 7.745 16.981 513 HA ASP 792 HA ASP 792 17.201 5.822 17.232 514 HB2 ASP 792 HB2 ASP 792 15.010 5.581 18.316 515 HB3 ASP 792 HB3 ASP 792 14.307 5.174 16.753 516 H HIS 793 HN HIS 793 14.677 5.240 14.954 517 HA HIS 793 HA HIS 793 16.644 5.087 12.833 518 HB2 HIS 793 HB2 HIS 793 15.011 2.840 13.940 519 HB3 HIS 793 HB3 HIS 793 15.521 2.847 12.249 520 HD2 HIS 793 HD2 HIS 793 16.922 2.179 15.788 521 HE1 HIS 793 HE1 HIS 793 20.044 1.473 13.012 522 HE2 HIS 793 HE2 HIS 793 19.300 1.236 15.400 523 H SER 794 HN SER 794 15.425 4.775 10.740 524 HA SER 794 HA SER 794 12.556 5.119 10.587 525 HB2 SER 794 HB2 SER 794 14.093 7.628 9.641 526 HB3 SER 794 HB3 SER 794 12.389 7.327 9.697 527 HG SER 794 HG SER 794 13.150 6.932 12.112 528 H SER 795 HN SER 795 14.948 3.584 9.280 529 HA SER 795 HA SER 795 14.283 4.207 6.500 530 HB2 SER 795 HB2 SER 795 16.795 4.276 7.126 531 HB3 SER 795 HB3 SER 795 16.659 2.546 7.452 532 HG SER 795 HG SER 795 17.295 2.603 5.459 533 H LEU 796 HN LEU 796 13.595 2.475 5.212 534 HA LEU 796 HA LEU 796 12.679 0.180 6.774 535 HB2 LEU 796 HB2 LEU 796 11.675 1.442 4.258 536 HB3 LEU 796 HB3 LEU 796 11.148 -0.175 4.708 537 HG LEU 796 HG LEU 796 10.232 0.908 6.838 538 HD11 LEU 796 HD11 LEU 796 10.675 3.449 5.285 539 HD12 LEU 796 HD12 LEU 796 11.470 2.991 6.791 540 HD13 LEU 796 HD13 LEU 796 9.733 3.294 6.767 541 HD21 LEU 796 HD21 LEU 796 8.789 0.202 5.027 542 HD22 LEU 796 HD22 LEU 796 9.067 1.724 4.184 543 HD23 LEU 796 HD23 LEU 796 8.202 1.713 5.721 Start of MODEL 6 1 HA ASP 724 HA ASP 724 5.049 -1.206 15.013 2 HB2 ASP 724 HB2 ASP 724 6.348 -1.081 17.744 3 HB3 ASP 724 HB3 ASP 724 5.089 0.019 17.199 4 H ILE 725 HN ILE 725 8.339 -0.670 16.410 5 HA ILE 725 HA ILE 725 8.531 1.908 15.302 6 HB ILE 725 HB ILE 725 10.832 -0.009 15.958 7 HG12 ILE 725 HG12 ILE 725 9.644 2.162 17.746 8 HG13 ILE 725 HG13 ILE 725 9.275 0.445 17.892 9 HG21 ILE 725 HG21 ILE 725 12.040 2.193 16.340 10 HG22 ILE 725 HG22 ILE 725 10.701 2.956 15.458 11 HG23 ILE 725 HG23 ILE 725 11.731 1.776 14.666 12 HD11 ILE 725 HD11 ILE 725 11.975 1.734 18.224 13 HD12 ILE 725 HD12 ILE 725 11.623 0.016 18.407 14 HD13 ILE 725 HD13 ILE 725 10.913 1.186 19.520 15 H SER 726 HN SER 726 9.648 -1.290 14.154 16 HA SER 726 HA SER 726 9.597 -0.323 11.372 17 HB2 SER 726 HB2 SER 726 10.709 -2.865 12.604 18 HB3 SER 726 HB3 SER 726 10.848 -2.366 10.924 19 HG SER 726 HG SER 726 12.191 -0.806 11.440 20 H GLU 727 HN GLU 727 8.660 -2.102 9.882 21 HA GLU 727 HA GLU 727 6.338 -3.175 11.231 22 HB2 GLU 727 HB2 GLU 727 6.661 -2.372 8.325 23 HB3 GLU 727 HB3 GLU 727 5.204 -3.027 9.071 24 HG2 GLU 727 HG2 GLU 727 5.064 -1.085 10.545 25 HG3 GLU 727 HG3 GLU 727 6.522 -0.436 9.814 26 H SER 728 HN SER 728 5.612 -4.954 9.285 27 HA SER 728 HA SER 728 6.854 -7.120 10.464 28 HB2 SER 728 HB2 SER 728 5.337 -7.271 7.898 29 HB3 SER 728 HB3 SER 728 5.389 -8.402 9.264 30 HG SER 728 HG SER 728 4.047 -5.934 9.051 31 H LEU 729 HN LEU 729 7.120 -6.700 6.890 32 HA LEU 729 HA LEU 729 9.838 -7.130 6.688 33 HB2 LEU 729 HB2 LEU 729 9.274 -9.409 7.710 34 HB3 LEU 729 HB3 LEU 729 8.286 -9.716 6.330 35 HG LEU 729 HG LEU 729 10.237 -9.677 4.854 36 HD11 LEU 729 HD11 LEU 729 11.806 -9.268 7.394 37 HD12 LEU 729 HD12 LEU 729 11.618 -8.109 6.072 38 HD13 LEU 729 HD13 LEU 729 12.482 -9.619 5.805 39 HD21 LEU 729 HD21 LEU 729 9.537 -11.794 5.831 40 HD22 LEU 729 HD22 LEU 729 10.541 -11.488 7.246 41 HD23 LEU 729 HD23 LEU 729 11.292 -11.736 5.671 42 H ARG 730 HN ARG 730 7.794 -9.226 4.765 43 HA ARG 730 HA ARG 730 8.408 -7.683 2.527 44 HB2 ARG 730 HB2 ARG 730 6.504 -9.182 1.492 45 HB3 ARG 730 HB3 ARG 730 8.173 -9.760 1.639 46 HG2 ARG 730 HG2 ARG 730 7.527 -10.953 3.639 47 HG3 ARG 730 HG3 ARG 730 5.869 -10.316 3.530 48 HD2 ARG 730 HD2 ARG 730 5.600 -11.435 1.398 49 HD3 ARG 730 HD3 ARG 730 7.245 -12.030 1.454 50 HE ARG 730 HE ARG 730 6.469 -13.199 3.561 51 HH11 ARG 730 HH11 ARG 730 4.301 -12.610 0.781 52 HH12 ARG 730 HH12 ARG 730 3.379 -13.999 1.036 53 HH21 ARG 730 HH21 ARG 730 5.181 -15.113 3.880 54 HH22 ARG 730 HH22 ARG 730 3.888 -15.468 2.811 55 H GLN 731 HN GLN 731 5.558 -8.050 4.444 56 HA GLN 731 HA GLN 731 3.953 -6.271 2.851 57 HB2 GLN 731 HB2 GLN 731 2.745 -7.895 4.096 58 HB3 GLN 731 HB3 GLN 731 3.641 -7.531 5.558 59 HG2 GLN 731 HG2 GLN 731 1.314 -6.783 5.595 60 HG3 GLN 731 HG3 GLN 731 2.434 -5.458 5.853 61 HE21 GLN 731 HE21 GLN 731 1.598 -6.947 2.815 62 HE22 GLN 731 HE22 GLN 731 0.911 -5.526 2.082 63 H GLY 732 HN GLY 732 5.641 -6.230 5.825 64 HA2 GLY 732 HA3 GLY 732 4.954 -3.613 6.656 65 HA3 GLY 732 HA2 GLY 732 6.272 -4.571 7.290 66 H GLY 733 HN GLY 733 7.258 -4.748 4.397 67 HA2 GLY 733 HA3 GLY 733 8.256 -2.047 4.160 68 HA3 GLY 733 HA2 GLY 733 9.395 -3.373 4.268 69 H GLY 734 HN GLY 734 6.689 -2.211 2.349 70 HA2 GLY 734 HA3 GLY 734 8.015 -2.331 0.062 71 HA3 GLY 734 HA2 GLY 734 7.396 -3.955 0.173 72 H LYS 735 HN LYS 735 4.923 -3.862 1.006 73 HA LYS 735 HA LYS 735 3.547 -1.821 -0.450 74 HB2 LYS 735 HB2 LYS 735 2.543 -3.107 -2.068 75 HB3 LYS 735 HB3 LYS 735 4.219 -3.561 -2.201 76 HG2 LYS 735 HG2 LYS 735 1.950 -5.214 -1.042 77 HG3 LYS 735 HG3 LYS 735 2.831 -5.497 -2.504 78 HD2 LYS 735 HD2 LYS 735 4.126 -5.622 0.217 79 HD3 LYS 735 HD3 LYS 735 3.505 -7.023 -0.653 80 HE2 LYS 735 HE2 LYS 735 5.058 -6.513 -2.510 81 HE3 LYS 735 HE3 LYS 735 5.701 -5.164 -1.576 82 HZ1 LYS 735 HZ1 LYS 735 6.433 -6.760 0.120 83 HZ2 LYS 735 HZ2 LYS 735 7.093 -7.108 -1.376 84 HZ3 LYS 735 HZ3 LYS 735 5.830 -8.032 -0.810 85 H LEU 736 HN LEU 736 1.102 -2.112 -0.264 86 HA LEU 736 HA LEU 736 0.498 -3.837 2.073 87 HB2 LEU 736 HB2 LEU 736 -1.143 -1.369 1.767 88 HB3 LEU 736 HB3 LEU 736 -0.876 -2.357 3.141 89 HG LEU 736 HG LEU 736 1.600 -1.412 3.017 90 HD11 LEU 736 HD11 LEU 736 -0.025 0.874 1.949 91 HD12 LEU 736 HD12 LEU 736 1.112 -0.081 0.986 92 HD13 LEU 736 HD13 LEU 736 1.699 0.883 2.344 93 HD21 LEU 736 HD21 LEU 736 0.937 0.277 4.659 94 HD22 LEU 736 HD22 LEU 736 0.130 -1.265 4.937 95 HD23 LEU 736 HD23 LEU 736 -0.747 0.068 4.186 96 H ASN 737 HN ASN 737 -1.241 -5.115 1.897 97 HA ASN 737 HA ASN 737 -3.119 -4.562 -0.267 98 HB2 ASN 737 HB2 ASN 737 -2.019 -7.376 0.114 99 HB3 ASN 737 HB3 ASN 737 -3.071 -6.910 -1.165 100 HD21 ASN 737 HD21 ASN 737 -1.086 -4.468 -1.547 101 HD22 ASN 737 HD22 ASN 737 0.162 -5.212 -2.450 102 H PHE 738 HN PHE 738 -5.290 -5.416 0.242 103 HA PHE 738 HA PHE 738 -6.017 -5.685 2.905 104 HB2 PHE 738 HB2 PHE 738 -7.633 -5.591 1.049 105 HB3 PHE 738 HB3 PHE 738 -7.047 -7.168 0.537 106 HD1 PHE 738 HD2 PHE 738 -8.336 -5.660 3.637 107 HD2 PHE 738 HD1 PHE 738 -8.454 -8.873 0.941 108 HE1 PHE 738 HE2 PHE 738 -10.038 -6.741 5.037 109 HE2 PHE 738 HE1 PHE 738 -10.172 -9.991 2.307 110 HZ PHE 738 HZ PHE 738 -10.964 -8.914 4.366 111 H ASP 739 HN ASP 739 -5.492 -8.601 0.891 112 HA ASP 739 HA ASP 739 -5.265 -10.240 3.206 113 HB2 ASP 739 HB2 ASP 739 -5.048 -10.723 0.307 114 HB3 ASP 739 HB3 ASP 739 -4.167 -11.837 1.343 115 H GLU 740 HN GLU 740 -2.900 -8.449 1.456 116 HA GLU 740 HA GLU 740 -0.755 -9.935 2.809 117 HB2 GLU 740 HB2 GLU 740 -0.698 -8.888 0.368 118 HB3 GLU 740 HB3 GLU 740 -0.228 -7.440 1.248 119 HG2 GLU 740 HG2 GLU 740 1.774 -8.435 0.578 120 HG3 GLU 740 HG3 GLU 740 1.600 -8.910 2.275 121 H LEU 741 HN LEU 741 -2.360 -6.844 3.035 122 HA LEU 741 HA LEU 741 -0.710 -5.521 4.793 123 HB2 LEU 741 HB2 LEU 741 -2.492 -4.389 3.875 124 HB3 LEU 741 HB3 LEU 741 -3.725 -5.472 4.454 125 HG LEU 741 HG LEU 741 -2.585 -4.601 6.770 126 HD11 LEU 741 HD11 LEU 741 -2.191 -2.222 6.654 127 HD12 LEU 741 HD12 LEU 741 -2.348 -2.277 4.903 128 HD13 LEU 741 HD13 LEU 741 -1.018 -3.121 5.695 129 HD21 LEU 741 HD21 LEU 741 -4.899 -4.622 6.383 130 HD22 LEU 741 HD22 LEU 741 -4.753 -3.416 5.153 131 HD23 LEU 741 HD23 LEU 741 -4.480 -2.971 6.837 132 H ARG 742 HN ARG 742 -2.966 -8.114 5.169 133 HA ARG 742 HA ARG 742 -3.324 -8.150 7.968 134 HB2 ARG 742 HB2 ARG 742 -2.964 -10.802 6.681 135 HB3 ARG 742 HB3 ARG 742 -4.152 -10.223 7.800 136 HG2 ARG 742 HG2 ARG 742 -4.209 -9.312 5.053 137 HG3 ARG 742 HG3 ARG 742 -4.907 -10.905 5.456 138 HD2 ARG 742 HD2 ARG 742 -6.094 -9.118 7.265 139 HD3 ARG 742 HD3 ARG 742 -5.758 -8.160 5.886 140 HE ARG 742 HE ARG 742 -7.358 -9.059 4.746 141 HH11 ARG 742 HH11 ARG 742 -6.628 -11.504 7.264 142 HH12 ARG 742 HH12 ARG 742 -7.762 -12.592 6.644 143 HH21 ARG 742 HH21 ARG 742 -8.823 -10.650 3.921 144 HH22 ARG 742 HH22 ARG 742 -9.055 -12.103 4.703 145 H GLN 743 HN GLN 743 -0.701 -9.252 5.946 146 HA GLN 743 HA GLN 743 0.625 -10.780 7.793 147 HB2 GLN 743 HB2 GLN 743 1.248 -9.630 5.378 148 HB3 GLN 743 HB3 GLN 743 2.457 -8.997 6.484 149 HG2 GLN 743 HG2 GLN 743 3.592 -10.857 6.009 150 HG3 GLN 743 HG3 GLN 743 2.548 -11.589 7.212 151 HE21 GLN 743 HE21 GLN 743 1.614 -10.586 3.998 152 HE22 GLN 743 HE22 GLN 743 1.276 -12.125 3.368 153 H ASP 744 HN ASP 744 0.272 -7.454 7.477 154 HA ASP 744 HA ASP 744 2.137 -6.784 9.476 155 HB2 ASP 744 HB2 ASP 744 0.916 -5.332 7.523 156 HB3 ASP 744 HB3 ASP 744 0.187 -4.725 8.984 157 H LEU 745 HN LEU 745 -1.375 -6.723 9.169 158 HA LEU 745 HA LEU 745 -1.654 -6.662 12.061 159 HB2 LEU 745 HB2 LEU 745 -3.990 -5.755 11.343 160 HB3 LEU 745 HB3 LEU 745 -2.614 -4.673 11.568 161 HG LEU 745 HG LEU 745 -2.326 -5.067 8.995 162 HD11 LEU 745 HD11 LEU 745 -4.049 -6.848 9.036 163 HD12 LEU 745 HD12 LEU 745 -4.195 -5.652 7.784 164 HD13 LEU 745 HD13 LEU 745 -5.294 -5.599 9.162 165 HD21 LEU 745 HD21 LEU 745 -3.803 -3.148 8.588 166 HD22 LEU 745 HD22 LEU 745 -2.776 -2.962 9.989 167 HD23 LEU 745 HD23 LEU 745 -4.484 -3.306 10.212 168 H LYS 746 HN LYS 746 -1.309 -9.082 10.882 169 HA LYS 746 HA LYS 746 -3.531 -10.455 10.210 170 HB2 LYS 746 HB2 LYS 746 -1.013 -11.448 11.513 171 HB3 LYS 746 HB3 LYS 746 -2.303 -12.612 11.194 172 HG2 LYS 746 HG2 LYS 746 -1.890 -11.464 8.701 173 HG3 LYS 746 HG3 LYS 746 -0.377 -11.235 9.469 174 HD2 LYS 746 HD2 LYS 746 0.027 -13.496 9.898 175 HD3 LYS 746 HD3 LYS 746 -1.621 -13.950 9.472 176 HE2 LYS 746 HE2 LYS 746 -1.222 -13.260 7.152 177 HE3 LYS 746 HE3 LYS 746 0.416 -12.786 7.572 178 HZ1 LYS 746 HZ1 LYS 746 1.002 -15.014 7.999 179 HZ2 LYS 746 HZ2 LYS 746 0.157 -15.037 6.517 180 HZ3 LYS 746 HZ3 LYS 746 -0.601 -15.524 7.936 181 H GLY 747 HN GLY 747 -5.364 -10.345 11.383 182 HA2 GLY 747 HA3 GLY 747 -6.659 -11.473 13.104 183 HA3 GLY 747 HA2 GLY 747 -5.283 -11.264 14.170 184 H LYS 748 HN LYS 748 -8.077 -9.764 12.768 185 HA LYS 748 HA LYS 748 -8.203 -8.026 14.913 186 HB2 LYS 748 HB2 LYS 748 -7.910 -5.810 14.060 187 HB3 LYS 748 HB3 LYS 748 -6.536 -6.769 13.538 188 HG2 LYS 748 HG2 LYS 748 -8.895 -5.978 11.871 189 HG3 LYS 748 HG3 LYS 748 -7.272 -5.311 11.790 190 HD2 LYS 748 HD2 LYS 748 -6.362 -7.273 10.930 191 HD3 LYS 748 HD3 LYS 748 -7.659 -8.234 11.503 192 HE2 LYS 748 HE2 LYS 748 -9.163 -7.279 10.013 193 HE3 LYS 748 HE3 LYS 748 -8.008 -6.160 9.366 194 HZ1 LYS 748 HZ1 LYS 748 -8.055 -7.993 7.879 195 HZ2 LYS 748 HZ2 LYS 748 -7.999 -9.117 9.158 196 HZ3 LYS 748 HZ3 LYS 748 -6.641 -8.210 8.791 197 H GLY 749 HN GLY 749 -9.514 -9.041 11.888 198 HA2 GLY 749 HA3 GLY 749 -11.985 -7.811 12.707 199 HA3 GLY 749 HA2 GLY 749 -11.621 -8.009 11.037 200 H HIS 750 HN HIS 750 -13.865 -9.114 11.616 201 HA HIS 750 HA HIS 750 -13.479 -11.857 12.472 202 HB2 HIS 750 HB2 HIS 750 -15.998 -10.354 11.767 203 HB3 HIS 750 HB3 HIS 750 -15.991 -12.083 12.073 204 HD2 HIS 750 HD2 HIS 750 -15.872 -8.734 14.037 205 HE1 HIS 750 HE1 HIS 750 -15.711 -11.895 16.849 206 HE2 HIS 750 HE2 HIS 750 -15.637 -9.425 16.505 207 H THR 751 HN THR 751 -15.301 -10.642 9.671 208 HA THR 751 HA THR 751 -14.172 -12.890 8.099 209 HB THR 751 HB THR 751 -16.610 -11.677 7.072 210 HG1 THR 751 HG1 THR 751 -17.301 -11.381 9.209 211 HG21 THR 751 HG21 THR 751 -15.919 -14.456 8.052 212 HG22 THR 751 HG22 THR 751 -15.787 -13.914 6.382 213 HG23 THR 751 HG23 THR 751 -17.362 -14.044 7.149 214 H ASP 752 HN ASP 752 -13.518 -12.535 6.018 215 HA ASP 752 HA ASP 752 -11.989 -10.286 5.503 216 HB2 ASP 752 HB2 ASP 752 -13.254 -12.131 3.421 217 HB3 ASP 752 HB3 ASP 752 -11.834 -11.111 3.236 218 H ALA 753 HN ALA 753 -15.331 -10.870 4.683 219 HA ALA 753 HA ALA 753 -15.627 -8.721 2.884 220 HB1 ALA 753 HB1 ALA 753 -17.768 -10.004 4.566 221 HB2 ALA 753 HB2 ALA 753 -17.206 -10.601 3.014 222 HB3 ALA 753 HB3 ALA 753 -18.029 -9.041 3.115 223 H GLU 754 HN GLU 754 -16.199 -8.919 6.291 224 HA GLU 754 HA GLU 754 -17.221 -6.349 6.698 225 HB2 GLU 754 HB2 GLU 754 -15.867 -8.428 8.296 226 HB3 GLU 754 HB3 GLU 754 -16.061 -6.844 9.031 227 HG2 GLU 754 HG2 GLU 754 -18.484 -7.155 8.807 228 HG3 GLU 754 HG3 GLU 754 -18.208 -8.671 7.944 229 H ILE 755 HN ILE 755 -13.994 -7.626 6.735 230 HA ILE 755 HA ILE 755 -12.740 -5.170 7.638 231 HB ILE 755 HB ILE 755 -11.425 -7.541 6.317 232 HG12 ILE 755 HG12 ILE 755 -11.857 -7.181 9.272 233 HG13 ILE 755 HG13 ILE 755 -12.974 -8.116 8.295 234 HG21 ILE 755 HG21 ILE 755 -10.156 -5.423 6.644 235 HG22 ILE 755 HG22 ILE 755 -9.499 -6.768 7.551 236 HG23 ILE 755 HG23 ILE 755 -10.471 -5.549 8.374 237 HD11 ILE 755 HD11 ILE 755 -11.322 -9.878 7.956 238 HD12 ILE 755 HD12 ILE 755 -11.176 -9.383 9.598 239 HD13 ILE 755 HD13 ILE 755 -10.033 -8.785 8.398 240 H GLU 756 HN GLU 756 -13.239 -6.791 4.537 241 HA GLU 756 HA GLU 756 -11.518 -5.212 3.098 242 HB2 GLU 756 HB2 GLU 756 -12.445 -7.439 2.413 243 HB3 GLU 756 HB3 GLU 756 -13.972 -6.610 2.099 244 HG2 GLU 756 HG2 GLU 756 -12.772 -5.241 0.357 245 HG3 GLU 756 HG3 GLU 756 -11.327 -6.163 0.718 246 H ALA 757 HN ALA 757 -14.959 -5.001 3.662 247 HA ALA 757 HA ALA 757 -15.427 -2.645 2.129 248 HB1 ALA 757 HB1 ALA 757 -16.958 -4.111 4.234 249 HB2 ALA 757 HB2 ALA 757 -17.397 -3.767 2.530 250 HB3 ALA 757 HB3 ALA 757 -17.464 -2.506 3.736 251 H ILE 758 HN ILE 758 -14.917 -3.172 5.614 252 HA ILE 758 HA ILE 758 -15.484 -0.618 6.469 253 HB ILE 758 HB ILE 758 -15.266 -2.529 8.033 254 HG12 ILE 758 HG12 ILE 758 -14.944 0.013 8.699 255 HG13 ILE 758 HG13 ILE 758 -14.751 -1.283 9.892 256 HG21 ILE 758 HG21 ILE 758 -13.253 -3.472 7.105 257 HG22 ILE 758 HG22 ILE 758 -13.175 -3.327 8.868 258 HG23 ILE 758 HG23 ILE 758 -12.300 -2.184 7.840 259 HD11 ILE 758 HD11 ILE 758 -13.014 0.559 9.971 260 HD12 ILE 758 HD12 ILE 758 -12.368 -0.095 8.434 261 HD13 ILE 758 HD13 ILE 758 -12.417 -1.078 9.860 262 H PHE 759 HN PHE 759 -12.354 -2.012 5.491 263 HA PHE 759 HA PHE 759 -10.879 0.266 6.152 264 HB2 PHE 759 HB2 PHE 759 -9.015 -0.884 5.274 265 HB3 PHE 759 HB3 PHE 759 -10.155 -2.152 5.598 266 HD1 PHE 759 HD2 PHE 759 -9.287 0.045 2.634 267 HD2 PHE 759 HD1 PHE 759 -10.345 -3.816 4.053 268 HE1 PHE 759 HE2 PHE 759 -9.108 -0.829 0.365 269 HE2 PHE 759 HE1 PHE 759 -10.125 -4.693 1.749 270 HZ PHE 759 HZ PHE 759 -9.517 -3.208 -0.074 271 H THR 760 HN THR 760 -12.764 -0.465 3.378 272 HA THR 760 HA THR 760 -11.479 1.185 1.520 273 HB THR 760 HB THR 760 -14.382 0.275 1.639 274 HG1 THR 760 HG1 THR 760 -13.166 -1.615 1.486 275 HG21 THR 760 HG21 THR 760 -14.366 0.531 -0.753 276 HG22 THR 760 HG22 THR 760 -12.675 1.013 -0.669 277 HG23 THR 760 HG23 THR 760 -13.924 2.098 -0.043 278 H LYS 761 HN LYS 761 -13.913 1.728 3.863 279 HA LYS 761 HA LYS 761 -14.013 4.592 3.141 280 HB2 LYS 761 HB2 LYS 761 -16.090 3.108 3.730 281 HB3 LYS 761 HB3 LYS 761 -15.585 3.442 5.363 282 HG2 LYS 761 HG2 LYS 761 -15.999 5.855 5.122 283 HG3 LYS 761 HG3 LYS 761 -16.128 5.640 3.390 284 HD2 LYS 761 HD2 LYS 761 -18.308 5.948 4.400 285 HD3 LYS 761 HD3 LYS 761 -18.173 4.341 3.693 286 HE2 LYS 761 HE2 LYS 761 -19.245 4.083 5.802 287 HE3 LYS 761 HE3 LYS 761 -17.599 3.497 5.980 288 HZ1 LYS 761 HZ1 LYS 761 -18.577 6.152 6.805 289 HZ2 LYS 761 HZ2 LYS 761 -17.010 5.597 7.055 290 HZ3 LYS 761 HZ3 LYS 761 -18.327 4.863 7.840 291 H TYR 762 HN TYR 762 -13.103 2.585 5.966 292 HA TYR 762 HA TYR 762 -12.366 5.006 7.409 293 HB2 TYR 762 HB2 TYR 762 -12.762 2.168 8.214 294 HB3 TYR 762 HB3 TYR 762 -11.870 3.275 9.236 295 HD1 TYR 762 HD1 TYR 762 -13.018 5.127 10.257 296 HD2 TYR 762 HD2 TYR 762 -15.218 2.260 8.030 297 HE1 TYR 762 HE1 TYR 762 -15.126 5.847 11.382 298 HE2 TYR 762 HE2 TYR 762 -17.283 2.957 9.145 299 HH TYR 762 HH TYR 762 -17.568 5.764 10.933 300 H ASP 763 HN ASP 763 -10.681 2.483 5.687 301 HA ASP 763 HA ASP 763 -8.252 2.524 7.107 302 HB2 ASP 763 HB2 ASP 763 -8.952 0.889 5.252 303 HB3 ASP 763 HB3 ASP 763 -8.494 2.103 4.135 304 H GLN 764 HN GLN 764 -6.255 3.472 6.498 305 HA GLN 764 HA GLN 764 -6.370 6.216 6.116 306 HB2 GLN 764 HB2 GLN 764 -4.463 5.112 7.196 307 HB3 GLN 764 HB3 GLN 764 -4.000 4.378 5.672 308 HG2 GLN 764 HG2 GLN 764 -3.747 6.821 4.797 309 HG3 GLN 764 HG3 GLN 764 -3.897 7.248 6.479 310 HE21 GLN 764 HE21 GLN 764 -1.959 5.448 4.207 311 HE22 GLN 764 HE22 GLN 764 -0.519 5.471 5.159 312 H ASP 765 HN ASP 765 -5.589 3.648 3.709 313 HA ASP 765 HA ASP 765 -5.742 5.812 1.695 314 HB2 ASP 765 HB2 ASP 765 -4.441 3.097 1.429 315 HB3 ASP 765 HB3 ASP 765 -4.559 4.343 0.220 316 H GLY 766 HN GLY 766 -7.537 3.222 2.852 317 HA2 GLY 766 HA3 GLY 766 -9.545 2.208 2.006 318 HA3 GLY 766 HA2 GLY 766 -9.674 3.668 1.052 319 H ASP 767 HN ASP 767 -6.837 1.864 0.639 320 HA ASP 767 HA ASP 767 -7.745 0.950 -1.997 321 HB2 ASP 767 HB2 ASP 767 -5.053 1.916 -0.999 322 HB3 ASP 767 HB3 ASP 767 -5.127 0.858 -2.412 323 H GLN 768 HN GLN 768 -5.212 0.130 0.270 324 HA GLN 768 HA GLN 768 -4.356 -1.889 1.070 325 HB2 GLN 768 HB2 GLN 768 -6.637 -1.131 2.325 326 HB3 GLN 768 HB3 GLN 768 -7.140 -2.691 1.788 327 HG2 GLN 768 HG2 GLN 768 -5.283 -3.690 2.873 328 HG3 GLN 768 HG3 GLN 768 -4.803 -2.092 3.463 329 HE21 GLN 768 HE21 GLN 768 -7.118 -4.599 3.702 330 HE22 GLN 768 HE22 GLN 768 -7.945 -3.985 5.097 331 H GLU 769 HN GLU 769 -3.670 -2.781 -0.821 332 HA GLU 769 HA GLU 769 -3.957 -5.267 -1.510 333 HB2 GLU 769 HB2 GLU 769 -5.602 -5.736 -3.218 334 HB3 GLU 769 HB3 GLU 769 -6.434 -4.997 -1.869 335 HG2 GLU 769 HG2 GLU 769 -6.823 -2.950 -3.204 336 HG3 GLU 769 HG3 GLU 769 -5.649 -3.524 -4.350 337 H LEU 770 HN LEU 770 -2.315 -2.800 -1.962 338 HA LEU 770 HA LEU 770 -2.044 -3.007 -4.832 339 HB2 LEU 770 HB2 LEU 770 -2.031 -0.671 -3.001 340 HB3 LEU 770 HB3 LEU 770 -0.964 -0.555 -4.336 341 HG LEU 770 HG LEU 770 -3.079 -0.821 -5.801 342 HD11 LEU 770 HD11 LEU 770 -4.353 -0.701 -3.107 343 HD12 LEU 770 HD12 LEU 770 -4.697 -1.826 -4.425 344 HD13 LEU 770 HD13 LEU 770 -5.173 -0.144 -4.550 345 HD21 LEU 770 HD21 LEU 770 -3.784 1.466 -5.452 346 HD22 LEU 770 HD22 LEU 770 -2.025 1.339 -5.367 347 HD23 LEU 770 HD23 LEU 770 -2.972 1.492 -3.891 348 H THR 771 HN THR 771 0.123 -3.570 -5.575 349 HA THR 771 HA THR 771 2.061 -3.969 -3.526 350 HB THR 771 HB THR 771 3.296 -5.209 -5.082 351 HG1 THR 771 HG1 THR 771 3.201 -4.892 -7.161 352 HG21 THR 771 HG21 THR 771 0.445 -5.311 -5.905 353 HG22 THR 771 HG22 THR 771 1.281 -6.284 -4.694 354 HG23 THR 771 HG23 THR 771 1.658 -6.503 -6.409 355 H GLU 772 HN GLU 772 4.453 -3.224 -4.059 356 HA GLU 772 HA GLU 772 4.587 -0.469 -4.070 357 HB2 GLU 772 HB2 GLU 772 6.191 -2.146 -3.092 358 HB3 GLU 772 HB3 GLU 772 6.786 -2.446 -4.700 359 HG2 GLU 772 HG2 GLU 772 6.874 0.295 -3.593 360 HG3 GLU 772 HG3 GLU 772 8.130 -0.890 -3.227 361 H HIS 773 HN HIS 773 4.750 -2.865 -6.638 362 HA HIS 773 HA HIS 773 5.761 -0.976 -8.571 363 HB2 HIS 773 HB2 HIS 773 4.435 -3.663 -9.049 364 HB3 HIS 773 HB3 HIS 773 5.114 -2.655 -10.294 365 HD2 HIS 773 HD2 HIS 773 6.537 -4.468 -7.085 366 HE1 HIS 773 HE1 HIS 773 9.552 -4.183 -10.036 367 HE2 HIS 773 HE2 HIS 773 8.863 -5.242 -7.869 368 H GLU 774 HN GLU 774 2.546 -1.927 -7.552 369 HA GLU 774 HA GLU 774 1.356 -0.430 -9.724 370 HB2 GLU 774 HB2 GLU 774 -0.115 -1.205 -7.173 371 HB3 GLU 774 HB3 GLU 774 -0.691 -0.796 -8.799 372 HG2 GLU 774 HG2 GLU 774 0.040 -2.775 -9.752 373 HG3 GLU 774 HG3 GLU 774 0.997 -3.198 -8.350 374 H HIS 775 HN HIS 775 2.104 0.138 -6.395 375 HA HIS 775 HA HIS 775 0.906 2.696 -5.983 376 HB2 HIS 775 HB2 HIS 775 1.536 1.163 -4.169 377 HB3 HIS 775 HB3 HIS 775 3.213 1.252 -4.676 378 HD2 HIS 775 HD2 HIS 775 4.347 2.511 -2.634 379 HE1 HIS 775 HE1 HIS 775 1.647 5.776 -2.337 380 HE2 HIS 775 HE2 HIS 775 3.681 4.685 -1.358 381 H GLN 776 HN GLN 776 3.919 1.603 -7.278 382 HA GLN 776 HA GLN 776 5.268 4.017 -7.383 383 HB2 GLN 776 HB2 GLN 776 6.147 1.676 -7.762 384 HB3 GLN 776 HB3 GLN 776 5.475 1.783 -9.378 385 HG2 GLN 776 HG2 GLN 776 7.874 2.230 -9.332 386 HG3 GLN 776 HG3 GLN 776 6.955 3.621 -9.904 387 HE21 GLN 776 HE21 GLN 776 8.684 2.290 -7.161 388 HE22 GLN 776 HE22 GLN 776 9.011 3.806 -6.411 389 H GLN 777 HN GLN 777 2.851 2.647 -9.437 390 HA GLN 777 HA GLN 777 3.265 4.594 -11.531 391 HB2 GLN 777 HB2 GLN 777 1.115 2.478 -11.363 392 HB3 GLN 777 HB3 GLN 777 1.650 3.324 -12.801 393 HG2 GLN 777 HG2 GLN 777 3.560 2.106 -13.014 394 HG3 GLN 777 HG3 GLN 777 3.629 1.697 -11.305 395 HE21 GLN 777 HE21 GLN 777 0.801 0.836 -11.218 396 HE22 GLN 777 HE22 GLN 777 0.750 -0.701 -11.953 397 H MET 778 HN MET 778 0.843 3.894 -9.089 398 HA MET 778 HA MET 778 -1.055 5.680 -10.352 399 HB2 MET 778 HB2 MET 778 -1.350 3.796 -8.035 400 HB3 MET 778 HB3 MET 778 -2.678 4.847 -8.603 401 HG2 MET 778 HG2 MET 778 -2.921 3.790 -10.562 402 HG3 MET 778 HG3 MET 778 -1.373 2.999 -10.594 403 HE1 MET 778 HE1 MET 778 -5.016 3.082 -9.205 404 HE2 MET 778 HE2 MET 778 -4.110 3.212 -7.690 405 HE3 MET 778 HE3 MET 778 -5.036 1.757 -8.042 406 H ARG 779 HN ARG 779 -0.576 5.762 -6.724 407 HA ARG 779 HA ARG 779 -1.155 8.513 -7.128 408 HB2 ARG 779 HB2 ARG 779 -1.216 6.807 -4.702 409 HB3 ARG 779 HB3 ARG 779 -1.144 8.544 -4.543 410 HG2 ARG 779 HG2 ARG 779 -3.173 8.747 -5.931 411 HG3 ARG 779 HG3 ARG 779 -3.283 6.981 -5.957 412 HD2 ARG 779 HD2 ARG 779 -3.396 8.753 -3.504 413 HD3 ARG 779 HD3 ARG 779 -4.726 7.890 -4.257 414 HE ARG 779 HE ARG 779 -3.381 5.878 -3.866 415 HH11 ARG 779 HH11 ARG 779 -2.987 8.655 -1.682 416 HH12 ARG 779 HH12 ARG 779 -2.822 7.690 -0.290 417 HH21 ARG 779 HH21 ARG 779 -3.202 4.592 -1.922 418 HH22 ARG 779 HH22 ARG 779 -2.894 5.413 -0.429 419 H ASP 780 HN ASP 780 -0.157 9.803 -5.168 420 HA ASP 780 HA ASP 780 2.688 9.785 -5.712 421 HB2 ASP 780 HB2 ASP 780 0.837 12.144 -6.016 422 HB3 ASP 780 HB3 ASP 780 2.595 12.026 -6.330 423 H ASP 781 HN ASP 781 3.167 9.451 -3.441 424 HA ASP 781 HA ASP 781 1.910 11.203 -1.432 425 HB2 ASP 781 HB2 ASP 781 2.515 8.781 -0.942 426 HB3 ASP 781 HB3 ASP 781 4.196 9.265 -0.947 427 H LEU 782 HN LEU 782 5.068 10.757 -2.697 428 HA LEU 782 HA LEU 782 6.276 12.914 -1.062 429 HB2 LEU 782 HB2 LEU 782 7.477 10.840 -2.049 430 HB3 LEU 782 HB3 LEU 782 7.448 11.705 -3.559 431 HG LEU 782 HG LEU 782 8.740 13.554 -2.492 432 HD11 LEU 782 HD11 LEU 782 9.956 13.073 -0.455 433 HD12 LEU 782 HD12 LEU 782 9.048 11.581 -0.250 434 HD13 LEU 782 HD13 LEU 782 8.222 13.137 -0.163 435 HD21 LEU 782 HD21 LEU 782 9.739 11.832 -3.917 436 HD22 LEU 782 HD22 LEU 782 10.032 10.837 -2.486 437 HD23 LEU 782 HD23 LEU 782 10.816 12.410 -2.658 438 H GLU 783 HN GLU 783 4.667 12.667 -4.054 439 HA GLU 783 HA GLU 783 5.580 14.766 -5.613 440 HB2 GLU 783 HB2 GLU 783 3.908 13.335 -6.297 441 HB3 GLU 783 HB3 GLU 783 2.708 13.988 -5.193 442 HG2 GLU 783 HG2 GLU 783 2.220 14.980 -7.413 443 HG3 GLU 783 HG3 GLU 783 2.952 16.178 -6.383 444 H LYS 784 HN LYS 784 3.502 14.659 -2.766 445 HA LYS 784 HA LYS 784 3.541 17.438 -2.642 446 HB2 LYS 784 HB2 LYS 784 1.290 15.917 -3.386 447 HB3 LYS 784 HB3 LYS 784 0.877 17.059 -2.075 448 HG2 LYS 784 HG2 LYS 784 2.325 18.617 -3.782 449 HG3 LYS 784 HG3 LYS 784 1.608 17.467 -4.914 450 HD2 LYS 784 HD2 LYS 784 0.108 19.288 -4.744 451 HD3 LYS 784 HD3 LYS 784 -0.537 17.910 -3.810 452 HE2 LYS 784 HE2 LYS 784 -0.808 20.037 -2.581 453 HE3 LYS 784 HE3 LYS 784 0.210 18.895 -1.729 454 HZ1 LYS 784 HZ1 LYS 784 2.166 20.125 -2.468 455 HZ2 LYS 784 HZ2 LYS 784 1.080 21.142 -1.693 456 HZ3 LYS 784 HZ3 LYS 784 1.187 21.174 -3.359 457 H GLU 785 HN GLU 785 4.831 16.619 -0.823 458 HA GLU 785 HA GLU 785 3.705 16.764 1.678 459 HB2 GLU 785 HB2 GLU 785 2.913 14.445 1.111 460 HB3 GLU 785 HB3 GLU 785 4.582 13.897 1.030 461 HG2 GLU 785 HG2 GLU 785 3.350 15.067 3.517 462 HG3 GLU 785 HG3 GLU 785 3.196 13.368 3.107 463 H ARG 786 HN ARG 786 5.338 17.321 2.956 464 HA ARG 786 HA ARG 786 8.021 16.894 1.899 465 HB2 ARG 786 HB2 ARG 786 7.366 19.186 1.448 466 HB3 ARG 786 HB3 ARG 786 7.041 19.435 3.162 467 HG2 ARG 786 HG2 ARG 786 9.367 19.101 3.693 468 HG3 ARG 786 HG3 ARG 786 9.731 18.739 2.013 469 HD2 ARG 786 HD2 ARG 786 8.650 21.350 3.044 470 HD3 ARG 786 HD3 ARG 786 10.341 21.034 2.656 471 HE ARG 786 HE ARG 786 8.476 20.559 0.506 472 HH11 ARG 786 HH11 ARG 786 10.573 22.947 2.052 473 HH12 ARG 786 HH12 ARG 786 10.811 23.863 0.645 474 HH21 ARG 786 HH21 ARG 786 8.715 21.856 -1.385 475 HH22 ARG 786 HH22 ARG 786 9.726 23.240 -1.365 476 H GLU 787 HN GLU 787 9.293 15.894 3.236 477 HA GLU 787 HA GLU 787 8.608 15.162 5.822 478 HB2 GLU 787 HB2 GLU 787 11.399 15.127 4.668 479 HB3 GLU 787 HB3 GLU 787 10.740 14.054 5.898 480 HG2 GLU 787 HG2 GLU 787 10.737 12.685 4.065 481 HG3 GLU 787 HG3 GLU 787 9.127 13.386 3.913 482 H ASP 788 HN ASP 788 9.543 15.797 7.826 483 HA ASP 788 HA ASP 788 10.279 18.560 7.981 484 HB2 ASP 788 HB2 ASP 788 8.900 17.703 9.701 485 HB3 ASP 788 HB3 ASP 788 10.004 16.360 10.029 486 H LEU 789 HN LEU 789 12.247 19.250 9.149 487 HA LEU 789 HA LEU 789 14.519 17.720 8.204 488 HB2 LEU 789 HB2 LEU 789 14.025 20.268 7.965 489 HB3 LEU 789 HB3 LEU 789 14.729 20.353 9.563 490 HG LEU 789 HG LEU 789 16.824 19.202 8.614 491 HD11 LEU 789 HD11 LEU 789 15.463 19.745 6.015 492 HD12 LEU 789 HD12 LEU 789 15.842 18.160 6.697 493 HD13 LEU 789 HD13 LEU 789 17.137 19.263 6.248 494 HD21 LEU 789 HD21 LEU 789 17.655 21.135 7.604 495 HD22 LEU 789 HD22 LEU 789 16.675 21.616 8.998 496 HD23 LEU 789 HD23 LEU 789 16.036 21.787 7.348 497 H ASP 790 HN ASP 790 14.534 16.156 9.669 498 HA ASP 790 HA ASP 790 14.575 16.716 12.589 499 HB2 ASP 790 HB2 ASP 790 13.085 14.878 11.418 500 HB3 ASP 790 HB3 ASP 790 14.574 13.944 11.381 501 H LEU 791 HN LEU 791 16.166 14.932 13.651 502 HA LEU 791 HA LEU 791 18.674 15.161 12.161 503 HB2 LEU 791 HB2 LEU 791 18.478 16.670 14.173 504 HB3 LEU 791 HB3 LEU 791 18.496 15.268 15.177 505 HG LEU 791 HG LEU 791 20.750 16.321 13.472 506 HD11 LEU 791 HD11 LEU 791 21.800 16.768 15.596 507 HD12 LEU 791 HD12 LEU 791 20.336 16.250 16.431 508 HD13 LEU 791 HD13 LEU 791 20.303 17.670 15.379 509 HD21 LEU 791 HD21 LEU 791 20.648 13.827 15.189 510 HD22 LEU 791 HD22 LEU 791 22.117 14.722 14.919 511 HD23 LEU 791 HD23 LEU 791 21.314 14.013 13.542 512 H ASP 792 HN ASP 792 17.142 13.231 14.599 513 HA ASP 792 HA ASP 792 18.139 10.769 13.323 514 HB2 ASP 792 HB2 ASP 792 20.027 11.510 14.593 515 HB3 ASP 792 HB3 ASP 792 19.146 11.455 16.087 516 H HIS 793 HN HIS 793 17.232 11.381 16.616 517 HA HIS 793 HA HIS 793 14.551 10.137 16.329 518 HB2 HIS 793 HB2 HIS 793 16.405 8.780 17.536 519 HB3 HIS 793 HB3 HIS 793 16.415 10.060 18.740 520 HD2 HIS 793 HD2 HIS 793 14.013 7.189 17.590 521 HE1 HIS 793 HE1 HIS 793 12.833 8.586 21.411 522 HE2 HIS 793 HE2 HIS 793 12.233 7.151 19.458 523 H SER 794 HN SER 794 13.199 11.227 18.119 524 HA SER 794 HA SER 794 14.113 13.766 19.212 525 HB2 SER 794 HB2 SER 794 12.429 14.992 17.781 526 HB3 SER 794 HB3 SER 794 13.999 14.575 17.068 527 HG SER 794 HG SER 794 12.672 13.901 15.528 528 H SER 795 HN SER 795 12.825 11.489 20.217 529 HA SER 795 HA SER 795 10.264 12.626 20.842 530 HB2 SER 795 HB2 SER 795 10.065 10.255 20.174 531 HB3 SER 795 HB3 SER 795 11.176 9.775 21.471 532 HG SER 795 HG SER 795 8.874 9.526 21.753 533 H LEU 796 HN LEU 796 9.936 13.393 22.893 534 HA LEU 796 HA LEU 796 12.216 13.418 24.747 535 HB2 LEU 796 HB2 LEU 796 9.824 15.179 24.447 536 HB3 LEU 796 HB3 LEU 796 10.978 15.360 25.769 537 HG LEU 796 HG LEU 796 11.537 17.043 24.267 538 HD11 LEU 796 HD11 LEU 796 13.503 15.842 24.916 539 HD12 LEU 796 HD12 LEU 796 13.679 16.472 23.278 540 HD13 LEU 796 HD13 LEU 796 13.339 14.764 23.528 541 HD21 LEU 796 HD21 LEU 796 11.742 16.775 21.822 542 HD22 LEU 796 HD22 LEU 796 10.115 16.415 22.398 543 HD23 LEU 796 HD23 LEU 796 11.213 15.099 21.976 Start of MODEL 7 1 HA ASP 724 HA ASP 724 10.954 2.506 7.650 2 HB2 ASP 724 HB2 ASP 724 10.785 3.511 5.289 3 HB3 ASP 724 HB3 ASP 724 9.106 3.838 5.671 4 H ILE 725 HN ILE 725 7.595 2.299 6.475 5 HA ILE 725 HA ILE 725 6.630 3.480 8.812 6 HB ILE 725 HB ILE 725 5.074 1.967 6.687 7 HG12 ILE 725 HG12 ILE 725 5.472 4.953 7.070 8 HG13 ILE 725 HG13 ILE 725 6.353 3.970 5.910 9 HG21 ILE 725 HG21 ILE 725 4.110 3.820 8.881 10 HG22 ILE 725 HG22 ILE 725 3.744 2.096 8.740 11 HG23 ILE 725 HG23 ILE 725 3.122 3.231 7.552 12 HD11 ILE 725 HD11 ILE 725 4.296 3.473 4.743 13 HD12 ILE 725 HD12 ILE 725 4.514 5.218 4.887 14 HD13 ILE 725 HD13 ILE 725 3.370 4.381 5.937 15 H SER 726 HN SER 726 6.504 0.065 7.770 16 HA SER 726 HA SER 726 5.454 -0.544 10.454 17 HB2 SER 726 HB2 SER 726 5.217 -2.115 7.929 18 HB3 SER 726 HB3 SER 726 4.501 -2.535 9.491 19 HG SER 726 HG SER 726 2.985 -1.508 8.344 20 H GLU 727 HN GLU 727 7.889 -1.836 8.183 21 HA GLU 727 HA GLU 727 9.796 -2.880 8.537 22 HB2 GLU 727 HB2 GLU 727 9.142 -2.206 11.264 23 HB3 GLU 727 HB3 GLU 727 10.431 -3.390 11.065 24 HG2 GLU 727 HG2 GLU 727 11.502 -1.229 11.162 25 HG3 GLU 727 HG3 GLU 727 11.487 -1.913 9.519 26 H SER 728 HN SER 728 7.097 -4.077 9.169 27 HA SER 728 HA SER 728 7.245 -6.546 10.468 28 HB2 SER 728 HB2 SER 728 5.653 -6.406 7.908 29 HB3 SER 728 HB3 SER 728 5.293 -7.197 9.428 30 HG SER 728 HG SER 728 4.296 -4.960 8.883 31 H LEU 729 HN LEU 729 7.490 -6.489 6.897 32 HA LEU 729 HA LEU 729 9.989 -7.468 6.593 33 HB2 LEU 729 HB2 LEU 729 8.846 -9.554 7.784 34 HB3 LEU 729 HB3 LEU 729 8.139 -9.863 6.228 35 HG LEU 729 HG LEU 729 11.089 -9.877 6.899 36 HD11 LEU 729 HD11 LEU 729 9.918 -11.759 7.818 37 HD12 LEU 729 HD12 LEU 729 10.944 -12.275 6.479 38 HD13 LEU 729 HD13 LEU 729 9.203 -12.117 6.246 39 HD21 LEU 729 HD21 LEU 729 11.472 -10.772 4.655 40 HD22 LEU 729 HD22 LEU 729 10.763 -9.160 4.564 41 HD23 LEU 729 HD23 LEU 729 9.763 -10.584 4.270 42 H ARG 730 HN ARG 730 7.611 -9.264 4.795 43 HA ARG 730 HA ARG 730 8.335 -7.731 2.555 44 HB2 ARG 730 HB2 ARG 730 6.426 -9.045 1.429 45 HB3 ARG 730 HB3 ARG 730 8.002 -9.829 1.679 46 HG2 ARG 730 HG2 ARG 730 7.059 -10.954 3.590 47 HG3 ARG 730 HG3 ARG 730 5.520 -10.095 3.385 48 HD2 ARG 730 HD2 ARG 730 5.236 -12.287 2.433 49 HD3 ARG 730 HD3 ARG 730 5.416 -11.148 1.096 50 HE ARG 730 HE ARG 730 7.932 -12.120 1.666 51 HH11 ARG 730 HH11 ARG 730 4.856 -13.385 0.478 52 HH12 ARG 730 HH12 ARG 730 5.547 -14.637 -0.428 53 HH21 ARG 730 HH21 ARG 730 8.898 -13.794 0.452 54 HH22 ARG 730 HH22 ARG 730 7.955 -14.886 -0.456 55 H GLN 731 HN GLN 731 5.426 -7.983 4.419 56 HA GLN 731 HA GLN 731 3.925 -6.121 2.837 57 HB2 GLN 731 HB2 GLN 731 2.649 -7.686 4.091 58 HB3 GLN 731 HB3 GLN 731 3.562 -7.351 5.555 59 HG2 GLN 731 HG2 GLN 731 1.292 -6.543 5.637 60 HG3 GLN 731 HG3 GLN 731 2.453 -5.224 5.798 61 HE21 GLN 731 HE21 GLN 731 1.512 -6.785 2.824 62 HE22 GLN 731 HE22 GLN 731 0.794 -5.382 2.072 63 H GLY 732 HN GLY 732 5.691 -6.095 5.797 64 HA2 GLY 732 HA3 GLY 732 5.107 -3.346 6.378 65 HA3 GLY 732 HA2 GLY 732 6.220 -4.335 7.277 66 H GLY 733 HN GLY 733 7.014 -4.534 4.079 67 HA2 GLY 733 HA3 GLY 733 8.625 -2.134 4.052 68 HA3 GLY 733 HA2 GLY 733 9.470 -3.671 3.958 69 H GLY 734 HN GLY 734 6.605 -2.197 2.412 70 HA2 GLY 734 HA3 GLY 734 7.799 -2.056 -0.056 71 HA3 GLY 734 HA2 GLY 734 7.157 -3.687 0.106 72 H LYS 735 HN LYS 735 4.741 -3.640 0.950 73 HA LYS 735 HA LYS 735 3.331 -1.584 -0.465 74 HB2 LYS 735 HB2 LYS 735 2.343 -2.888 -2.066 75 HB3 LYS 735 HB3 LYS 735 4.029 -3.326 -2.144 76 HG2 LYS 735 HG2 LYS 735 1.753 -5.002 -1.011 77 HG3 LYS 735 HG3 LYS 735 2.665 -5.297 -2.457 78 HD2 LYS 735 HD2 LYS 735 3.891 -5.382 0.303 79 HD3 LYS 735 HD3 LYS 735 3.349 -6.791 -0.611 80 HE2 LYS 735 HE2 LYS 735 4.937 -6.253 -2.380 81 HE3 LYS 735 HE3 LYS 735 5.479 -4.836 -1.477 82 HZ1 LYS 735 HZ1 LYS 735 5.720 -7.662 -0.676 83 HZ2 LYS 735 HZ2 LYS 735 6.275 -6.380 0.280 84 HZ3 LYS 735 HZ3 LYS 735 6.954 -6.696 -1.243 85 H LEU 736 HN LEU 736 0.893 -1.930 -0.238 86 HA LEU 736 HA LEU 736 0.336 -3.650 2.112 87 HB2 LEU 736 HB2 LEU 736 -1.346 -1.222 1.830 88 HB3 LEU 736 HB3 LEU 736 -1.043 -2.202 3.198 89 HG LEU 736 HG LEU 736 1.404 -1.205 3.074 90 HD11 LEU 736 HD11 LEU 736 -0.253 1.052 1.986 91 HD12 LEU 736 HD12 LEU 736 0.906 0.118 1.032 92 HD13 LEU 736 HD13 LEU 736 1.466 1.097 2.392 93 HD21 LEU 736 HD21 LEU 736 0.713 0.459 4.729 94 HD22 LEU 736 HD22 LEU 736 -0.099 -1.081 4.987 95 HD23 LEU 736 HD23 LEU 736 -0.966 0.257 4.232 96 H ASN 737 HN ASN 737 -1.338 -4.977 1.920 97 HA ASN 737 HA ASN 737 -3.258 -4.443 -0.226 98 HB2 ASN 737 HB2 ASN 737 -2.083 -7.238 0.141 99 HB3 ASN 737 HB3 ASN 737 -3.133 -6.780 -1.137 100 HD21 ASN 737 HD21 ASN 737 -1.213 -4.289 -1.514 101 HD22 ASN 737 HD22 ASN 737 0.035 -5.022 -2.427 102 H PHE 738 HN PHE 738 -5.380 -5.345 0.282 103 HA PHE 738 HA PHE 738 -6.053 -5.617 2.993 104 HB2 PHE 738 HB2 PHE 738 -7.724 -5.471 1.230 105 HB3 PHE 738 HB3 PHE 738 -7.153 -6.989 0.577 106 HD1 PHE 738 HD2 PHE 738 -8.326 -5.706 3.866 107 HD2 PHE 738 HD1 PHE 738 -8.537 -8.778 0.975 108 HE1 PHE 738 HE2 PHE 738 -9.959 -6.870 5.252 109 HE2 PHE 738 HE1 PHE 738 -10.203 -9.968 2.381 110 HZ PHE 738 HZ PHE 738 -10.900 -9.002 4.507 111 H ASP 739 HN ASP 739 -5.508 -8.409 0.894 112 HA ASP 739 HA ASP 739 -5.348 -10.225 3.056 113 HB2 ASP 739 HB2 ASP 739 -4.588 -10.440 0.172 114 HB3 ASP 739 HB3 ASP 739 -4.436 -11.784 1.295 115 H GLU 740 HN GLU 740 -2.941 -8.400 1.401 116 HA GLU 740 HA GLU 740 -0.760 -9.838 2.811 117 HB2 GLU 740 HB2 GLU 740 -0.642 -8.823 0.363 118 HB3 GLU 740 HB3 GLU 740 -0.281 -7.334 1.216 119 HG2 GLU 740 HG2 GLU 740 1.808 -8.186 0.643 120 HG3 GLU 740 HG3 GLU 740 1.613 -8.682 2.327 121 H LEU 741 HN LEU 741 -2.443 -6.774 3.068 122 HA LEU 741 HA LEU 741 -0.808 -5.409 4.821 123 HB2 LEU 741 HB2 LEU 741 -2.606 -4.296 3.925 124 HB3 LEU 741 HB3 LEU 741 -3.823 -5.410 4.491 125 HG LEU 741 HG LEU 741 -2.705 -4.526 6.816 126 HD11 LEU 741 HD11 LEU 741 -2.386 -2.140 6.691 127 HD12 LEU 741 HD12 LEU 741 -2.544 -2.198 4.941 128 HD13 LEU 741 HD13 LEU 741 -1.180 -2.987 5.726 129 HD21 LEU 741 HD21 LEU 741 -5.029 -4.612 6.369 130 HD22 LEU 741 HD22 LEU 741 -4.882 -3.329 5.210 131 HD23 LEU 741 HD23 LEU 741 -4.634 -2.985 6.916 132 H ARG 742 HN ARG 742 -3.011 -8.063 5.204 133 HA ARG 742 HA ARG 742 -3.370 -8.103 7.998 134 HB2 ARG 742 HB2 ARG 742 -2.901 -10.750 6.737 135 HB3 ARG 742 HB3 ARG 742 -4.115 -10.190 7.832 136 HG2 ARG 742 HG2 ARG 742 -4.174 -9.311 5.071 137 HG3 ARG 742 HG3 ARG 742 -4.810 -10.927 5.476 138 HD2 ARG 742 HD2 ARG 742 -6.111 -9.209 7.251 139 HD3 ARG 742 HD3 ARG 742 -5.757 -8.214 5.903 140 HE ARG 742 HE ARG 742 -7.136 -9.210 4.595 141 HH11 ARG 742 HH11 ARG 742 -6.978 -11.322 7.497 142 HH12 ARG 742 HH12 ARG 742 -8.113 -12.393 6.861 143 HH21 ARG 742 HH21 ARG 742 -8.567 -10.790 3.757 144 HH22 ARG 742 HH22 ARG 742 -9.076 -12.071 4.701 145 H GLN 743 HN GLN 743 -0.687 -9.123 5.985 146 HA GLN 743 HA GLN 743 0.685 -10.571 7.842 147 HB2 GLN 743 HB2 GLN 743 1.209 -9.494 5.369 148 HB3 GLN 743 HB3 GLN 743 2.366 -8.745 6.416 149 HG2 GLN 743 HG2 GLN 743 3.646 -10.574 6.683 150 HG3 GLN 743 HG3 GLN 743 2.244 -11.616 6.911 151 HE21 GLN 743 HE21 GLN 743 0.990 -10.952 4.524 152 HE22 GLN 743 HE22 GLN 743 1.827 -11.632 3.218 153 H ASP 744 HN ASP 744 0.215 -7.271 7.493 154 HA ASP 744 HA ASP 744 2.065 -6.436 9.508 155 HB2 ASP 744 HB2 ASP 744 0.695 -5.095 7.505 156 HB3 ASP 744 HB3 ASP 744 -0.063 -4.535 8.976 157 H LEU 745 HN LEU 745 -1.448 -6.588 9.199 158 HA LEU 745 HA LEU 745 -1.761 -6.555 12.101 159 HB2 LEU 745 HB2 LEU 745 -4.118 -5.748 11.381 160 HB3 LEU 745 HB3 LEU 745 -2.795 -4.602 11.597 161 HG LEU 745 HG LEU 745 -2.523 -4.962 9.010 162 HD11 LEU 745 HD11 LEU 745 -4.141 -6.835 9.050 163 HD12 LEU 745 HD12 LEU 745 -4.390 -5.635 7.815 164 HD13 LEU 745 HD13 LEU 745 -5.454 -5.669 9.205 165 HD21 LEU 745 HD21 LEU 745 -4.161 -3.122 8.681 166 HD22 LEU 745 HD22 LEU 745 -3.047 -2.898 10.006 167 HD23 LEU 745 HD23 LEU 745 -4.708 -3.356 10.346 168 H LYS 746 HN LYS 746 -1.288 -8.939 10.912 169 HA LYS 746 HA LYS 746 -3.461 -10.388 10.249 170 HB2 LYS 746 HB2 LYS 746 -0.916 -11.290 11.552 171 HB3 LYS 746 HB3 LYS 746 -2.167 -12.494 11.241 172 HG2 LYS 746 HG2 LYS 746 -1.815 -11.336 8.765 173 HG3 LYS 746 HG3 LYS 746 -0.277 -11.083 9.495 174 HD2 LYS 746 HD2 LYS 746 0.053 -13.408 9.975 175 HD3 LYS 746 HD3 LYS 746 -1.587 -13.790 9.459 176 HE2 LYS 746 HE2 LYS 746 -1.009 -12.988 7.184 177 HE3 LYS 746 HE3 LYS 746 0.657 -12.773 7.718 178 HZ1 LYS 746 HZ1 LYS 746 0.781 -15.153 8.155 179 HZ2 LYS 746 HZ2 LYS 746 0.300 -14.891 6.561 180 HZ3 LYS 746 HZ3 LYS 746 -0.837 -15.328 7.719 181 H GLY 747 HN GLY 747 -5.310 -10.622 11.360 182 HA2 GLY 747 HA3 GLY 747 -6.475 -11.830 13.092 183 HA3 GLY 747 HA2 GLY 747 -5.124 -11.494 14.150 184 H LYS 748 HN LYS 748 -7.972 -10.084 12.677 185 HA LYS 748 HA LYS 748 -8.199 -8.346 14.908 186 HB2 LYS 748 HB2 LYS 748 -8.140 -6.181 13.925 187 HB3 LYS 748 HB3 LYS 748 -6.696 -7.027 13.393 188 HG2 LYS 748 HG2 LYS 748 -9.188 -6.803 11.689 189 HG3 LYS 748 HG3 LYS 748 -7.783 -5.714 11.617 190 HD2 LYS 748 HD2 LYS 748 -6.431 -7.442 10.916 191 HD3 LYS 748 HD3 LYS 748 -7.571 -8.663 11.360 192 HE2 LYS 748 HE2 LYS 748 -9.139 -7.897 9.831 193 HE3 LYS 748 HE3 LYS 748 -8.153 -6.542 9.339 194 HZ1 LYS 748 HZ1 LYS 748 -7.909 -8.270 7.756 195 HZ2 LYS 748 HZ2 LYS 748 -7.627 -9.429 8.978 196 HZ3 LYS 748 HZ3 LYS 748 -6.478 -8.220 8.666 197 H GLY 749 HN GLY 749 -9.615 -9.652 12.014 198 HA2 GLY 749 HA3 GLY 749 -12.055 -8.295 12.771 199 HA3 GLY 749 HA2 GLY 749 -11.680 -8.524 11.114 200 H HIS 750 HN HIS 750 -13.963 -9.520 11.550 201 HA HIS 750 HA HIS 750 -13.743 -12.295 12.373 202 HB2 HIS 750 HB2 HIS 750 -16.126 -10.618 11.584 203 HB3 HIS 750 HB3 HIS 750 -16.241 -12.353 11.803 204 HD2 HIS 750 HD2 HIS 750 -15.523 -9.156 14.050 205 HE1 HIS 750 HE1 HIS 750 -16.912 -12.313 16.476 206 HE2 HIS 750 HE2 HIS 750 -16.435 -9.854 16.314 207 H THR 751 HN THR 751 -15.568 -10.990 9.617 208 HA THR 751 HA THR 751 -14.342 -13.100 7.960 209 HB THR 751 HB THR 751 -16.700 -11.791 6.852 210 HG1 THR 751 HG1 THR 751 -17.303 -11.571 9.056 211 HG21 THR 751 HG21 THR 751 -16.171 -14.637 7.737 212 HG22 THR 751 HG22 THR 751 -15.863 -14.019 6.117 213 HG23 THR 751 HG23 THR 751 -17.508 -14.116 6.730 214 H ASP 752 HN ASP 752 -13.579 -12.622 5.968 215 HA ASP 752 HA ASP 752 -12.020 -10.338 5.573 216 HB2 ASP 752 HB2 ASP 752 -13.197 -12.116 3.380 217 HB3 ASP 752 HB3 ASP 752 -11.740 -11.128 3.335 218 H ALA 753 HN ALA 753 -15.343 -10.924 4.598 219 HA ALA 753 HA ALA 753 -15.592 -8.710 2.900 220 HB1 ALA 753 HB1 ALA 753 -17.819 -10.055 4.441 221 HB2 ALA 753 HB2 ALA 753 -17.174 -10.560 2.903 222 HB3 ALA 753 HB3 ALA 753 -17.995 -9.005 3.039 223 H GLU 754 HN GLU 754 -16.207 -9.000 6.277 224 HA GLU 754 HA GLU 754 -17.274 -6.440 6.744 225 HB2 GLU 754 HB2 GLU 754 -15.897 -8.523 8.338 226 HB3 GLU 754 HB3 GLU 754 -16.239 -6.990 9.109 227 HG2 GLU 754 HG2 GLU 754 -18.627 -7.443 8.763 228 HG3 GLU 754 HG3 GLU 754 -18.252 -8.875 7.819 229 H ILE 755 HN ILE 755 -14.026 -7.639 6.844 230 HA ILE 755 HA ILE 755 -12.854 -5.147 7.767 231 HB ILE 755 HB ILE 755 -11.519 -7.515 6.473 232 HG12 ILE 755 HG12 ILE 755 -11.728 -7.066 9.401 233 HG13 ILE 755 HG13 ILE 755 -13.027 -7.910 8.555 234 HG21 ILE 755 HG21 ILE 755 -10.224 -5.390 6.675 235 HG22 ILE 755 HG22 ILE 755 -9.566 -6.725 7.608 236 HG23 ILE 755 HG23 ILE 755 -10.484 -5.456 8.420 237 HD11 ILE 755 HD11 ILE 755 -10.136 -8.699 8.474 238 HD12 ILE 755 HD12 ILE 755 -11.504 -9.552 7.796 239 HD13 ILE 755 HD13 ILE 755 -11.341 -9.443 9.528 240 H GLU 756 HN GLU 756 -13.217 -6.821 4.689 241 HA GLU 756 HA GLU 756 -11.561 -5.205 3.212 242 HB2 GLU 756 HB2 GLU 756 -12.499 -7.420 2.528 243 HB3 GLU 756 HB3 GLU 756 -14.025 -6.598 2.206 244 HG2 GLU 756 HG2 GLU 756 -12.744 -5.200 0.492 245 HG3 GLU 756 HG3 GLU 756 -11.404 -6.290 0.788 246 H ALA 757 HN ALA 757 -14.999 -5.020 3.763 247 HA ALA 757 HA ALA 757 -15.503 -2.684 2.237 248 HB1 ALA 757 HB1 ALA 757 -17.028 -4.174 4.329 249 HB2 ALA 757 HB2 ALA 757 -17.426 -3.886 2.606 250 HB3 ALA 757 HB3 ALA 757 -17.570 -2.597 3.776 251 H ILE 758 HN ILE 758 -15.018 -3.216 5.737 252 HA ILE 758 HA ILE 758 -15.639 -0.675 6.578 253 HB ILE 758 HB ILE 758 -15.408 -2.592 8.134 254 HG12 ILE 758 HG12 ILE 758 -15.251 -0.076 8.852 255 HG13 ILE 758 HG13 ILE 758 -14.927 -1.335 10.041 256 HG21 ILE 758 HG21 ILE 758 -13.304 -3.421 7.230 257 HG22 ILE 758 HG22 ILE 758 -13.337 -3.376 8.993 258 HG23 ILE 758 HG23 ILE 758 -12.449 -2.139 8.085 259 HD11 ILE 758 HD11 ILE 758 -13.374 0.595 10.131 260 HD12 ILE 758 HD12 ILE 758 -12.751 0.129 8.529 261 HD13 ILE 758 HD13 ILE 758 -12.577 -0.942 9.897 262 H PHE 759 HN PHE 759 -12.467 -2.012 5.640 263 HA PHE 759 HA PHE 759 -11.033 0.270 6.330 264 HB2 PHE 759 HB2 PHE 759 -9.135 -0.844 5.446 265 HB3 PHE 759 HB3 PHE 759 -10.254 -2.130 5.781 266 HD1 PHE 759 HD2 PHE 759 -9.393 0.055 2.814 267 HD2 PHE 759 HD1 PHE 759 -10.440 -3.803 4.253 268 HE1 PHE 759 HE2 PHE 759 -9.189 -0.840 0.555 269 HE2 PHE 759 HE1 PHE 759 -10.185 -4.696 1.956 270 HZ PHE 759 HZ PHE 759 -9.577 -3.232 0.140 271 H THR 760 HN THR 760 -12.874 -0.470 3.530 272 HA THR 760 HA THR 760 -11.578 1.239 1.711 273 HB THR 760 HB THR 760 -14.434 0.243 1.777 274 HG1 THR 760 HG1 THR 760 -13.155 -1.550 1.433 275 HG21 THR 760 HG21 THR 760 -12.909 1.566 -0.477 276 HG22 THR 760 HG22 THR 760 -14.411 2.126 0.285 277 HG23 THR 760 HG23 THR 760 -14.416 0.683 -0.681 278 H LYS 761 HN LYS 761 -14.043 1.701 4.068 279 HA LYS 761 HA LYS 761 -14.301 4.525 3.340 280 HB2 LYS 761 HB2 LYS 761 -16.253 2.926 3.822 281 HB3 LYS 761 HB3 LYS 761 -15.861 3.145 5.498 282 HG2 LYS 761 HG2 LYS 761 -16.427 5.553 5.416 283 HG3 LYS 761 HG3 LYS 761 -16.497 5.446 3.668 284 HD2 LYS 761 HD2 LYS 761 -18.434 4.019 3.800 285 HD3 LYS 761 HD3 LYS 761 -18.361 3.978 5.551 286 HE2 LYS 761 HE2 LYS 761 -18.698 6.410 5.590 287 HE3 LYS 761 HE3 LYS 761 -18.854 6.389 3.831 288 HZ1 LYS 761 HZ1 LYS 761 -21.026 6.311 4.921 289 HZ2 LYS 761 HZ2 LYS 761 -20.571 4.875 5.711 290 HZ3 LYS 761 HZ3 LYS 761 -20.728 4.896 4.058 291 H TYR 762 HN TYR 762 -13.246 2.556 6.164 292 HA TYR 762 HA TYR 762 -12.551 5.014 7.538 293 HB2 TYR 762 HB2 TYR 762 -13.067 2.256 8.443 294 HB3 TYR 762 HB3 TYR 762 -11.996 3.260 9.414 295 HD1 TYR 762 HD1 TYR 762 -12.822 5.306 10.408 296 HD2 TYR 762 HD2 TYR 762 -15.486 2.704 8.369 297 HE1 TYR 762 HE1 TYR 762 -14.733 6.463 11.436 298 HE2 TYR 762 HE2 TYR 762 -17.401 3.845 9.388 299 HH TYR 762 HH TYR 762 -17.876 5.195 11.365 300 H ASP 763 HN ASP 763 -10.822 2.502 5.845 301 HA ASP 763 HA ASP 763 -8.403 2.592 7.254 302 HB2 ASP 763 HB2 ASP 763 -9.057 0.927 5.414 303 HB3 ASP 763 HB3 ASP 763 -8.678 2.154 4.294 304 H GLN 764 HN GLN 764 -6.420 3.550 6.683 305 HA GLN 764 HA GLN 764 -6.503 6.265 6.279 306 HB2 GLN 764 HB2 GLN 764 -4.181 4.377 5.946 307 HB3 GLN 764 HB3 GLN 764 -4.029 6.122 5.887 308 HG2 GLN 764 HG2 GLN 764 -4.851 6.265 8.169 309 HG3 GLN 764 HG3 GLN 764 -4.949 4.512 8.283 310 HE21 GLN 764 HE21 GLN 764 -2.999 3.325 8.245 311 HE22 GLN 764 HE22 GLN 764 -1.501 4.067 8.670 312 H ASP 765 HN ASP 765 -5.732 3.706 3.870 313 HA ASP 765 HA ASP 765 -5.838 5.893 1.911 314 HB2 ASP 765 HB2 ASP 765 -3.844 4.512 2.260 315 HB3 ASP 765 HB3 ASP 765 -4.682 3.149 1.556 316 H GLY 766 HN GLY 766 -7.669 3.245 3.038 317 HA2 GLY 766 HA3 GLY 766 -9.696 2.330 2.218 318 HA3 GLY 766 HA2 GLY 766 -9.703 3.737 1.161 319 H ASP 767 HN ASP 767 -6.900 2.303 0.511 320 HA ASP 767 HA ASP 767 -7.955 1.049 -1.870 321 HB2 ASP 767 HB2 ASP 767 -5.421 2.327 -1.178 322 HB3 ASP 767 HB3 ASP 767 -5.223 0.865 -2.138 323 H GLN 768 HN GLN 768 -5.374 0.282 0.437 324 HA GLN 768 HA GLN 768 -4.451 -1.772 1.118 325 HB2 GLN 768 HB2 GLN 768 -6.795 -1.077 2.263 326 HB3 GLN 768 HB3 GLN 768 -7.168 -2.682 1.679 327 HG2 GLN 768 HG2 GLN 768 -5.389 -3.612 2.919 328 HG3 GLN 768 HG3 GLN 768 -4.883 -2.005 3.449 329 HE21 GLN 768 HE21 GLN 768 -7.210 -4.531 3.884 330 HE22 GLN 768 HE22 GLN 768 -7.993 -3.784 5.238 331 H GLU 769 HN GLU 769 -3.746 -2.734 -0.762 332 HA GLU 769 HA GLU 769 -4.013 -5.160 -1.508 333 HB2 GLU 769 HB2 GLU 769 -5.691 -5.680 -3.242 334 HB3 GLU 769 HB3 GLU 769 -6.521 -4.980 -1.877 335 HG2 GLU 769 HG2 GLU 769 -7.633 -3.924 -3.539 336 HG3 GLU 769 HG3 GLU 769 -6.309 -2.781 -3.398 337 H LEU 770 HN LEU 770 -2.518 -2.564 -1.929 338 HA LEU 770 HA LEU 770 -2.090 -2.796 -4.806 339 HB2 LEU 770 HB2 LEU 770 -2.073 -0.327 -3.074 340 HB3 LEU 770 HB3 LEU 770 -0.971 -0.398 -4.389 341 HG LEU 770 HG LEU 770 -3.005 -0.633 -5.919 342 HD11 LEU 770 HD11 LEU 770 -5.150 -0.076 -4.960 343 HD12 LEU 770 HD12 LEU 770 -4.366 -0.304 -3.377 344 HD13 LEU 770 HD13 LEU 770 -4.508 -1.661 -4.485 345 HD21 LEU 770 HD21 LEU 770 -3.702 1.652 -5.679 346 HD22 LEU 770 HD22 LEU 770 -1.954 1.521 -5.486 347 HD23 LEU 770 HD23 LEU 770 -2.986 1.726 -4.071 348 H THR 771 HN THR 771 -0.225 -3.432 -5.510 349 HA THR 771 HA THR 771 1.848 -3.882 -3.556 350 HB THR 771 HB THR 771 2.655 -5.543 -4.899 351 HG1 THR 771 HG1 THR 771 3.405 -5.175 -6.752 352 HG21 THR 771 HG21 THR 771 0.177 -5.827 -5.094 353 HG22 THR 771 HG22 THR 771 1.125 -6.569 -6.373 354 HG23 THR 771 HG23 THR 771 0.279 -5.051 -6.666 355 H GLU 772 HN GLU 772 4.153 -3.473 -4.182 356 HA GLU 772 HA GLU 772 4.617 -0.706 -4.300 357 HB2 GLU 772 HB2 GLU 772 6.051 -2.417 -3.231 358 HB3 GLU 772 HB3 GLU 772 6.582 -2.969 -4.797 359 HG2 GLU 772 HG2 GLU 772 6.959 -0.098 -4.478 360 HG3 GLU 772 HG3 GLU 772 7.810 -1.031 -3.250 361 H HIS 773 HN HIS 773 4.520 -3.205 -6.723 362 HA HIS 773 HA HIS 773 5.732 -1.809 -8.862 363 HB2 HIS 773 HB2 HIS 773 3.569 -3.967 -9.006 364 HB3 HIS 773 HB3 HIS 773 4.623 -3.440 -10.309 365 HD2 HIS 773 HD2 HIS 773 7.184 -4.413 -10.135 366 HE1 HIS 773 HE1 HIS 773 6.327 -7.227 -7.078 367 HE2 HIS 773 HE2 HIS 773 8.076 -6.349 -8.633 368 H GLU 774 HN GLU 774 2.447 -2.052 -7.706 369 HA GLU 774 HA GLU 774 1.347 -0.542 -9.918 370 HB2 GLU 774 HB2 GLU 774 -0.137 -1.046 -7.291 371 HB3 GLU 774 HB3 GLU 774 -0.713 -0.682 -8.922 372 HG2 GLU 774 HG2 GLU 774 -0.135 -2.840 -9.771 373 HG3 GLU 774 HG3 GLU 774 0.747 -3.212 -8.292 374 H HIS 775 HN HIS 775 2.095 0.061 -6.598 375 HA HIS 775 HA HIS 775 1.195 2.730 -6.318 376 HB2 HIS 775 HB2 HIS 775 1.624 1.203 -4.442 377 HB3 HIS 775 HB3 HIS 775 3.315 1.159 -4.922 378 HD2 HIS 775 HD2 HIS 775 4.629 2.468 -3.059 379 HE1 HIS 775 HE1 HIS 775 1.974 5.742 -2.503 380 HE2 HIS 775 HE2 HIS 775 4.176 4.751 -1.840 381 H GLN 776 HN GLN 776 4.132 1.289 -7.521 382 HA GLN 776 HA GLN 776 5.775 3.513 -7.405 383 HB2 GLN 776 HB2 GLN 776 6.267 1.002 -7.839 384 HB3 GLN 776 HB3 GLN 776 6.082 1.451 -9.529 385 HG2 GLN 776 HG2 GLN 776 8.412 1.479 -8.828 386 HG3 GLN 776 HG3 GLN 776 7.858 3.086 -9.306 387 HE21 GLN 776 HE21 GLN 776 8.641 1.034 -6.561 388 HE22 GLN 776 HE22 GLN 776 8.908 2.341 -5.464 389 H GLN 777 HN GLN 777 3.489 2.439 -9.781 390 HA GLN 777 HA GLN 777 4.355 4.334 -11.835 391 HB2 GLN 777 HB2 GLN 777 1.816 2.712 -11.869 392 HB3 GLN 777 HB3 GLN 777 2.769 3.294 -13.218 393 HG2 GLN 777 HG2 GLN 777 4.215 1.573 -13.166 394 HG3 GLN 777 HG3 GLN 777 4.087 1.365 -11.421 395 HE21 GLN 777 HE21 GLN 777 1.152 1.247 -11.430 396 HE22 GLN 777 HE22 GLN 777 0.722 -0.287 -12.041 397 H MET 778 HN MET 778 1.637 3.901 -9.638 398 HA MET 778 HA MET 778 0.150 5.967 -11.021 399 HB2 MET 778 HB2 MET 778 -0.669 4.223 -8.717 400 HB3 MET 778 HB3 MET 778 -1.714 5.476 -9.414 401 HG2 MET 778 HG2 MET 778 -1.866 4.431 -11.448 402 HG3 MET 778 HG3 MET 778 -0.597 3.269 -11.138 403 HE1 MET 778 HE1 MET 778 -3.590 4.495 -8.823 404 HE2 MET 778 HE2 MET 778 -4.797 3.266 -9.193 405 HE3 MET 778 HE3 MET 778 -4.277 4.393 -10.444 406 H ARG 779 HN ARG 779 0.448 5.972 -7.393 407 HA ARG 779 HA ARG 779 0.120 8.743 -7.725 408 HB2 ARG 779 HB2 ARG 779 0.081 6.953 -5.356 409 HB3 ARG 779 HB3 ARG 779 0.221 8.697 -5.179 410 HG2 ARG 779 HG2 ARG 779 -1.837 9.024 -6.370 411 HG3 ARG 779 HG3 ARG 779 -1.980 7.283 -6.644 412 HD2 ARG 779 HD2 ARG 779 -1.913 8.643 -3.960 413 HD3 ARG 779 HD3 ARG 779 -3.368 8.056 -4.773 414 HE ARG 779 HE ARG 779 -1.534 5.999 -4.664 415 HH11 ARG 779 HH11 ARG 779 -3.382 7.921 -2.360 416 HH12 ARG 779 HH12 ARG 779 -3.669 6.601 -1.308 417 HH21 ARG 779 HH21 ARG 779 -1.997 4.193 -3.218 418 HH22 ARG 779 HH22 ARG 779 -2.965 4.472 -1.829 419 H ASP 780 HN ASP 780 1.272 10.091 -6.230 420 HA ASP 780 HA ASP 780 4.135 9.635 -6.426 421 HB2 ASP 780 HB2 ASP 780 2.664 12.154 -7.272 422 HB3 ASP 780 HB3 ASP 780 4.403 11.824 -7.234 423 H ASP 781 HN ASP 781 4.376 9.495 -4.186 424 HA ASP 781 HA ASP 781 3.086 11.434 -2.355 425 HB2 ASP 781 HB2 ASP 781 3.512 8.877 -1.887 426 HB3 ASP 781 HB3 ASP 781 5.148 9.402 -1.515 427 H LEU 782 HN LEU 782 6.291 10.522 -3.224 428 HA LEU 782 HA LEU 782 7.525 12.674 -1.593 429 HB2 LEU 782 HB2 LEU 782 8.620 10.401 -2.232 430 HB3 LEU 782 HB3 LEU 782 8.916 11.135 -3.782 431 HG LEU 782 HG LEU 782 10.289 12.892 -2.717 432 HD11 LEU 782 HD11 LEU 782 11.059 12.572 -0.432 433 HD12 LEU 782 HD12 LEU 782 9.878 11.282 -0.215 434 HD13 LEU 782 HD13 LEU 782 9.339 12.937 -0.484 435 HD21 LEU 782 HD21 LEU 782 11.285 10.866 -3.668 436 HD22 LEU 782 HD22 LEU 782 11.147 10.070 -2.096 437 HD23 LEU 782 HD23 LEU 782 12.188 11.484 -2.292 438 H GLU 783 HN GLU 783 6.488 12.255 -4.865 439 HA GLU 783 HA GLU 783 7.641 14.317 -6.188 440 HB2 GLU 783 HB2 GLU 783 5.954 12.823 -7.056 441 HB3 GLU 783 HB3 GLU 783 4.690 13.822 -6.349 442 HG2 GLU 783 HG2 GLU 783 4.943 14.566 -8.716 443 HG3 GLU 783 HG3 GLU 783 5.585 15.769 -7.624 444 H LYS 784 HN LYS 784 5.237 14.370 -3.575 445 HA LYS 784 HA LYS 784 5.102 17.191 -3.845 446 HB2 LYS 784 HB2 LYS 784 3.142 15.642 -4.730 447 HB3 LYS 784 HB3 LYS 784 2.551 15.965 -3.105 448 HG2 LYS 784 HG2 LYS 784 3.238 18.430 -3.748 449 HG3 LYS 784 HG3 LYS 784 2.910 17.831 -5.378 450 HD2 LYS 784 HD2 LYS 784 0.844 18.671 -4.628 451 HD3 LYS 784 HD3 LYS 784 0.799 16.909 -4.392 452 HE2 LYS 784 HE2 LYS 784 -0.093 18.043 -2.419 453 HE3 LYS 784 HE3 LYS 784 1.385 17.176 -2.049 454 HZ1 LYS 784 HZ1 LYS 784 2.605 19.307 -2.216 455 HZ2 LYS 784 HZ2 LYS 784 1.461 19.284 -1.021 456 HZ3 LYS 784 HZ3 LYS 784 1.133 20.108 -2.464 457 H GLU 785 HN GLU 785 6.556 16.515 -1.975 458 HA GLU 785 HA GLU 785 5.243 16.925 0.513 459 HB2 GLU 785 HB2 GLU 785 5.146 14.444 0.356 460 HB3 GLU 785 HB3 GLU 785 6.896 14.357 0.161 461 HG2 GLU 785 HG2 GLU 785 7.089 15.302 2.521 462 HG3 GLU 785 HG3 GLU 785 5.316 15.182 2.609 463 H ARG 786 HN ARG 786 6.704 18.029 1.852 464 HA ARG 786 HA ARG 786 9.331 18.351 0.705 465 HB2 ARG 786 HB2 ARG 786 8.032 20.413 0.799 466 HB3 ARG 786 HB3 ARG 786 7.760 20.163 2.515 467 HG2 ARG 786 HG2 ARG 786 10.027 20.622 3.041 468 HG3 ARG 786 HG3 ARG 786 10.494 20.579 1.338 469 HD2 ARG 786 HD2 ARG 786 8.599 22.585 2.563 470 HD3 ARG 786 HD3 ARG 786 10.306 22.886 2.223 471 HE ARG 786 HE ARG 786 9.298 22.006 -0.133 472 HH11 ARG 786 HH11 ARG 786 8.388 24.697 1.988 473 HH12 ARG 786 HH12 ARG 786 7.851 25.680 0.709 474 HH21 ARG 786 HH21 ARG 786 8.586 23.369 -1.849 475 HH22 ARG 786 HH22 ARG 786 7.968 24.917 -1.531 476 H GLU 787 HN GLU 787 11.061 17.807 1.865 477 HA GLU 787 HA GLU 787 10.678 16.188 4.127 478 HB2 GLU 787 HB2 GLU 787 13.326 17.233 3.126 479 HB3 GLU 787 HB3 GLU 787 13.058 15.794 4.100 480 HG2 GLU 787 HG2 GLU 787 13.450 14.897 2.044 481 HG3 GLU 787 HG3 GLU 787 11.698 15.056 1.971 482 H ASP 788 HN ASP 788 11.359 16.498 6.202 483 HA ASP 788 HA ASP 788 11.207 19.041 7.340 484 HB2 ASP 788 HB2 ASP 788 10.513 17.072 8.555 485 HB3 ASP 788 HB3 ASP 788 12.132 16.373 8.407 486 H LEU 789 HN LEU 789 13.131 19.817 8.889 487 HA LEU 789 HA LEU 789 15.486 19.946 7.202 488 HB2 LEU 789 HB2 LEU 789 14.148 21.805 8.599 489 HB3 LEU 789 HB3 LEU 789 15.402 21.390 9.750 490 HG LEU 789 HG LEU 789 17.099 21.840 7.834 491 HD11 LEU 789 HD11 LEU 789 15.549 21.684 6.018 492 HD12 LEU 789 HD12 LEU 789 16.392 23.227 6.062 493 HD13 LEU 789 HD13 LEU 789 14.716 23.123 6.601 494 HD21 LEU 789 HD21 LEU 789 15.392 24.069 8.817 495 HD22 LEU 789 HD22 LEU 789 17.058 24.156 8.185 496 HD23 LEU 789 HD23 LEU 789 16.737 23.347 9.723 497 H ASP 790 HN ASP 790 16.298 18.045 7.546 498 HA ASP 790 HA ASP 790 17.149 17.264 10.295 499 HB2 ASP 790 HB2 ASP 790 15.485 15.715 8.879 500 HB3 ASP 790 HB3 ASP 790 17.017 15.234 8.139 501 H LEU 791 HN LEU 791 19.186 15.599 10.030 502 HA LEU 791 HA LEU 791 20.970 17.068 8.269 503 HB2 LEU 791 HB2 LEU 791 21.307 17.006 10.892 504 HB3 LEU 791 HB3 LEU 791 22.024 15.456 10.579 505 HG LEU 791 HG LEU 791 23.002 18.120 9.554 506 HD11 LEU 791 HD11 LEU 791 23.319 17.896 11.897 507 HD12 LEU 791 HD12 LEU 791 24.870 17.751 11.069 508 HD13 LEU 791 HD13 LEU 791 24.056 16.312 11.679 509 HD21 LEU 791 HD21 LEU 791 24.106 15.335 9.120 510 HD22 LEU 791 HD22 LEU 791 25.099 16.773 9.066 511 HD23 LEU 791 HD23 LEU 791 23.802 16.606 7.905 512 H ASP 792 HN ASP 792 20.847 13.845 9.615 513 HA ASP 792 HA ASP 792 21.711 12.836 6.942 514 HB2 ASP 792 HB2 ASP 792 23.488 12.925 8.526 515 HB3 ASP 792 HB3 ASP 792 22.635 11.899 9.649 516 H HIS 793 HN HIS 793 21.055 11.126 9.862 517 HA HIS 793 HA HIS 793 18.433 10.105 8.949 518 HB2 HIS 793 HB2 HIS 793 20.517 8.523 8.599 519 HB3 HIS 793 HB3 HIS 793 20.517 8.413 10.352 520 HD2 HIS 793 HD2 HIS 793 18.275 7.343 7.321 521 HE1 HIS 793 HE1 HIS 793 17.181 5.040 10.697 522 HE2 HIS 793 HE2 HIS 793 16.759 5.477 8.278 523 H SER 794 HN SER 794 17.261 9.463 10.956 524 HA SER 794 HA SER 794 18.284 10.214 13.581 525 HB2 SER 794 HB2 SER 794 16.682 12.068 13.837 526 HB3 SER 794 HB3 SER 794 18.022 12.454 12.752 527 HG SER 794 HG SER 794 16.283 13.118 11.652 528 H SER 795 HN SER 795 17.147 8.005 12.599 529 HA SER 795 HA SER 795 14.401 7.943 13.292 530 HB2 SER 795 HB2 SER 795 15.170 6.289 11.740 531 HB3 SER 795 HB3 SER 795 16.361 5.650 12.882 532 HG SER 795 HG SER 795 13.530 5.460 12.939 533 H LEU 796 HN LEU 796 14.202 8.603 15.381 534 HA LEU 796 HA LEU 796 15.372 7.024 17.552 535 HB2 LEU 796 HB2 LEU 796 15.320 9.979 17.173 536 HB3 LEU 796 HB3 LEU 796 15.410 9.310 18.801 537 HG LEU 796 HG LEU 796 17.545 9.137 16.598 538 HD11 LEU 796 HD11 LEU 796 17.519 10.541 19.216 539 HD12 LEU 796 HD12 LEU 796 17.405 11.279 17.616 540 HD13 LEU 796 HD13 LEU 796 18.870 10.421 18.092 541 HD21 LEU 796 HD21 LEU 796 17.475 7.051 17.904 542 HD22 LEU 796 HD22 LEU 796 17.570 8.000 19.390 543 HD23 LEU 796 HD23 LEU 796 18.913 8.011 18.249 Start of MODEL 8 1 HA ASP 724 HA ASP 724 5.323 1.567 7.658 2 HB2 ASP 724 HB2 ASP 724 4.565 3.850 9.499 3 HB3 ASP 724 HB3 ASP 724 5.613 3.989 8.098 4 H ILE 725 HN ILE 725 5.506 2.472 11.106 5 HA ILE 725 HA ILE 725 8.299 2.762 11.173 6 HB ILE 725 HB ILE 725 6.355 2.222 13.450 7 HG12 ILE 725 HG12 ILE 725 7.451 4.842 12.390 8 HG13 ILE 725 HG13 ILE 725 5.833 4.243 12.068 9 HG21 ILE 725 HG21 ILE 725 9.151 3.322 13.427 10 HG22 ILE 725 HG22 ILE 725 8.652 1.785 14.119 11 HG23 ILE 725 HG23 ILE 725 8.103 3.305 14.847 12 HD11 ILE 725 HD11 ILE 725 6.954 4.972 14.767 13 HD12 ILE 725 HD12 ILE 725 5.323 4.369 14.461 14 HD13 ILE 725 HD13 ILE 725 5.823 5.929 13.811 15 H SER 726 HN SER 726 6.146 -0.002 11.711 16 HA SER 726 HA SER 726 8.282 -1.647 12.768 17 HB2 SER 726 HB2 SER 726 5.385 -2.376 12.257 18 HB3 SER 726 HB3 SER 726 6.570 -3.315 13.142 19 HG SER 726 HG SER 726 6.688 -1.036 14.294 20 H GLU 727 HN GLU 727 9.221 -3.270 11.807 21 HA GLU 727 HA GLU 727 8.911 -3.666 8.921 22 HB2 GLU 727 HB2 GLU 727 10.802 -5.191 9.960 23 HB3 GLU 727 HB3 GLU 727 11.105 -3.855 8.871 24 HG2 GLU 727 HG2 GLU 727 12.554 -3.383 10.777 25 HG3 GLU 727 HG3 GLU 727 11.120 -2.355 10.900 26 H SER 728 HN SER 728 7.325 -4.751 9.074 27 HA SER 728 HA SER 728 6.922 -7.240 10.313 28 HB2 SER 728 HB2 SER 728 5.701 -6.498 7.637 29 HB3 SER 728 HB3 SER 728 5.082 -7.654 8.808 30 HG SER 728 HG SER 728 4.387 -5.153 8.785 31 H LEU 729 HN LEU 729 7.687 -6.782 6.893 32 HA LEU 729 HA LEU 729 10.032 -7.849 6.508 33 HB2 LEU 729 HB2 LEU 729 9.306 -10.033 7.499 34 HB3 LEU 729 HB3 LEU 729 8.063 -10.167 6.283 35 HG LEU 729 HG LEU 729 9.831 -10.342 4.545 36 HD11 LEU 729 HD11 LEU 729 11.711 -10.384 6.901 37 HD12 LEU 729 HD12 LEU 729 11.615 -9.132 5.661 38 HD13 LEU 729 HD13 LEU 729 12.142 -10.759 5.233 39 HD21 LEU 729 HD21 LEU 729 10.007 -12.335 6.802 40 HD22 LEU 729 HD22 LEU 729 10.560 -12.610 5.156 41 HD23 LEU 729 HD23 LEU 729 8.845 -12.357 5.474 42 H ARG 730 HN ARG 730 7.608 -9.541 4.683 43 HA ARG 730 HA ARG 730 8.350 -8.059 2.446 44 HB2 ARG 730 HB2 ARG 730 6.282 -9.286 1.444 45 HB3 ARG 730 HB3 ARG 730 7.853 -10.088 1.582 46 HG2 ARG 730 HG2 ARG 730 7.081 -11.237 3.533 47 HG3 ARG 730 HG3 ARG 730 5.585 -10.300 3.573 48 HD2 ARG 730 HD2 ARG 730 5.208 -12.537 2.638 49 HD3 ARG 730 HD3 ARG 730 4.937 -11.281 1.435 50 HE ARG 730 HE ARG 730 7.585 -12.305 1.366 51 HH11 ARG 730 HH11 ARG 730 4.239 -12.915 0.257 52 HH12 ARG 730 HH12 ARG 730 4.721 -13.762 -1.124 53 HH21 ARG 730 HH21 ARG 730 8.209 -13.459 -0.532 54 HH22 ARG 730 HH22 ARG 730 7.017 -14.094 -1.592 55 H GLN 731 HN GLN 731 5.482 -8.105 4.399 56 HA GLN 731 HA GLN 731 3.992 -6.257 2.796 57 HB2 GLN 731 HB2 GLN 731 2.777 -7.798 4.134 58 HB3 GLN 731 HB3 GLN 731 3.707 -7.386 5.562 59 HG2 GLN 731 HG2 GLN 731 1.428 -6.590 5.642 60 HG3 GLN 731 HG3 GLN 731 2.587 -5.265 5.742 61 HE21 GLN 731 HE21 GLN 731 1.620 -6.919 2.798 62 HE22 GLN 731 HE22 GLN 731 0.887 -5.536 2.063 63 H GLY 732 HN GLY 732 5.729 -6.157 5.758 64 HA2 GLY 732 HA3 GLY 732 5.206 -3.380 6.334 65 HA3 GLY 732 HA2 GLY 732 6.344 -4.376 7.195 66 H GLY 733 HN GLY 733 7.235 -4.781 4.142 67 HA2 GLY 733 HA3 GLY 733 8.833 -2.371 4.018 68 HA3 GLY 733 HA2 GLY 733 9.647 -3.932 3.981 69 H GLY 734 HN GLY 734 6.764 -2.536 2.413 70 HA2 GLY 734 HA3 GLY 734 7.988 -2.336 -0.038 71 HA3 GLY 734 HA2 GLY 734 7.329 -3.952 0.037 72 H LYS 735 HN LYS 735 4.905 -3.888 0.896 73 HA LYS 735 HA LYS 735 3.536 -1.809 -0.559 74 HB2 LYS 735 HB2 LYS 735 2.557 -3.152 -2.208 75 HB3 LYS 735 HB3 LYS 735 4.219 -3.605 -2.256 76 HG2 LYS 735 HG2 LYS 735 1.972 -5.215 -1.036 77 HG3 LYS 735 HG3 LYS 735 2.794 -5.567 -2.507 78 HD2 LYS 735 HD2 LYS 735 4.145 -5.594 0.198 79 HD3 LYS 735 HD3 LYS 735 3.560 -7.019 -0.653 80 HE2 LYS 735 HE2 LYS 735 5.122 -6.517 -2.505 81 HE3 LYS 735 HE3 LYS 735 5.720 -5.124 -1.604 82 HZ1 LYS 735 HZ1 LYS 735 7.195 -6.963 -1.286 83 HZ2 LYS 735 HZ2 LYS 735 5.954 -7.982 -0.851 84 HZ3 LYS 735 HZ3 LYS 735 6.400 -6.720 0.178 85 H LEU 736 HN LEU 736 1.090 -2.061 -0.298 86 HA LEU 736 HA LEU 736 0.487 -3.751 2.064 87 HB2 LEU 736 HB2 LEU 736 -1.110 -1.262 1.713 88 HB3 LEU 736 HB3 LEU 736 -0.877 -2.238 3.096 89 HG LEU 736 HG LEU 736 1.624 -1.359 2.982 90 HD11 LEU 736 HD11 LEU 736 0.069 0.969 1.901 91 HD12 LEU 736 HD12 LEU 736 1.176 -0.019 0.935 92 HD13 LEU 736 HD13 LEU 736 1.793 0.929 2.293 93 HD21 LEU 736 HD21 LEU 736 1.003 0.323 4.638 94 HD22 LEU 736 HD22 LEU 736 0.108 -1.172 4.886 95 HD23 LEU 736 HD23 LEU 736 -0.679 0.211 4.128 96 H ASN 737 HN ASN 737 -1.226 -5.068 1.834 97 HA ASN 737 HA ASN 737 -3.155 -4.496 -0.280 98 HB2 ASN 737 HB2 ASN 737 -1.887 -7.277 -0.015 99 HB3 ASN 737 HB3 ASN 737 -3.148 -6.943 -1.099 100 HD21 ASN 737 HD21 ASN 737 -0.275 -5.003 -0.709 101 HD22 ASN 737 HD22 ASN 737 0.287 -5.259 -2.326 102 H PHE 738 HN PHE 738 -5.313 -5.415 0.266 103 HA PHE 738 HA PHE 738 -6.009 -5.647 2.934 104 HB2 PHE 738 HB2 PHE 738 -7.631 -5.623 1.093 105 HB3 PHE 738 HB3 PHE 738 -7.042 -7.205 0.604 106 HD1 PHE 738 HD2 PHE 738 -8.276 -5.601 3.638 107 HD2 PHE 738 HD1 PHE 738 -8.414 -8.950 1.118 108 HE1 PHE 738 HE2 PHE 738 -9.944 -6.637 5.149 109 HE2 PHE 738 HE1 PHE 738 -10.077 -10.025 2.577 110 HZ PHE 738 HZ PHE 738 -10.847 -8.860 4.607 111 H ASP 739 HN ASP 739 -5.474 -8.600 0.982 112 HA ASP 739 HA ASP 739 -5.223 -10.203 3.325 113 HB2 ASP 739 HB2 ASP 739 -4.842 -10.732 0.425 114 HB3 ASP 739 HB3 ASP 739 -4.265 -11.899 1.611 115 H GLU 740 HN GLU 740 -2.887 -8.511 1.448 116 HA GLU 740 HA GLU 740 -0.695 -9.909 2.800 117 HB2 GLU 740 HB2 GLU 740 -0.682 -8.844 0.380 118 HB3 GLU 740 HB3 GLU 740 -0.254 -7.376 1.258 119 HG2 GLU 740 HG2 GLU 740 1.801 -8.296 0.587 120 HG3 GLU 740 HG3 GLU 740 1.631 -8.805 2.276 121 H LEU 741 HN LEU 741 -2.342 -6.806 3.048 122 HA LEU 741 HA LEU 741 -0.690 -5.423 4.757 123 HB2 LEU 741 HB2 LEU 741 -2.488 -4.322 3.822 124 HB3 LEU 741 HB3 LEU 741 -3.710 -5.403 4.439 125 HG LEU 741 HG LEU 741 -2.567 -4.463 6.718 126 HD11 LEU 741 HD11 LEU 741 -2.182 -2.085 6.530 127 HD12 LEU 741 HD12 LEU 741 -2.339 -2.195 4.782 128 HD13 LEU 741 HD13 LEU 741 -1.004 -3.006 5.599 129 HD21 LEU 741 HD21 LEU 741 -4.884 -4.485 6.341 130 HD22 LEU 741 HD22 LEU 741 -4.730 -3.307 5.078 131 HD23 LEU 741 HD23 LEU 741 -4.431 -2.830 6.748 132 H ARG 742 HN ARG 742 -2.922 -8.012 5.246 133 HA ARG 742 HA ARG 742 -3.260 -7.978 8.057 134 HB2 ARG 742 HB2 ARG 742 -2.853 -10.653 6.850 135 HB3 ARG 742 HB3 ARG 742 -4.056 -10.045 7.944 136 HG2 ARG 742 HG2 ARG 742 -4.089 -9.240 5.164 137 HG3 ARG 742 HG3 ARG 742 -4.762 -10.816 5.629 138 HD2 ARG 742 HD2 ARG 742 -6.017 -9.023 7.347 139 HD3 ARG 742 HD3 ARG 742 -5.686 -8.072 5.956 140 HE ARG 742 HE ARG 742 -7.244 -9.049 4.830 141 HH11 ARG 742 HH11 ARG 742 -6.231 -11.563 7.209 142 HH12 ARG 742 HH12 ARG 742 -7.370 -12.661 6.605 143 HH21 ARG 742 HH21 ARG 742 -8.711 -10.672 4.073 144 HH22 ARG 742 HH22 ARG 742 -8.806 -12.159 4.819 145 H GLN 743 HN GLN 743 -0.625 -9.100 6.055 146 HA GLN 743 HA GLN 743 0.725 -10.527 7.949 147 HB2 GLN 743 HB2 GLN 743 1.279 -9.412 5.477 148 HB3 GLN 743 HB3 GLN 743 2.587 -8.900 6.526 149 HG2 GLN 743 HG2 GLN 743 3.538 -10.895 6.481 150 HG3 GLN 743 HG3 GLN 743 2.042 -11.713 6.891 151 HE21 GLN 743 HE21 GLN 743 0.572 -10.767 4.655 152 HE22 GLN 743 HE22 GLN 743 1.153 -11.537 3.238 153 H ASP 744 HN ASP 744 0.339 -7.229 7.479 154 HA ASP 744 HA ASP 744 2.213 -6.393 9.446 155 HB2 ASP 744 HB2 ASP 744 0.889 -5.042 7.447 156 HB3 ASP 744 HB3 ASP 744 0.131 -4.454 8.889 157 H LEU 745 HN LEU 745 -1.313 -6.446 9.175 158 HA LEU 745 HA LEU 745 -1.606 -6.275 12.083 159 HB2 LEU 745 HB2 LEU 745 -3.928 -5.416 11.331 160 HB3 LEU 745 HB3 LEU 745 -2.570 -4.293 11.459 161 HG LEU 745 HG LEU 745 -2.358 -4.760 8.907 162 HD11 LEU 745 HD11 LEU 745 -3.912 -6.644 9.086 163 HD12 LEU 745 HD12 LEU 745 -4.214 -5.532 7.763 164 HD13 LEU 745 HD13 LEU 745 -5.250 -5.486 9.187 165 HD21 LEU 745 HD21 LEU 745 -4.395 -3.101 10.327 166 HD22 LEU 745 HD22 LEU 745 -4.350 -3.086 8.584 167 HD23 LEU 745 HD23 LEU 745 -2.920 -2.621 9.482 168 H LYS 746 HN LYS 746 -1.213 -8.716 10.969 169 HA LYS 746 HA LYS 746 -3.418 -10.144 10.324 170 HB2 LYS 746 HB2 LYS 746 -0.925 -11.014 11.737 171 HB3 LYS 746 HB3 LYS 746 -2.175 -12.232 11.462 172 HG2 LYS 746 HG2 LYS 746 -1.711 -11.242 8.923 173 HG3 LYS 746 HG3 LYS 746 -0.224 -10.906 9.686 174 HD2 LYS 746 HD2 LYS 746 0.092 -13.168 10.502 175 HD3 LYS 746 HD3 LYS 746 -1.418 -13.668 9.746 176 HE2 LYS 746 HE2 LYS 746 -0.479 -13.056 7.540 177 HE3 LYS 746 HE3 LYS 746 1.030 -12.615 8.343 178 HZ1 LYS 746 HZ1 LYS 746 1.175 -14.827 7.416 179 HZ2 LYS 746 HZ2 LYS 746 -0.176 -15.321 8.267 180 HZ3 LYS 746 HZ3 LYS 746 1.234 -14.930 9.100 181 H GLY 747 HN GLY 747 -5.260 -10.640 11.354 182 HA2 GLY 747 HA3 GLY 747 -6.593 -11.386 13.191 183 HA3 GLY 747 HA2 GLY 747 -5.264 -10.967 14.234 184 H LYS 748 HN LYS 748 -8.218 -9.776 13.008 185 HA LYS 748 HA LYS 748 -8.191 -7.442 14.605 186 HB2 LYS 748 HB2 LYS 748 -7.908 -5.592 13.083 187 HB3 LYS 748 HB3 LYS 748 -6.629 -6.740 12.786 188 HG2 LYS 748 HG2 LYS 748 -9.096 -6.597 11.021 189 HG3 LYS 748 HG3 LYS 748 -7.565 -5.784 10.718 190 HD2 LYS 748 HD2 LYS 748 -6.571 -7.614 10.023 191 HD3 LYS 748 HD3 LYS 748 -7.239 -8.634 11.317 192 HE2 LYS 748 HE2 LYS 748 -9.312 -8.580 10.062 193 HE3 LYS 748 HE3 LYS 748 -8.480 -7.736 8.753 194 HZ1 LYS 748 HZ1 LYS 748 -7.958 -10.444 9.807 195 HZ2 LYS 748 HZ2 LYS 748 -6.927 -9.725 8.739 196 HZ3 LYS 748 HZ3 LYS 748 -8.532 -10.091 8.282 197 H GLY 749 HN GLY 749 -9.624 -9.374 12.161 198 HA2 GLY 749 HA3 GLY 749 -12.116 -8.074 12.770 199 HA3 GLY 749 HA2 GLY 749 -11.707 -8.246 11.090 200 H HIS 750 HN HIS 750 -14.002 -9.392 11.804 201 HA HIS 750 HA HIS 750 -13.570 -12.174 12.408 202 HB2 HIS 750 HB2 HIS 750 -16.031 -10.574 11.766 203 HB3 HIS 750 HB3 HIS 750 -16.093 -12.324 11.977 204 HD2 HIS 750 HD2 HIS 750 -16.138 -13.100 14.654 205 HE1 HIS 750 HE1 HIS 750 -15.634 -9.248 16.313 206 HE2 HIS 750 HE2 HIS 750 -16.393 -11.589 16.712 207 H THR 751 HN THR 751 -15.507 -10.838 9.714 208 HA THR 751 HA THR 751 -14.263 -12.918 8.081 209 HB THR 751 HB THR 751 -16.158 -12.294 6.464 210 HG1 THR 751 HG1 THR 751 -17.039 -10.968 8.764 211 HG21 THR 751 HG21 THR 751 -16.384 -13.912 8.929 212 HG22 THR 751 HG22 THR 751 -16.148 -14.443 7.271 213 HG23 THR 751 HG23 THR 751 -17.733 -13.849 7.793 214 H ASP 752 HN ASP 752 -13.511 -12.544 6.069 215 HA ASP 752 HA ASP 752 -11.934 -10.307 5.580 216 HB2 ASP 752 HB2 ASP 752 -13.183 -12.192 3.545 217 HB3 ASP 752 HB3 ASP 752 -11.788 -11.141 3.284 218 H ALA 753 HN ALA 753 -15.285 -10.904 4.667 219 HA ALA 753 HA ALA 753 -15.572 -8.755 2.885 220 HB1 ALA 753 HB1 ALA 753 -17.717 -10.041 4.565 221 HB2 ALA 753 HB2 ALA 753 -17.111 -10.656 3.045 222 HB3 ALA 753 HB3 ALA 753 -17.954 -9.106 3.085 223 H GLU 754 HN GLU 754 -16.135 -8.964 6.336 224 HA GLU 754 HA GLU 754 -17.222 -6.415 6.728 225 HB2 GLU 754 HB2 GLU 754 -15.773 -8.404 8.380 226 HB3 GLU 754 HB3 GLU 754 -16.140 -6.825 9.069 227 HG2 GLU 754 HG2 GLU 754 -18.505 -7.381 8.797 228 HG3 GLU 754 HG3 GLU 754 -18.082 -8.883 7.981 229 H ILE 755 HN ILE 755 -13.964 -7.574 6.824 230 HA ILE 755 HA ILE 755 -12.764 -5.067 7.705 231 HB ILE 755 HB ILE 755 -11.431 -7.457 6.451 232 HG12 ILE 755 HG12 ILE 755 -11.873 -7.186 9.383 233 HG13 ILE 755 HG13 ILE 755 -13.148 -7.877 8.391 234 HG21 ILE 755 HG21 ILE 755 -9.539 -6.716 7.604 235 HG22 ILE 755 HG22 ILE 755 -10.422 -5.862 8.785 236 HG23 ILE 755 HG23 ILE 755 -10.209 -5.156 7.169 237 HD11 ILE 755 HD11 ILE 755 -10.327 -8.896 8.502 238 HD12 ILE 755 HD12 ILE 755 -11.673 -9.608 7.639 239 HD13 ILE 755 HD13 ILE 755 -11.685 -9.573 9.402 240 H GLU 756 HN GLU 756 -13.147 -6.820 4.658 241 HA GLU 756 HA GLU 756 -11.517 -5.216 3.120 242 HB2 GLU 756 HB2 GLU 756 -12.419 -7.467 2.501 243 HB3 GLU 756 HB3 GLU 756 -13.969 -6.675 2.188 244 HG2 GLU 756 HG2 GLU 756 -12.667 -5.231 0.501 245 HG3 GLU 756 HG3 GLU 756 -11.385 -6.413 0.703 246 H ALA 757 HN ALA 757 -14.961 -5.051 3.704 247 HA ALA 757 HA ALA 757 -15.489 -2.755 2.133 248 HB1 ALA 757 HB1 ALA 757 -16.980 -4.169 4.304 249 HB2 ALA 757 HB2 ALA 757 -17.400 -3.957 2.577 250 HB3 ALA 757 HB3 ALA 757 -17.542 -2.619 3.694 251 H ILE 758 HN ILE 758 -14.923 -3.187 5.625 252 HA ILE 758 HA ILE 758 -15.572 -0.639 6.420 253 HB ILE 758 HB ILE 758 -15.306 -2.490 8.030 254 HG12 ILE 758 HG12 ILE 758 -15.072 0.074 8.621 255 HG13 ILE 758 HG13 ILE 758 -14.838 -1.166 9.859 256 HG21 ILE 758 HG21 ILE 758 -13.134 -3.374 7.129 257 HG22 ILE 758 HG22 ILE 758 -13.287 -3.250 8.875 258 HG23 ILE 758 HG23 ILE 758 -12.347 -2.044 7.995 259 HD11 ILE 758 HD11 ILE 758 -13.183 0.759 9.835 260 HD12 ILE 758 HD12 ILE 758 -12.478 0.016 8.368 261 HD13 ILE 758 HD13 ILE 758 -12.522 -0.851 9.873 262 H PHE 759 HN PHE 759 -12.440 -1.973 5.446 263 HA PHE 759 HA PHE 759 -10.973 0.316 6.071 264 HB2 PHE 759 HB2 PHE 759 -9.093 -0.828 5.196 265 HB3 PHE 759 HB3 PHE 759 -10.209 -2.102 5.568 266 HD1 PHE 759 HD2 PHE 759 -9.423 0.034 2.534 267 HD2 PHE 759 HD1 PHE 759 -10.342 -3.820 4.070 268 HE1 PHE 759 HE2 PHE 759 -9.247 -0.894 0.290 269 HE2 PHE 759 HE1 PHE 759 -10.115 -4.754 1.787 270 HZ PHE 759 HZ PHE 759 -9.581 -3.291 -0.088 271 H THR 760 HN THR 760 -12.873 -0.489 3.322 272 HA THR 760 HA THR 760 -11.601 1.140 1.428 273 HB THR 760 HB THR 760 -14.485 0.183 1.557 274 HG1 THR 760 HG1 THR 760 -13.197 -1.621 1.325 275 HG21 THR 760 HG21 THR 760 -14.158 2.133 0.022 276 HG22 THR 760 HG22 THR 760 -14.656 0.657 -0.776 277 HG23 THR 760 HG23 THR 760 -12.966 1.175 -0.873 278 H LYS 761 HN LYS 761 -14.042 1.713 3.797 279 HA LYS 761 HA LYS 761 -14.151 4.516 2.954 280 HB2 LYS 761 HB2 LYS 761 -16.249 3.138 3.650 281 HB3 LYS 761 HB3 LYS 761 -15.707 3.477 5.269 282 HG2 LYS 761 HG2 LYS 761 -15.925 5.953 4.924 283 HG3 LYS 761 HG3 LYS 761 -16.246 5.627 3.242 284 HD2 LYS 761 HD2 LYS 761 -18.355 4.616 3.785 285 HD3 LYS 761 HD3 LYS 761 -18.058 4.768 5.515 286 HE2 LYS 761 HE2 LYS 761 -18.307 7.028 3.538 287 HE3 LYS 761 HE3 LYS 761 -19.512 6.535 4.730 288 HZ1 LYS 761 HZ1 LYS 761 -17.926 7.106 6.483 289 HZ2 LYS 761 HZ2 LYS 761 -18.273 8.435 5.527 290 HZ3 LYS 761 HZ3 LYS 761 -16.804 7.624 5.341 291 H TYR 762 HN TYR 762 -13.172 2.617 5.841 292 HA TYR 762 HA TYR 762 -12.434 5.093 7.204 293 HB2 TYR 762 HB2 TYR 762 -12.861 2.285 8.095 294 HB3 TYR 762 HB3 TYR 762 -11.947 3.404 9.088 295 HD1 TYR 762 HD1 TYR 762 -13.051 5.398 9.960 296 HD2 TYR 762 HD2 TYR 762 -15.333 2.390 8.005 297 HE1 TYR 762 HE1 TYR 762 -15.117 6.264 11.003 298 HE2 TYR 762 HE2 TYR 762 -17.378 3.253 9.083 299 HH TYR 762 HH TYR 762 -17.508 6.229 10.561 300 H ASP 763 HN ASP 763 -10.783 2.533 5.543 301 HA ASP 763 HA ASP 763 -8.312 2.633 6.914 302 HB2 ASP 763 HB2 ASP 763 -9.037 0.928 5.116 303 HB3 ASP 763 HB3 ASP 763 -8.585 2.113 3.972 304 H GLN 764 HN GLN 764 -6.313 3.524 6.232 305 HA GLN 764 HA GLN 764 -6.351 6.237 5.853 306 HB2 GLN 764 HB2 GLN 764 -4.026 4.426 5.114 307 HB3 GLN 764 HB3 GLN 764 -3.931 6.147 5.407 308 HG2 GLN 764 HG2 GLN 764 -3.070 5.184 7.292 309 HG3 GLN 764 HG3 GLN 764 -4.715 5.610 7.794 310 HE21 GLN 764 HE21 GLN 764 -3.553 2.837 5.906 311 HE22 GLN 764 HE22 GLN 764 -4.128 1.635 6.972 312 H ASP 765 HN ASP 765 -5.786 3.686 3.351 313 HA ASP 765 HA ASP 765 -6.020 5.870 1.410 314 HB2 ASP 765 HB2 ASP 765 -4.485 3.383 1.433 315 HB3 ASP 765 HB3 ASP 765 -5.093 3.938 -0.142 316 H GLY 766 HN GLY 766 -7.755 3.295 2.658 317 HA2 GLY 766 HA3 GLY 766 -9.729 2.211 1.931 318 HA3 GLY 766 HA2 GLY 766 -9.939 3.574 0.855 319 H ASP 767 HN ASP 767 -7.021 1.982 0.486 320 HA ASP 767 HA ASP 767 -7.922 0.826 -2.044 321 HB2 ASP 767 HB2 ASP 767 -5.282 1.938 -1.141 322 HB3 ASP 767 HB3 ASP 767 -5.327 0.743 -2.432 323 H GLN 768 HN GLN 768 -5.286 0.134 0.154 324 HA GLN 768 HA GLN 768 -4.430 -1.859 1.027 325 HB2 GLN 768 HB2 GLN 768 -6.777 -1.126 2.228 326 HB3 GLN 768 HB3 GLN 768 -7.183 -2.737 1.767 327 HG2 GLN 768 HG2 GLN 768 -5.292 -3.575 2.946 328 HG3 GLN 768 HG3 GLN 768 -4.904 -1.923 3.447 329 HE21 GLN 768 HE21 GLN 768 -7.038 -4.591 3.922 330 HE22 GLN 768 HE22 GLN 768 -7.916 -3.893 5.238 331 H GLU 769 HN GLU 769 -3.729 -2.796 -0.862 332 HA GLU 769 HA GLU 769 -4.013 -5.295 -1.510 333 HB2 GLU 769 HB2 GLU 769 -5.691 -5.768 -3.248 334 HB3 GLU 769 HB3 GLU 769 -6.535 -5.002 -1.920 335 HG2 GLU 769 HG2 GLU 769 -6.791 -2.909 -3.256 336 HG3 GLU 769 HG3 GLU 769 -5.642 -3.558 -4.392 337 H LEU 770 HN LEU 770 -2.315 -2.874 -1.965 338 HA LEU 770 HA LEU 770 -2.058 -3.024 -4.841 339 HB2 LEU 770 HB2 LEU 770 -2.051 -0.691 -2.981 340 HB3 LEU 770 HB3 LEU 770 -0.986 -0.577 -4.345 341 HG LEU 770 HG LEU 770 -3.123 -0.820 -5.758 342 HD11 LEU 770 HD11 LEU 770 -4.332 -0.730 -3.035 343 HD12 LEU 770 HD12 LEU 770 -4.723 -1.837 -4.362 344 HD13 LEU 770 HD13 LEU 770 -5.177 -0.148 -4.452 345 HD21 LEU 770 HD21 LEU 770 -3.777 1.459 -5.418 346 HD22 LEU 770 HD22 LEU 770 -2.019 1.355 -5.215 347 HD23 LEU 770 HD23 LEU 770 -3.070 1.458 -3.813 348 H THR 771 HN THR 771 0.044 -3.644 -5.574 349 HA THR 771 HA THR 771 1.967 -4.162 -3.573 350 HB THR 771 HB THR 771 3.112 -5.452 -5.146 351 HG1 THR 771 HG1 THR 771 3.212 -5.067 -7.162 352 HG21 THR 771 HG21 THR 771 0.270 -5.356 -5.969 353 HG22 THR 771 HG22 THR 771 1.024 -6.388 -4.762 354 HG23 THR 771 HG23 THR 771 1.379 -6.642 -6.481 355 H GLU 772 HN GLU 772 4.392 -3.527 -4.214 356 HA GLU 772 HA GLU 772 4.701 -0.790 -4.135 357 HB2 GLU 772 HB2 GLU 772 6.229 -2.656 -3.376 358 HB3 GLU 772 HB3 GLU 772 6.780 -2.801 -5.024 359 HG2 GLU 772 HG2 GLU 772 6.866 -0.239 -3.548 360 HG3 GLU 772 HG3 GLU 772 8.202 -1.400 -3.470 361 H HIS 773 HN HIS 773 4.584 -3.113 -6.765 362 HA HIS 773 HA HIS 773 5.647 -1.319 -8.729 363 HB2 HIS 773 HB2 HIS 773 3.943 -3.765 -9.275 364 HB3 HIS 773 HB3 HIS 773 5.011 -2.935 -10.378 365 HD2 HIS 773 HD2 HIS 773 7.831 -2.999 -9.405 366 HE1 HIS 773 HE1 HIS 773 7.235 -6.819 -7.680 367 HE2 HIS 773 HE2 HIS 773 8.897 -5.009 -8.200 368 H GLU 774 HN GLU 774 2.409 -2.052 -7.624 369 HA GLU 774 HA GLU 774 1.189 -0.366 -9.685 370 HB2 GLU 774 HB2 GLU 774 -0.175 -1.263 -7.114 371 HB3 GLU 774 HB3 GLU 774 -0.865 -0.795 -8.675 372 HG2 GLU 774 HG2 GLU 774 -0.082 -2.772 -9.755 373 HG3 GLU 774 HG3 GLU 774 0.861 -3.212 -8.353 374 H HIS 775 HN HIS 775 2.148 0.019 -6.387 375 HA HIS 775 HA HIS 775 1.148 2.631 -5.670 376 HB2 HIS 775 HB2 HIS 775 2.000 0.889 -4.066 377 HB3 HIS 775 HB3 HIS 775 3.603 1.050 -4.761 378 HD2 HIS 775 HD2 HIS 775 2.087 1.806 -1.660 379 HE1 HIS 775 HE1 HIS 775 4.387 5.292 -2.318 380 HE2 HIS 775 HE2 HIS 775 2.937 4.047 -0.691 381 H GLN 776 HN GLN 776 3.956 1.474 -7.445 382 HA GLN 776 HA GLN 776 5.474 3.752 -7.437 383 HB2 GLN 776 HB2 GLN 776 6.255 1.630 -8.349 384 HB3 GLN 776 HB3 GLN 776 5.168 1.809 -9.718 385 HG2 GLN 776 HG2 GLN 776 6.356 3.744 -10.485 386 HG3 GLN 776 HG3 GLN 776 7.380 3.731 -9.053 387 HE21 GLN 776 HE21 GLN 776 6.658 2.146 -12.070 388 HE22 GLN 776 HE22 GLN 776 8.124 1.255 -12.143 389 H GLN 777 HN GLN 777 2.712 2.941 -9.348 390 HA GLN 777 HA GLN 777 2.932 5.324 -10.956 391 HB2 GLN 777 HB2 GLN 777 0.641 3.381 -10.829 392 HB3 GLN 777 HB3 GLN 777 1.037 4.476 -12.134 393 HG2 GLN 777 HG2 GLN 777 2.702 3.155 -12.957 394 HG3 GLN 777 HG3 GLN 777 3.017 2.420 -11.377 395 HE21 GLN 777 HE21 GLN 777 0.352 1.713 -10.730 396 HE22 GLN 777 HE22 GLN 777 -0.117 0.436 -11.763 397 H MET 778 HN MET 778 0.905 4.059 -8.364 398 HA MET 778 HA MET 778 -0.866 6.304 -8.668 399 HB2 MET 778 HB2 MET 778 -1.121 3.705 -7.364 400 HB3 MET 778 HB3 MET 778 -2.339 4.927 -7.099 401 HG2 MET 778 HG2 MET 778 -2.871 5.003 -9.461 402 HG3 MET 778 HG3 MET 778 -1.643 3.825 -9.865 403 HE1 MET 778 HE1 MET 778 -5.123 4.513 -8.231 404 HE2 MET 778 HE2 MET 778 -4.230 3.924 -6.829 405 HE3 MET 778 HE3 MET 778 -5.534 2.957 -7.516 406 H ARG 779 HN ARG 779 -0.032 7.897 -7.422 407 HA ARG 779 HA ARG 779 -0.121 9.091 -5.715 408 HB2 ARG 779 HB2 ARG 779 -0.172 6.673 -4.027 409 HB3 ARG 779 HB3 ARG 779 0.282 8.199 -3.317 410 HG2 ARG 779 HG2 ARG 779 -1.838 9.166 -3.638 411 HG3 ARG 779 HG3 ARG 779 -2.220 8.023 -4.925 412 HD2 ARG 779 HD2 ARG 779 -1.662 7.215 -2.186 413 HD3 ARG 779 HD3 ARG 779 -3.322 7.665 -2.675 414 HE ARG 779 HE ARG 779 -1.852 5.739 -4.269 415 HH11 ARG 779 HH11 ARG 779 -4.222 6.011 -1.657 416 HH12 ARG 779 HH12 ARG 779 -5.240 4.786 -2.290 417 HH21 ARG 779 HH21 ARG 779 -3.279 4.002 -5.082 418 HH22 ARG 779 HH22 ARG 779 -4.703 3.620 -4.215 419 H ASP 780 HN ASP 780 1.269 9.852 -3.991 420 HA ASP 780 HA ASP 780 4.081 9.300 -4.547 421 HB2 ASP 780 HB2 ASP 780 2.778 12.020 -4.804 422 HB3 ASP 780 HB3 ASP 780 4.489 11.670 -4.984 423 H ASP 781 HN ASP 781 4.256 8.576 -2.406 424 HA ASP 781 HA ASP 781 3.408 10.209 -0.109 425 HB2 ASP 781 HB2 ASP 781 3.513 7.611 -0.200 426 HB3 ASP 781 HB3 ASP 781 5.238 7.812 0.079 427 H LEU 782 HN LEU 782 6.439 9.196 -1.430 428 HA LEU 782 HA LEU 782 8.103 10.780 0.457 429 HB2 LEU 782 HB2 LEU 782 8.718 8.603 -0.903 430 HB3 LEU 782 HB3 LEU 782 8.974 9.710 -2.230 431 HG LEU 782 HG LEU 782 10.647 10.907 -0.790 432 HD11 LEU 782 HD11 LEU 782 11.604 9.664 1.062 433 HD12 LEU 782 HD12 LEU 782 10.379 8.412 0.854 434 HD13 LEU 782 HD13 LEU 782 9.899 10.034 1.349 435 HD21 LEU 782 HD21 LEU 782 11.292 9.413 -2.606 436 HD22 LEU 782 HD22 LEU 782 11.170 8.030 -1.518 437 HD23 LEU 782 HD23 LEU 782 12.396 9.264 -1.241 438 H GLU 783 HN GLU 783 6.633 11.293 -2.646 439 HA GLU 783 HA GLU 783 7.876 13.440 -3.636 440 HB2 GLU 783 HB2 GLU 783 6.025 12.554 -4.576 441 HB3 GLU 783 HB3 GLU 783 4.891 13.228 -3.402 442 HG2 GLU 783 HG2 GLU 783 5.528 15.491 -4.136 443 HG3 GLU 783 HG3 GLU 783 6.648 14.801 -5.300 444 H LYS 784 HN LYS 784 5.793 13.172 -0.767 445 HA LYS 784 HA LYS 784 6.070 15.992 -0.314 446 HB2 LYS 784 HB2 LYS 784 3.846 15.048 -1.345 447 HB3 LYS 784 HB3 LYS 784 3.445 14.806 0.358 448 HG2 LYS 784 HG2 LYS 784 4.058 17.164 0.796 449 HG3 LYS 784 HG3 LYS 784 4.155 17.317 -0.975 450 HD2 LYS 784 HD2 LYS 784 1.867 16.795 -1.243 451 HD3 LYS 784 HD3 LYS 784 1.722 16.318 0.456 452 HE2 LYS 784 HE2 LYS 784 2.176 18.548 1.150 453 HE3 LYS 784 HE3 LYS 784 2.376 19.091 -0.508 454 HZ1 LYS 784 HZ1 LYS 784 -0.164 18.053 0.668 455 HZ2 LYS 784 HZ2 LYS 784 0.049 18.487 -0.948 456 HZ3 LYS 784 HZ3 LYS 784 0.168 19.654 0.254 457 H GLU 785 HN GLU 785 7.544 14.283 1.053 458 HA GLU 785 HA GLU 785 6.547 14.371 3.757 459 HB2 GLU 785 HB2 GLU 785 5.933 12.122 3.009 460 HB3 GLU 785 HB3 GLU 785 7.583 11.790 2.484 461 HG2 GLU 785 HG2 GLU 785 8.251 12.048 4.947 462 HG3 GLU 785 HG3 GLU 785 6.508 12.063 5.296 463 H ARG 786 HN ARG 786 8.288 14.844 5.125 464 HA ARG 786 HA ARG 786 10.915 14.809 3.859 465 HB2 ARG 786 HB2 ARG 786 10.177 17.019 4.558 466 HB3 ARG 786 HB3 ARG 786 9.894 16.446 6.191 467 HG2 ARG 786 HG2 ARG 786 12.278 16.039 6.478 468 HG3 ARG 786 HG3 ARG 786 12.583 16.587 4.834 469 HD2 ARG 786 HD2 ARG 786 11.349 18.246 7.029 470 HD3 ARG 786 HD3 ARG 786 13.039 18.332 6.535 471 HE ARG 786 HE ARG 786 11.655 18.787 4.244 472 HH11 ARG 786 HH11 ARG 786 11.558 20.329 7.444 473 HH12 ARG 786 HH12 ARG 786 11.213 21.875 6.831 474 HH21 ARG 786 HH21 ARG 786 11.155 20.909 3.431 475 HH22 ARG 786 HH22 ARG 786 10.945 22.212 4.495 476 H GLU 787 HN GLU 787 12.559 13.682 4.834 477 HA GLU 787 HA GLU 787 11.992 11.609 6.663 478 HB2 GLU 787 HB2 GLU 787 14.593 12.828 5.777 479 HB3 GLU 787 HB3 GLU 787 14.501 11.419 6.813 480 HG2 GLU 787 HG2 GLU 787 13.409 11.598 4.013 481 HG3 GLU 787 HG3 GLU 787 14.942 10.860 4.464 482 H ASP 788 HN ASP 788 12.741 11.319 8.740 483 HA ASP 788 HA ASP 788 12.346 13.575 10.451 484 HB2 ASP 788 HB2 ASP 788 11.532 11.411 10.995 485 HB3 ASP 788 HB3 ASP 788 13.163 10.711 10.968 486 H LEU 789 HN LEU 789 13.975 14.117 12.193 487 HA LEU 789 HA LEU 789 16.603 14.197 10.942 488 HB2 LEU 789 HB2 LEU 789 15.118 16.191 11.726 489 HB3 LEU 789 HB3 LEU 789 15.861 15.864 13.276 490 HG LEU 789 HG LEU 789 18.173 16.171 12.179 491 HD11 LEU 789 HD11 LEU 789 16.550 17.088 9.864 492 HD12 LEU 789 HD12 LEU 789 17.582 15.653 9.924 493 HD13 LEU 789 HD13 LEU 789 18.285 17.260 10.076 494 HD21 LEU 789 HD21 LEU 789 16.312 18.468 11.892 495 HD22 LEU 789 HD22 LEU 789 18.083 18.482 12.072 496 HD23 LEU 789 HD23 LEU 789 17.060 17.975 13.424 497 H ASP 790 HN ASP 790 17.362 12.357 11.546 498 HA ASP 790 HA ASP 790 17.385 11.608 14.415 499 HB2 ASP 790 HB2 ASP 790 16.328 10.008 12.640 500 HB3 ASP 790 HB3 ASP 790 18.001 9.636 12.217 501 H LEU 791 HN LEU 791 19.473 9.988 14.744 502 HA LEU 791 HA LEU 791 21.638 11.531 13.644 503 HB2 LEU 791 HB2 LEU 791 21.215 11.737 16.178 504 HB3 LEU 791 HB3 LEU 791 21.870 10.147 16.348 505 HG LEU 791 HG LEU 791 23.277 12.655 15.482 506 HD11 LEU 791 HD11 LEU 791 24.603 12.301 17.485 507 HD12 LEU 791 HD12 LEU 791 23.603 10.911 17.898 508 HD13 LEU 791 HD13 LEU 791 22.891 12.525 17.829 509 HD21 LEU 791 HD21 LEU 791 24.359 9.830 15.490 510 HD22 LEU 791 HD22 LEU 791 25.376 11.251 15.638 511 HD23 LEU 791 HD23 LEU 791 24.436 11.028 14.176 512 H ASP 792 HN ASP 792 21.012 8.370 14.938 513 HA ASP 792 HA ASP 792 22.560 7.150 12.699 514 HB2 ASP 792 HB2 ASP 792 24.117 7.473 14.431 515 HB3 ASP 792 HB3 ASP 792 23.087 6.730 15.624 516 H HIS 793 HN HIS 793 21.436 5.773 15.672 517 HA HIS 793 HA HIS 793 19.171 4.341 14.404 518 HB2 HIS 793 HB2 HIS 793 21.334 2.967 14.743 519 HB3 HIS 793 HB3 HIS 793 21.086 3.205 16.467 520 HD2 HIS 793 HD2 HIS 793 19.924 0.966 13.610 521 HE1 HIS 793 HE1 HIS 793 17.524 -0.014 16.952 522 HE2 HIS 793 HE2 HIS 793 18.006 -0.469 14.538 523 H SER 794 HN SER 794 17.547 4.064 16.040 524 HA SER 794 HA SER 794 17.860 5.117 18.752 525 HB2 SER 794 HB2 SER 794 16.149 6.865 18.278 526 HB3 SER 794 HB3 SER 794 17.779 7.177 17.637 527 HG SER 794 HG SER 794 16.658 7.524 15.862 528 H SER 795 HN SER 795 16.702 2.779 17.126 529 HA SER 795 HA SER 795 14.080 2.939 18.277 530 HB2 SER 795 HB2 SER 795 14.118 2.190 15.930 531 HB3 SER 795 HB3 SER 795 15.085 0.766 16.374 532 HG SER 795 HG SER 795 13.335 -0.173 16.835 533 H LEU 796 HN LEU 796 13.903 2.074 20.193 534 HA LEU 796 HA LEU 796 15.846 0.072 21.028 535 HB2 LEU 796 HB2 LEU 796 14.275 2.114 22.514 536 HB3 LEU 796 HB3 LEU 796 14.927 0.735 23.389 537 HG LEU 796 HG LEU 796 17.224 1.519 22.581 538 HD11 LEU 796 HD11 LEU 796 16.548 2.955 20.762 539 HD12 LEU 796 HD12 LEU 796 17.473 3.861 21.961 540 HD13 LEU 796 HD13 LEU 796 15.720 4.030 21.887 541 HD21 LEU 796 HD21 LEU 796 17.406 3.252 24.309 542 HD22 LEU 796 HD22 LEU 796 16.503 1.842 24.861 543 HD23 LEU 796 HD23 LEU 796 15.646 3.317 24.413 Start of MODEL 9 1 HA ASP 724 HA ASP 724 4.248 0.603 12.592 2 HB2 ASP 724 HB2 ASP 724 2.608 1.046 14.566 3 HB3 ASP 724 HB3 ASP 724 4.023 1.656 15.393 4 H ILE 725 HN ILE 725 6.039 0.273 15.657 5 HA ILE 725 HA ILE 725 8.124 2.064 15.008 6 HB ILE 725 HB ILE 725 8.249 -0.491 16.682 7 HG12 ILE 725 HG12 ILE 725 7.736 2.311 17.802 8 HG13 ILE 725 HG13 ILE 725 6.435 1.218 17.328 9 HG21 ILE 725 HG21 ILE 725 9.986 1.977 16.730 10 HG22 ILE 725 HG22 ILE 725 10.455 0.383 16.137 11 HG23 ILE 725 HG23 ILE 725 10.111 0.620 17.850 12 HD11 ILE 725 HD11 ILE 725 6.768 1.111 19.627 13 HD12 ILE 725 HD12 ILE 725 8.507 0.827 19.456 14 HD13 ILE 725 HD13 ILE 725 7.352 -0.412 18.957 15 H SER 726 HN SER 726 7.981 -1.549 14.756 16 HA SER 726 HA SER 726 9.664 -1.355 12.420 17 HB2 SER 726 HB2 SER 726 8.869 -3.751 14.101 18 HB3 SER 726 HB3 SER 726 10.033 -3.735 12.777 19 HG SER 726 HG SER 726 10.266 -2.927 15.376 20 H GLU 727 HN GLU 727 8.803 -2.602 10.575 21 HA GLU 727 HA GLU 727 6.036 -3.273 10.926 22 HB2 GLU 727 HB2 GLU 727 7.363 -2.287 8.369 23 HB3 GLU 727 HB3 GLU 727 5.704 -2.849 8.554 24 HG2 GLU 727 HG2 GLU 727 5.206 -1.028 10.073 25 HG3 GLU 727 HG3 GLU 727 6.859 -0.452 9.918 26 H SER 728 HN SER 728 5.574 -5.018 9.138 27 HA SER 728 HA SER 728 6.849 -7.202 10.352 28 HB2 SER 728 HB2 SER 728 5.243 -7.297 7.825 29 HB3 SER 728 HB3 SER 728 5.465 -8.593 9.007 30 HG SER 728 HG SER 728 4.077 -6.178 9.236 31 H LEU 729 HN LEU 729 7.131 -6.873 6.792 32 HA LEU 729 HA LEU 729 9.880 -7.107 6.613 33 HB2 LEU 729 HB2 LEU 729 9.229 -9.419 7.714 34 HB3 LEU 729 HB3 LEU 729 8.643 -9.847 6.128 35 HG LEU 729 HG LEU 729 11.503 -9.094 6.762 36 HD11 LEU 729 HD11 LEU 729 12.018 -11.461 6.562 37 HD12 LEU 729 HD12 LEU 729 10.311 -11.847 6.387 38 HD13 LEU 729 HD13 LEU 729 10.910 -11.147 7.890 39 HD21 LEU 729 HD21 LEU 729 10.307 -10.345 4.285 40 HD22 LEU 729 HD22 LEU 729 12.025 -10.071 4.573 41 HD23 LEU 729 HD23 LEU 729 10.926 -8.700 4.421 42 H ARG 730 HN ARG 730 7.706 -9.223 4.769 43 HA ARG 730 HA ARG 730 8.395 -7.710 2.525 44 HB2 ARG 730 HB2 ARG 730 6.490 -9.072 1.422 45 HB3 ARG 730 HB3 ARG 730 8.087 -9.810 1.667 46 HG2 ARG 730 HG2 ARG 730 7.215 -10.878 3.617 47 HG3 ARG 730 HG3 ARG 730 5.632 -10.118 3.400 48 HD2 ARG 730 HD2 ARG 730 5.513 -12.387 2.525 49 HD3 ARG 730 HD3 ARG 730 5.462 -11.240 1.185 50 HE ARG 730 HE ARG 730 8.100 -12.084 1.705 51 HH11 ARG 730 HH11 ARG 730 5.094 -13.148 0.169 52 HH12 ARG 730 HH12 ARG 730 5.866 -14.180 -0.937 53 HH21 ARG 730 HH21 ARG 730 9.149 -13.476 0.211 54 HH22 ARG 730 HH22 ARG 730 8.239 -14.419 -0.877 55 H GLN 731 HN GLN 731 5.500 -8.026 4.402 56 HA GLN 731 HA GLN 731 3.929 -6.210 2.844 57 HB2 GLN 731 HB2 GLN 731 2.710 -7.756 4.163 58 HB3 GLN 731 HB3 GLN 731 3.665 -7.392 5.596 59 HG2 GLN 731 HG2 GLN 731 1.367 -6.617 5.682 60 HG3 GLN 731 HG3 GLN 731 2.508 -5.288 5.869 61 HE21 GLN 731 HE21 GLN 731 1.621 -6.832 2.866 62 HE22 GLN 731 HE22 GLN 731 0.913 -5.424 2.136 63 H GLY 732 HN GLY 732 5.722 -6.073 5.764 64 HA2 GLY 732 HA3 GLY 732 5.108 -3.312 6.232 65 HA3 GLY 732 HA2 GLY 732 6.218 -4.305 7.179 66 H GLY 733 HN GLY 733 7.185 -4.737 4.138 67 HA2 GLY 733 HA3 GLY 733 8.911 -2.405 4.222 68 HA3 GLY 733 HA2 GLY 733 9.557 -4.012 3.954 69 H GLY 734 HN GLY 734 6.658 -2.508 2.555 70 HA2 GLY 734 HA3 GLY 734 7.915 -1.880 0.209 71 HA3 GLY 734 HA2 GLY 734 7.447 -3.561 0.057 72 H LYS 735 HN LYS 735 4.919 -3.672 1.064 73 HA LYS 735 HA LYS 735 3.523 -1.637 -0.378 74 HB2 LYS 735 HB2 LYS 735 2.546 -2.930 -1.964 75 HB3 LYS 735 HB3 LYS 735 4.238 -3.323 -2.081 76 HG2 LYS 735 HG2 LYS 735 2.040 -5.085 -0.934 77 HG3 LYS 735 HG3 LYS 735 2.899 -5.322 -2.412 78 HD2 LYS 735 HD2 LYS 735 4.253 -5.426 0.284 79 HD3 LYS 735 HD3 LYS 735 3.677 -6.838 -0.594 80 HE2 LYS 735 HE2 LYS 735 5.195 -6.207 -2.479 81 HE3 LYS 735 HE3 LYS 735 5.813 -4.893 -1.480 82 HZ1 LYS 735 HZ1 LYS 735 7.272 -6.802 -1.340 83 HZ2 LYS 735 HZ2 LYS 735 6.010 -7.797 -0.902 84 HZ3 LYS 735 HZ3 LYS 735 6.537 -6.581 0.157 85 H LEU 736 HN LEU 736 1.066 -1.954 -0.211 86 HA LEU 736 HA LEU 736 0.482 -3.649 2.154 87 HB2 LEU 736 HB2 LEU 736 -1.326 -1.317 1.796 88 HB3 LEU 736 HB3 LEU 736 -0.919 -2.209 3.194 89 HG LEU 736 HG LEU 736 1.375 -1.004 3.124 90 HD11 LEU 736 HD11 LEU 736 -0.303 0.979 1.636 91 HD12 LEU 736 HD12 LEU 736 0.915 -0.034 0.838 92 HD13 LEU 736 HD13 LEU 736 1.404 1.134 2.074 93 HD21 LEU 736 HD21 LEU 736 0.450 0.771 4.465 94 HD22 LEU 736 HD22 LEU 736 -0.416 -0.729 4.796 95 HD23 LEU 736 HD23 LEU 736 -1.145 0.502 3.769 96 H ASN 737 HN ASN 737 -1.221 -5.015 1.925 97 HA ASN 737 HA ASN 737 -3.096 -4.466 -0.244 98 HB2 ASN 737 HB2 ASN 737 -2.002 -7.282 0.139 99 HB3 ASN 737 HB3 ASN 737 -3.024 -6.771 -1.155 100 HD21 ASN 737 HD21 ASN 737 -1.120 -4.357 -1.526 101 HD22 ASN 737 HD22 ASN 737 0.175 -5.065 -2.384 102 H PHE 738 HN PHE 738 -5.265 -5.359 0.263 103 HA PHE 738 HA PHE 738 -5.964 -5.616 2.928 104 HB2 PHE 738 HB2 PHE 738 -7.585 -5.534 1.112 105 HB3 PHE 738 HB3 PHE 738 -7.003 -7.105 0.567 106 HD1 PHE 738 HD2 PHE 738 -8.185 -5.650 3.786 107 HD2 PHE 738 HD1 PHE 738 -8.479 -8.794 0.974 108 HE1 PHE 738 HE2 PHE 738 -9.847 -6.736 5.196 109 HE2 PHE 738 HE1 PHE 738 -10.175 -9.897 2.402 110 HZ PHE 738 HZ PHE 738 -10.844 -8.858 4.504 111 H ASP 739 HN ASP 739 -5.435 -8.570 0.903 112 HA ASP 739 HA ASP 739 -5.178 -10.164 3.237 113 HB2 ASP 739 HB2 ASP 739 -5.005 -10.709 0.349 114 HB3 ASP 739 HB3 ASP 739 -4.116 -11.805 1.401 115 H GLU 740 HN GLU 740 -2.826 -8.419 1.421 116 HA GLU 740 HA GLU 740 -0.655 -9.860 2.778 117 HB2 GLU 740 HB2 GLU 740 -0.601 -8.799 0.360 118 HB3 GLU 740 HB3 GLU 740 -0.216 -7.326 1.234 119 HG2 GLU 740 HG2 GLU 740 1.860 -8.159 0.602 120 HG3 GLU 740 HG3 GLU 740 1.701 -8.724 2.273 121 H LEU 741 HN LEU 741 -2.308 -6.764 3.051 122 HA LEU 741 HA LEU 741 -0.676 -5.437 4.845 123 HB2 LEU 741 HB2 LEU 741 -2.443 -4.318 3.936 124 HB3 LEU 741 HB3 LEU 741 -3.688 -5.414 4.480 125 HG LEU 741 HG LEU 741 -2.566 -4.538 6.814 126 HD11 LEU 741 HD11 LEU 741 -2.227 -2.161 6.676 127 HD12 LEU 741 HD12 LEU 741 -2.380 -2.225 4.926 128 HD13 LEU 741 HD13 LEU 741 -1.021 -3.014 5.717 129 HD21 LEU 741 HD21 LEU 741 -4.876 -4.595 6.417 130 HD22 LEU 741 HD22 LEU 741 -4.736 -3.380 5.182 131 HD23 LEU 741 HD23 LEU 741 -4.464 -2.941 6.864 132 H ARG 742 HN ARG 742 -2.910 -8.063 5.174 133 HA ARG 742 HA ARG 742 -3.312 -8.172 7.967 134 HB2 ARG 742 HB2 ARG 742 -2.877 -10.794 6.617 135 HB3 ARG 742 HB3 ARG 742 -4.064 -10.250 7.742 136 HG2 ARG 742 HG2 ARG 742 -4.129 -9.290 5.021 137 HG3 ARG 742 HG3 ARG 742 -4.814 -10.893 5.397 138 HD2 ARG 742 HD2 ARG 742 -6.014 -9.130 7.245 139 HD3 ARG 742 HD3 ARG 742 -5.693 -8.167 5.871 140 HE ARG 742 HE ARG 742 -7.271 -9.041 4.735 141 HH11 ARG 742 HH11 ARG 742 -6.642 -11.464 7.276 142 HH12 ARG 742 HH12 ARG 742 -7.783 -12.538 6.661 143 HH21 ARG 742 HH21 ARG 742 -8.770 -10.600 3.911 144 HH22 ARG 742 HH22 ARG 742 -9.022 -12.047 4.722 145 H GLN 743 HN GLN 743 -0.632 -9.169 5.963 146 HA GLN 743 HA GLN 743 0.718 -10.706 7.800 147 HB2 GLN 743 HB2 GLN 743 1.285 -9.561 5.357 148 HB3 GLN 743 HB3 GLN 743 2.470 -8.901 6.447 149 HG2 GLN 743 HG2 GLN 743 3.671 -10.806 6.585 150 HG3 GLN 743 HG3 GLN 743 2.227 -11.779 6.819 151 HE21 GLN 743 HE21 GLN 743 0.934 -10.973 4.451 152 HE22 GLN 743 HE22 GLN 743 1.749 -11.649 3.119 153 H ASP 744 HN ASP 744 0.307 -7.388 7.503 154 HA ASP 744 HA ASP 744 2.115 -6.773 9.564 155 HB2 ASP 744 HB2 ASP 744 0.872 -5.246 7.640 156 HB3 ASP 744 HB3 ASP 744 0.303 -4.636 9.170 157 H LEU 745 HN LEU 745 -1.374 -6.707 9.208 158 HA LEU 745 HA LEU 745 -1.719 -6.687 12.109 159 HB2 LEU 745 HB2 LEU 745 -4.049 -5.814 11.362 160 HB3 LEU 745 HB3 LEU 745 -2.694 -4.701 11.572 161 HG LEU 745 HG LEU 745 -2.410 -5.046 9.011 162 HD11 LEU 745 HD11 LEU 745 -4.094 -6.931 9.068 163 HD12 LEU 745 HD12 LEU 745 -4.228 -5.754 7.789 164 HD13 LEU 745 HD13 LEU 745 -5.351 -5.685 9.151 165 HD21 LEU 745 HD21 LEU 745 -4.580 -3.476 10.361 166 HD22 LEU 745 HD22 LEU 745 -4.180 -3.265 8.664 167 HD23 LEU 745 HD23 LEU 745 -2.966 -2.967 9.870 168 H LYS 746 HN LYS 746 -1.304 -9.072 10.888 169 HA LYS 746 HA LYS 746 -3.470 -10.490 10.140 170 HB2 LYS 746 HB2 LYS 746 -0.978 -11.433 11.496 171 HB3 LYS 746 HB3 LYS 746 -2.225 -12.628 11.141 172 HG2 LYS 746 HG2 LYS 746 -1.791 -11.461 8.676 173 HG3 LYS 746 HG3 LYS 746 -0.295 -11.188 9.466 174 HD2 LYS 746 HD2 LYS 746 0.117 -13.449 9.980 175 HD3 LYS 746 HD3 LYS 746 -1.484 -13.931 9.418 176 HE2 LYS 746 HE2 LYS 746 -0.907 -13.250 7.153 177 HE3 LYS 746 HE3 LYS 746 0.670 -12.709 7.709 178 HZ1 LYS 746 HZ1 LYS 746 -0.306 -15.504 7.820 179 HZ2 LYS 746 HZ2 LYS 746 1.231 -14.949 8.289 180 HZ3 LYS 746 HZ3 LYS 746 0.764 -14.870 6.679 181 H GLY 747 HN GLY 747 -5.373 -10.545 11.211 182 HA2 GLY 747 HA3 GLY 747 -6.683 -11.852 12.788 183 HA3 GLY 747 HA2 GLY 747 -5.346 -11.700 13.899 184 H LYS 748 HN LYS 748 -8.060 -9.984 12.514 185 HA LYS 748 HA LYS 748 -8.140 -8.415 14.886 186 HB2 LYS 748 HB2 LYS 748 -8.086 -6.177 14.022 187 HB3 LYS 748 HB3 LYS 748 -6.659 -7.024 13.439 188 HG2 LYS 748 HG2 LYS 748 -9.155 -6.636 11.757 189 HG3 LYS 748 HG3 LYS 748 -7.721 -5.588 11.758 190 HD2 LYS 748 HD2 LYS 748 -6.402 -7.285 10.984 191 HD3 LYS 748 HD3 LYS 748 -7.588 -8.518 11.304 192 HE2 LYS 748 HE2 LYS 748 -9.031 -7.677 9.740 193 HE3 LYS 748 HE3 LYS 748 -8.091 -6.245 9.435 194 HZ1 LYS 748 HZ1 LYS 748 -6.293 -7.762 8.696 195 HZ2 LYS 748 HZ2 LYS 748 -7.667 -7.803 7.714 196 HZ3 LYS 748 HZ3 LYS 748 -7.375 -9.061 8.820 197 H GLY 749 HN GLY 749 -9.620 -9.267 11.874 198 HA2 GLY 749 HA3 GLY 749 -12.064 -8.010 12.780 199 HA3 GLY 749 HA2 GLY 749 -11.705 -8.316 11.118 200 H HIS 750 HN HIS 750 -13.917 -9.327 11.475 201 HA HIS 750 HA HIS 750 -13.672 -12.097 12.393 202 HB2 HIS 750 HB2 HIS 750 -16.067 -10.421 11.703 203 HB3 HIS 750 HB3 HIS 750 -16.188 -12.163 11.875 204 HD2 HIS 750 HD2 HIS 750 -15.493 -8.988 14.106 205 HE1 HIS 750 HE1 HIS 750 -16.532 -12.226 16.619 206 HE2 HIS 750 HE2 HIS 750 -15.842 -9.819 16.507 207 H THR 751 HN THR 751 -15.526 -10.782 9.640 208 HA THR 751 HA THR 751 -14.252 -12.869 8.044 209 HB THR 751 HB THR 751 -16.122 -12.265 6.376 210 HG1 THR 751 HG1 THR 751 -17.178 -11.029 8.701 211 HG21 THR 751 HG21 THR 751 -16.410 -13.798 8.881 212 HG22 THR 751 HG22 THR 751 -16.222 -14.407 7.235 213 HG23 THR 751 HG23 THR 751 -17.767 -13.724 7.760 214 H ASP 752 HN ASP 752 -13.533 -12.464 6.021 215 HA ASP 752 HA ASP 752 -11.900 -10.240 5.580 216 HB2 ASP 752 HB2 ASP 752 -13.124 -12.143 3.536 217 HB3 ASP 752 HB3 ASP 752 -11.793 -11.038 3.225 218 H ALA 753 HN ALA 753 -15.241 -10.830 4.650 219 HA ALA 753 HA ALA 753 -15.530 -8.668 2.895 220 HB1 ALA 753 HB1 ALA 753 -17.712 -9.940 4.540 221 HB2 ALA 753 HB2 ALA 753 -17.091 -10.576 3.035 222 HB3 ALA 753 HB3 ALA 753 -17.912 -9.013 3.052 223 H GLU 754 HN GLU 754 -16.116 -8.898 6.316 224 HA GLU 754 HA GLU 754 -17.175 -6.341 6.719 225 HB2 GLU 754 HB2 GLU 754 -15.737 -8.355 8.363 226 HB3 GLU 754 HB3 GLU 754 -16.093 -6.777 9.060 227 HG2 GLU 754 HG2 GLU 754 -18.446 -7.332 8.846 228 HG3 GLU 754 HG3 GLU 754 -18.038 -8.828 7.994 229 H ILE 755 HN ILE 755 -13.906 -7.542 6.839 230 HA ILE 755 HA ILE 755 -12.742 -5.016 7.697 231 HB ILE 755 HB ILE 755 -11.413 -7.423 6.464 232 HG12 ILE 755 HG12 ILE 755 -11.595 -6.877 9.383 233 HG13 ILE 755 HG13 ILE 755 -12.896 -7.754 8.570 234 HG21 ILE 755 HG21 ILE 755 -10.114 -5.286 6.583 235 HG22 ILE 755 HG22 ILE 755 -9.443 -6.585 7.560 236 HG23 ILE 755 HG23 ILE 755 -10.369 -5.300 8.330 237 HD11 ILE 755 HD11 ILE 755 -10.011 -8.529 8.423 238 HD12 ILE 755 HD12 ILE 755 -11.405 -9.453 7.907 239 HD13 ILE 755 HD13 ILE 755 -11.119 -9.207 9.609 240 H GLU 756 HN GLU 756 -13.100 -6.750 4.669 241 HA GLU 756 HA GLU 756 -11.448 -5.151 3.174 242 HB2 GLU 756 HB2 GLU 756 -12.349 -7.426 2.549 243 HB3 GLU 756 HB3 GLU 756 -13.856 -6.583 2.141 244 HG2 GLU 756 HG2 GLU 756 -12.631 -5.353 0.374 245 HG3 GLU 756 HG3 GLU 756 -11.161 -6.185 0.853 246 H ALA 757 HN ALA 757 -14.888 -4.995 3.689 247 HA ALA 757 HA ALA 757 -15.397 -2.677 2.115 248 HB1 ALA 757 HB1 ALA 757 -16.939 -4.125 4.235 249 HB2 ALA 757 HB2 ALA 757 -17.300 -3.912 2.493 250 HB3 ALA 757 HB3 ALA 757 -17.483 -2.575 3.605 251 H ILE 758 HN ILE 758 -14.926 -3.138 5.612 252 HA ILE 758 HA ILE 758 -15.566 -0.580 6.423 253 HB ILE 758 HB ILE 758 -15.333 -2.510 7.975 254 HG12 ILE 758 HG12 ILE 758 -15.267 -0.026 8.751 255 HG13 ILE 758 HG13 ILE 758 -14.835 -1.300 9.900 256 HG21 ILE 758 HG21 ILE 758 -13.215 -3.322 7.128 257 HG22 ILE 758 HG22 ILE 758 -13.235 -3.207 8.894 258 HG23 ILE 758 HG23 ILE 758 -12.375 -1.998 7.933 259 HD11 ILE 758 HD11 ILE 758 -12.921 0.472 8.397 260 HD12 ILE 758 HD12 ILE 758 -12.475 -0.807 9.520 261 HD13 ILE 758 HD13 ILE 758 -13.351 0.600 10.111 262 H PHE 759 HN PHE 759 -12.387 -1.921 5.522 263 HA PHE 759 HA PHE 759 -10.962 0.383 6.163 264 HB2 PHE 759 HB2 PHE 759 -9.053 -0.740 5.303 265 HB3 PHE 759 HB3 PHE 759 -10.171 -2.027 5.656 266 HD1 PHE 759 HD2 PHE 759 -9.346 0.120 2.628 267 HD2 PHE 759 HD1 PHE 759 -10.283 -3.736 4.165 268 HE1 PHE 759 HE2 PHE 759 -9.128 -0.822 0.388 269 HE2 PHE 759 HE1 PHE 759 -10.020 -4.675 1.894 270 HZ PHE 759 HZ PHE 759 -9.457 -3.232 0.029 271 H THR 760 HN THR 760 -12.802 -0.429 3.382 272 HA THR 760 HA THR 760 -11.532 1.219 1.507 273 HB THR 760 HB THR 760 -14.414 0.262 1.640 274 HG1 THR 760 HG1 THR 760 -13.118 -1.571 1.499 275 HG21 THR 760 HG21 THR 760 -14.442 0.532 -0.763 276 HG22 THR 760 HG22 THR 760 -12.765 1.061 -0.692 277 HG23 THR 760 HG23 THR 760 -14.032 2.104 -0.053 278 H LYS 761 HN LYS 761 -13.985 1.751 3.845 279 HA LYS 761 HA LYS 761 -14.244 4.600 3.102 280 HB2 LYS 761 HB2 LYS 761 -16.233 3.011 3.744 281 HB3 LYS 761 HB3 LYS 761 -15.750 3.385 5.377 282 HG2 LYS 761 HG2 LYS 761 -16.254 5.771 5.099 283 HG3 LYS 761 HG3 LYS 761 -16.394 5.530 3.371 284 HD2 LYS 761 HD2 LYS 761 -18.375 4.118 3.752 285 HD3 LYS 761 HD3 LYS 761 -18.247 4.413 5.484 286 HE2 LYS 761 HE2 LYS 761 -18.510 6.825 5.074 287 HE3 LYS 761 HE3 LYS 761 -18.676 6.502 3.352 288 HZ1 LYS 761 HZ1 LYS 761 -20.504 5.512 5.472 289 HZ2 LYS 761 HZ2 LYS 761 -20.683 5.215 3.827 290 HZ3 LYS 761 HZ3 LYS 761 -20.831 6.776 4.414 291 H TYR 762 HN TYR 762 -13.178 2.670 5.937 292 HA TYR 762 HA TYR 762 -12.460 5.169 7.255 293 HB2 TYR 762 HB2 TYR 762 -12.839 2.410 8.228 294 HB3 TYR 762 HB3 TYR 762 -11.896 3.560 9.172 295 HD1 TYR 762 HD1 TYR 762 -13.024 5.764 9.766 296 HD2 TYR 762 HD2 TYR 762 -15.190 2.398 8.352 297 HE1 TYR 762 HE1 TYR 762 -15.071 6.702 10.712 298 HE2 TYR 762 HE2 TYR 762 -17.261 3.333 9.317 299 HH TYR 762 HH TYR 762 -17.899 4.876 11.063 300 H ASP 763 HN ASP 763 -10.762 2.603 5.627 301 HA ASP 763 HA ASP 763 -8.333 2.730 7.026 302 HB2 ASP 763 HB2 ASP 763 -8.994 1.029 5.209 303 HB3 ASP 763 HB3 ASP 763 -8.602 2.236 4.073 304 H GLN 764 HN GLN 764 -6.375 3.718 6.443 305 HA GLN 764 HA GLN 764 -6.538 6.429 5.966 306 HB2 GLN 764 HB2 GLN 764 -4.713 5.337 7.191 307 HB3 GLN 764 HB3 GLN 764 -4.087 4.694 5.681 308 HG2 GLN 764 HG2 GLN 764 -3.543 6.917 4.916 309 HG3 GLN 764 HG3 GLN 764 -4.383 7.619 6.293 310 HE21 GLN 764 HE21 GLN 764 -1.529 5.958 5.255 311 HE22 GLN 764 HE22 GLN 764 -0.629 6.237 6.692 312 H ASP 765 HN ASP 765 -5.681 3.833 3.636 313 HA ASP 765 HA ASP 765 -5.871 5.974 1.615 314 HB2 ASP 765 HB2 ASP 765 -4.490 3.314 1.432 315 HB3 ASP 765 HB3 ASP 765 -4.777 4.381 0.079 316 H GLY 766 HN GLY 766 -7.647 3.386 2.821 317 HA2 GLY 766 HA3 GLY 766 -9.627 2.304 1.983 318 HA3 GLY 766 HA2 GLY 766 -9.732 3.690 0.923 319 H ASP 767 HN ASP 767 -6.830 2.098 0.663 320 HA ASP 767 HA ASP 767 -7.586 1.050 -1.964 321 HB2 ASP 767 HB2 ASP 767 -4.919 1.952 -0.817 322 HB3 ASP 767 HB3 ASP 767 -4.992 0.986 -2.296 323 H GLN 768 HN GLN 768 -5.224 0.235 0.482 324 HA GLN 768 HA GLN 768 -4.350 -1.807 1.197 325 HB2 GLN 768 HB2 GLN 768 -6.806 -1.132 2.281 326 HB3 GLN 768 HB3 GLN 768 -7.029 -2.756 1.715 327 HG2 GLN 768 HG2 GLN 768 -5.306 -3.565 3.052 328 HG3 GLN 768 HG3 GLN 768 -4.807 -1.930 3.493 329 HE21 GLN 768 HE21 GLN 768 -7.057 -4.458 4.115 330 HE22 GLN 768 HE22 GLN 768 -7.865 -3.650 5.417 331 H GLU 769 HN GLU 769 -3.649 -2.692 -0.757 332 HA GLU 769 HA GLU 769 -3.952 -5.167 -1.494 333 HB2 GLU 769 HB2 GLU 769 -6.292 -3.765 -2.774 334 HB3 GLU 769 HB3 GLU 769 -5.492 -5.019 -3.694 335 HG2 GLU 769 HG2 GLU 769 -5.927 -6.576 -1.797 336 HG3 GLU 769 HG3 GLU 769 -6.806 -5.229 -1.044 337 H LEU 770 HN LEU 770 -2.311 -2.737 -1.909 338 HA LEU 770 HA LEU 770 -2.029 -2.931 -4.769 339 HB2 LEU 770 HB2 LEU 770 -2.073 -0.572 -2.987 340 HB3 LEU 770 HB3 LEU 770 -1.000 -0.432 -4.314 341 HG LEU 770 HG LEU 770 -3.102 -0.791 -5.803 342 HD11 LEU 770 HD11 LEU 770 -4.448 -0.627 -3.136 343 HD12 LEU 770 HD12 LEU 770 -4.712 -1.828 -4.405 344 HD13 LEU 770 HD13 LEU 770 -5.242 -0.174 -4.626 345 HD21 LEU 770 HD21 LEU 770 -3.872 1.475 -5.541 346 HD22 LEU 770 HD22 LEU 770 -2.112 1.425 -5.380 347 HD23 LEU 770 HD23 LEU 770 -3.130 1.577 -3.949 348 H THR 771 HN THR 771 0.136 -3.529 -5.475 349 HA THR 771 HA THR 771 2.107 -3.821 -3.421 350 HB THR 771 HB THR 771 3.260 -5.254 -4.857 351 HG1 THR 771 HG1 THR 771 3.359 -5.080 -6.885 352 HG21 THR 771 HG21 THR 771 0.383 -5.356 -5.585 353 HG22 THR 771 HG22 THR 771 1.329 -6.341 -4.440 354 HG23 THR 771 HG23 THR 771 1.558 -6.542 -6.167 355 H GLU 772 HN GLU 772 4.477 -3.219 -3.974 356 HA GLU 772 HA GLU 772 4.744 -0.477 -4.129 357 HB2 GLU 772 HB2 GLU 772 6.270 -2.162 -3.059 358 HB3 GLU 772 HB3 GLU 772 6.840 -2.616 -4.634 359 HG2 GLU 772 HG2 GLU 772 7.116 0.201 -3.763 360 HG3 GLU 772 HG3 GLU 772 8.262 -1.031 -3.239 361 H HIS 773 HN HIS 773 4.801 -3.014 -6.574 362 HA HIS 773 HA HIS 773 5.802 -1.267 -8.618 363 HB2 HIS 773 HB2 HIS 773 4.381 -3.931 -8.927 364 HB3 HIS 773 HB3 HIS 773 5.011 -3.010 -10.256 365 HD2 HIS 773 HD2 HIS 773 7.884 -2.436 -9.858 366 HE1 HIS 773 HE1 HIS 773 8.407 -6.301 -8.205 367 HE2 HIS 773 HE2 HIS 773 9.431 -4.465 -9.598 368 H GLU 774 HN GLU 774 2.606 -2.104 -7.486 369 HA GLU 774 HA GLU 774 1.311 -0.717 -9.679 370 HB2 GLU 774 HB2 GLU 774 -0.005 -1.440 -7.023 371 HB3 GLU 774 HB3 GLU 774 -0.733 -1.026 -8.573 372 HG2 GLU 774 HG2 GLU 774 0.006 -2.999 -9.623 373 HG3 GLU 774 HG3 GLU 774 1.017 -3.412 -8.262 374 H HIS 775 HN HIS 775 2.131 0.009 -6.406 375 HA HIS 775 HA HIS 775 1.036 2.636 -6.083 376 HB2 HIS 775 HB2 HIS 775 1.669 1.166 -4.191 377 HB3 HIS 775 HB3 HIS 775 3.327 1.165 -4.748 378 HD2 HIS 775 HD2 HIS 775 4.721 2.644 -3.135 379 HE1 HIS 775 HE1 HIS 775 1.891 5.704 -2.333 380 HE2 HIS 775 HE2 HIS 775 4.125 4.755 -1.745 381 H GLN 776 HN GLN 776 3.946 1.433 -7.535 382 HA GLN 776 HA GLN 776 5.360 3.773 -7.724 383 HB2 GLN 776 HB2 GLN 776 6.122 1.491 -8.447 384 HB3 GLN 776 HB3 GLN 776 5.203 1.732 -9.924 385 HG2 GLN 776 HG2 GLN 776 7.579 2.218 -10.237 386 HG3 GLN 776 HG3 GLN 776 6.642 3.670 -10.519 387 HE21 GLN 776 HE21 GLN 776 8.879 2.080 -8.470 388 HE22 GLN 776 HE22 GLN 776 9.325 3.454 -7.529 389 H GLN 777 HN GLN 777 2.764 2.538 -9.688 390 HA GLN 777 HA GLN 777 2.819 4.783 -11.566 391 HB2 GLN 777 HB2 GLN 777 0.736 2.622 -11.380 392 HB3 GLN 777 HB3 GLN 777 1.226 3.540 -12.781 393 HG2 GLN 777 HG2 GLN 777 3.005 2.203 -13.235 394 HG3 GLN 777 HG3 GLN 777 3.290 1.811 -11.541 395 HE21 GLN 777 HE21 GLN 777 0.520 1.001 -11.026 396 HE22 GLN 777 HE22 GLN 777 0.308 -0.516 -11.787 397 H MET 778 HN MET 778 0.801 3.507 -8.985 398 HA MET 778 HA MET 778 -1.160 5.456 -9.531 399 HB2 MET 778 HB2 MET 778 -1.189 2.878 -8.025 400 HB3 MET 778 HB3 MET 778 -2.539 3.992 -7.967 401 HG2 MET 778 HG2 MET 778 -2.954 3.740 -10.308 402 HG3 MET 778 HG3 MET 778 -1.535 2.755 -10.573 403 HE1 MET 778 HE1 MET 778 -4.372 1.901 -11.601 404 HE2 MET 778 HE2 MET 778 -4.425 0.205 -11.123 405 HE3 MET 778 HE3 MET 778 -2.935 0.895 -11.765 406 H ARG 779 HN ARG 779 -1.113 7.095 -8.033 407 HA ARG 779 HA ARG 779 -1.355 8.103 -6.235 408 HB2 ARG 779 HB2 ARG 779 -0.075 5.906 -4.650 409 HB3 ARG 779 HB3 ARG 779 -0.513 7.450 -3.944 410 HG2 ARG 779 HG2 ARG 779 -2.792 7.139 -4.594 411 HG3 ARG 779 HG3 ARG 779 -2.361 5.604 -5.355 412 HD2 ARG 779 HD2 ARG 779 -2.152 6.314 -2.446 413 HD3 ARG 779 HD3 ARG 779 -3.338 5.234 -3.172 414 HE ARG 779 HE ARG 779 -0.673 4.419 -3.707 415 HH11 ARG 779 HH11 ARG 779 -3.352 4.023 -1.473 416 HH12 ARG 779 HH12 ARG 779 -2.514 3.027 -0.376 417 HH21 ARG 779 HH21 ARG 779 0.472 2.929 -2.267 418 HH22 ARG 779 HH22 ARG 779 -0.284 2.387 -0.827 419 H ASP 780 HN ASP 780 -0.162 9.323 -4.639 420 HA ASP 780 HA ASP 780 2.525 9.998 -5.587 421 HB2 ASP 780 HB2 ASP 780 0.230 11.986 -5.562 422 HB3 ASP 780 HB3 ASP 780 1.885 12.359 -5.836 423 H ASP 781 HN ASP 781 3.114 9.326 -3.412 424 HA ASP 781 HA ASP 781 2.185 11.040 -1.192 425 HB2 ASP 781 HB2 ASP 781 2.489 8.657 -0.629 426 HB3 ASP 781 HB3 ASP 781 4.175 8.698 -1.075 427 H LEU 782 HN LEU 782 5.237 10.229 -2.577 428 HA LEU 782 HA LEU 782 6.699 12.267 -1.005 429 HB2 LEU 782 HB2 LEU 782 7.609 10.052 -2.047 430 HB3 LEU 782 HB3 LEU 782 7.685 10.963 -3.531 431 HG LEU 782 HG LEU 782 9.189 12.599 -2.417 432 HD11 LEU 782 HD11 LEU 782 8.551 12.174 -0.112 433 HD12 LEU 782 HD12 LEU 782 10.275 11.992 -0.385 434 HD13 LEU 782 HD13 LEU 782 9.258 10.557 -0.217 435 HD21 LEU 782 HD21 LEU 782 9.985 10.768 -3.862 436 HD22 LEU 782 HD22 LEU 782 10.170 9.749 -2.425 437 HD23 LEU 782 HD23 LEU 782 11.115 11.234 -2.603 438 H GLU 783 HN GLU 783 5.004 12.204 -3.917 439 HA GLU 783 HA GLU 783 6.111 14.395 -5.323 440 HB2 GLU 783 HB2 GLU 783 4.003 12.736 -5.855 441 HB3 GLU 783 HB3 GLU 783 3.181 14.177 -5.386 442 HG2 GLU 783 HG2 GLU 783 5.361 14.267 -7.462 443 HG3 GLU 783 HG3 GLU 783 3.731 14.062 -8.001 444 H LYS 784 HN LYS 784 4.032 14.185 -2.414 445 HA LYS 784 HA LYS 784 3.956 16.934 -2.276 446 HB2 LYS 784 HB2 LYS 784 1.568 15.459 -3.093 447 HB3 LYS 784 HB3 LYS 784 1.304 16.698 -1.852 448 HG2 LYS 784 HG2 LYS 784 2.487 18.260 -3.391 449 HG3 LYS 784 HG3 LYS 784 2.440 16.994 -4.614 450 HD2 LYS 784 HD2 LYS 784 0.027 16.932 -4.469 451 HD3 LYS 784 HD3 LYS 784 0.089 18.147 -3.180 452 HE2 LYS 784 HE2 LYS 784 1.237 19.629 -4.660 453 HE3 LYS 784 HE3 LYS 784 1.045 18.494 -5.996 454 HZ1 LYS 784 HZ1 LYS 784 -1.161 19.817 -4.505 455 HZ2 LYS 784 HZ2 LYS 784 -1.371 18.656 -5.724 456 HZ3 LYS 784 HZ3 LYS 784 -0.692 20.147 -6.101 457 H GLU 785 HN GLU 785 5.185 15.814 -0.508 458 HA GLU 785 HA GLU 785 3.892 15.955 1.946 459 HB2 GLU 785 HB2 GLU 785 3.020 13.709 1.171 460 HB3 GLU 785 HB3 GLU 785 4.666 13.078 1.274 461 HG2 GLU 785 HG2 GLU 785 3.144 14.285 3.559 462 HG3 GLU 785 HG3 GLU 785 3.064 12.554 3.189 463 H ARG 786 HN ARG 786 5.426 16.481 3.221 464 HA ARG 786 HA ARG 786 8.162 15.831 2.451 465 HB2 ARG 786 HB2 ARG 786 7.687 18.144 1.933 466 HB3 ARG 786 HB3 ARG 786 7.149 18.430 3.579 467 HG2 ARG 786 HG2 ARG 786 9.405 17.993 4.384 468 HG3 ARG 786 HG3 ARG 786 9.945 17.703 2.731 469 HD2 ARG 786 HD2 ARG 786 8.829 20.253 3.874 470 HD3 ARG 786 HD3 ARG 786 10.484 19.974 3.324 471 HE ARG 786 HE ARG 786 8.949 19.390 1.180 472 HH11 ARG 786 HH11 ARG 786 9.341 22.270 3.172 473 HH12 ARG 786 HH12 ARG 786 8.871 23.348 1.951 474 HH21 ARG 786 HH21 ARG 786 8.246 20.815 -0.458 475 HH22 ARG 786 HH22 ARG 786 8.198 22.495 -0.172 476 H GLU 787 HN GLU 787 9.286 14.912 4.047 477 HA GLU 787 HA GLU 787 8.272 14.341 6.553 478 HB2 GLU 787 HB2 GLU 787 11.146 14.388 5.620 479 HB3 GLU 787 HB3 GLU 787 10.640 13.744 7.176 480 HG2 GLU 787 HG2 GLU 787 9.326 12.043 6.097 481 HG3 GLU 787 HG3 GLU 787 9.687 12.684 4.505 482 H ASP 788 HN ASP 788 8.888 15.185 8.635 483 HA ASP 788 HA ASP 788 8.987 18.068 8.656 484 HB2 ASP 788 HB2 ASP 788 7.502 16.849 10.110 485 HB3 ASP 788 HB3 ASP 788 8.860 16.030 10.879 486 H LEU 789 HN LEU 789 10.434 19.264 10.066 487 HA LEU 789 HA LEU 789 13.165 18.399 9.575 488 HB2 LEU 789 HB2 LEU 789 11.958 20.727 9.199 489 HB3 LEU 789 HB3 LEU 789 12.452 20.964 10.858 490 HG LEU 789 HG LEU 789 14.865 20.464 10.120 491 HD11 LEU 789 HD11 LEU 789 13.649 20.747 7.406 492 HD12 LEU 789 HD12 LEU 789 14.343 19.277 8.084 493 HD13 LEU 789 HD13 LEU 789 15.366 20.683 7.796 494 HD21 LEU 789 HD21 LEU 789 14.053 22.713 10.538 495 HD22 LEU 789 HD22 LEU 789 13.388 22.717 8.902 496 HD23 LEU 789 HD23 LEU 789 15.153 22.633 9.143 497 H ASP 790 HN ASP 790 13.298 16.906 11.060 498 HA ASP 790 HA ASP 790 12.778 17.564 13.918 499 HB2 ASP 790 HB2 ASP 790 11.925 15.346 12.599 500 HB3 ASP 790 HB3 ASP 790 13.510 14.786 13.131 501 H LEU 791 HN LEU 791 14.500 16.019 15.294 502 HA LEU 791 HA LEU 791 16.995 17.194 14.351 503 HB2 LEU 791 HB2 LEU 791 15.880 17.748 16.738 504 HB3 LEU 791 HB3 LEU 791 16.770 16.323 17.190 505 HG LEU 791 HG LEU 791 17.994 18.838 16.053 506 HD11 LEU 791 HD11 LEU 791 18.789 19.302 18.288 507 HD12 LEU 791 HD12 LEU 791 17.921 17.913 18.917 508 HD13 LEU 791 HD13 LEU 791 17.032 19.268 18.215 509 HD21 LEU 791 HD21 LEU 791 19.251 16.291 17.088 510 HD22 LEU 791 HD22 LEU 791 20.079 17.825 17.132 511 HD23 LEU 791 HD23 LEU 791 19.610 17.170 15.579 512 H ASP 792 HN ASP 792 16.271 14.413 16.310 513 HA ASP 792 HA ASP 792 18.756 13.230 15.205 514 HB2 ASP 792 HB2 ASP 792 18.561 13.491 17.591 515 HB3 ASP 792 HB3 ASP 792 17.191 12.419 17.618 516 H HIS 793 HN HIS 793 15.705 11.917 16.225 517 HA HIS 793 HA HIS 793 15.583 10.352 13.729 518 HB2 HIS 793 HB2 HIS 793 16.382 9.160 15.972 519 HB3 HIS 793 HB3 HIS 793 14.665 9.221 16.351 520 HD2 HIS 793 HD2 HIS 793 17.118 7.352 13.988 521 HE1 HIS 793 HE1 HIS 793 13.277 5.683 13.435 522 HE2 HIS 793 HE2 HIS 793 15.710 5.327 13.190 523 H SER 794 HN SER 794 13.115 9.252 14.218 524 HA SER 794 HA SER 794 11.170 11.229 15.208 525 HB2 SER 794 HB2 SER 794 11.021 10.617 12.215 526 HB3 SER 794 HB3 SER 794 10.233 11.838 13.171 527 HG SER 794 HG SER 794 12.455 12.620 13.572 528 H SER 795 HN SER 795 11.881 8.437 15.675 529 HA SER 795 HA SER 795 9.502 7.296 14.709 530 HB2 SER 795 HB2 SER 795 11.438 5.772 14.504 531 HB3 SER 795 HB3 SER 795 11.750 5.894 16.244 532 HG SER 795 HG SER 795 10.646 4.172 16.273 533 H LEU 796 HN LEU 796 7.976 6.438 16.406 534 HA LEU 796 HA LEU 796 8.264 7.776 19.006 535 HB2 LEU 796 HB2 LEU 796 6.159 8.086 17.575 536 HB3 LEU 796 HB3 LEU 796 5.817 6.397 17.879 537 HG LEU 796 HG LEU 796 5.790 6.857 20.297 538 HD11 LEU 796 HD11 LEU 796 7.066 8.917 20.372 539 HD12 LEU 796 HD12 LEU 796 5.456 9.180 21.038 540 HD13 LEU 796 HD13 LEU 796 5.837 9.737 19.411 541 HD21 LEU 796 HD21 LEU 796 3.799 8.337 18.588 542 HD22 LEU 796 HD22 LEU 796 3.558 7.872 20.271 543 HD23 LEU 796 HD23 LEU 796 3.741 6.630 19.032 Start of MODEL 10 1 HA ASP 724 HA ASP 724 4.705 -1.455 15.277 2 HB2 ASP 724 HB2 ASP 724 6.001 -2.255 17.859 3 HB3 ASP 724 HB3 ASP 724 5.176 -0.707 17.723 4 H ILE 725 HN ILE 725 8.070 -1.401 16.502 5 HA ILE 725 HA ILE 725 8.327 1.378 16.016 6 HB ILE 725 HB ILE 725 10.505 -0.771 16.116 7 HG12 ILE 725 HG12 ILE 725 9.467 1.047 18.347 8 HG13 ILE 725 HG13 ILE 725 9.115 -0.671 18.178 9 HG21 ILE 725 HG21 ILE 725 10.673 2.227 16.466 10 HG22 ILE 725 HG22 ILE 725 11.259 1.323 15.069 11 HG23 ILE 725 HG23 ILE 725 12.011 1.091 16.648 12 HD11 ILE 725 HD11 ILE 725 11.803 0.573 18.632 13 HD12 ILE 725 HD12 ILE 725 11.489 -1.154 18.493 14 HD13 ILE 725 HD13 ILE 725 10.813 -0.240 19.842 15 H SER 726 HN SER 726 9.359 -1.506 14.071 16 HA SER 726 HA SER 726 8.886 0.100 11.672 17 HB2 SER 726 HB2 SER 726 10.396 -2.500 12.064 18 HB3 SER 726 HB3 SER 726 10.102 -1.715 10.513 19 HG SER 726 HG SER 726 11.835 -1.089 12.546 20 H GLU 727 HN GLU 727 8.156 -1.589 9.916 21 HA GLU 727 HA GLU 727 5.827 -2.767 11.092 22 HB2 GLU 727 HB2 GLU 727 6.415 -2.041 8.206 23 HB3 GLU 727 HB3 GLU 727 4.887 -2.640 8.867 24 HG2 GLU 727 HG2 GLU 727 4.642 -0.668 10.237 25 HG3 GLU 727 HG3 GLU 727 6.192 -0.064 9.683 26 H SER 728 HN SER 728 5.341 -4.751 9.323 27 HA SER 728 HA SER 728 6.900 -6.639 10.665 28 HB2 SER 728 HB2 SER 728 5.206 -7.185 8.266 29 HB3 SER 728 HB3 SER 728 5.656 -8.289 9.579 30 HG SER 728 HG SER 728 4.032 -5.984 9.687 31 H LEU 729 HN LEU 729 6.960 -6.671 7.077 32 HA LEU 729 HA LEU 729 9.772 -6.751 6.845 33 HB2 LEU 729 HB2 LEU 729 8.387 -9.449 6.782 34 HB3 LEU 729 HB3 LEU 729 9.854 -9.169 5.889 35 HG LEU 729 HG LEU 729 9.586 -9.021 8.900 36 HD11 LEU 729 HD11 LEU 729 10.841 -11.119 8.893 37 HD12 LEU 729 HD12 LEU 729 10.804 -11.136 7.133 38 HD13 LEU 729 HD13 LEU 729 9.304 -11.291 8.046 39 HD21 LEU 729 HD21 LEU 729 12.038 -8.965 8.885 40 HD22 LEU 729 HD22 LEU 729 11.371 -7.571 8.042 41 HD23 LEU 729 HD23 LEU 729 12.029 -8.925 7.121 42 H ARG 730 HN ARG 730 7.821 -8.973 5.001 43 HA ARG 730 HA ARG 730 8.422 -7.527 2.660 44 HB2 ARG 730 HB2 ARG 730 6.686 -9.150 1.682 45 HB3 ARG 730 HB3 ARG 730 8.342 -9.708 2.002 46 HG2 ARG 730 HG2 ARG 730 7.532 -10.692 4.065 47 HG3 ARG 730 HG3 ARG 730 5.866 -10.158 3.714 48 HD2 ARG 730 HD2 ARG 730 6.102 -12.464 3.109 49 HD3 ARG 730 HD3 ARG 730 6.066 -11.536 1.609 50 HE ARG 730 HE ARG 730 8.711 -11.743 2.249 51 HH11 ARG 730 HH11 ARG 730 6.123 -14.101 1.672 52 HH12 ARG 730 HH12 ARG 730 7.176 -15.287 1.076 53 HH21 ARG 730 HH21 ARG 730 10.134 -13.374 1.501 54 HH22 ARG 730 HH22 ARG 730 9.518 -14.886 1.006 55 H GLN 731 HN GLN 731 5.527 -7.921 4.504 56 HA GLN 731 HA GLN 731 3.992 -6.237 2.779 57 HB2 GLN 731 HB2 GLN 731 2.778 -7.853 3.988 58 HB3 GLN 731 HB3 GLN 731 3.597 -7.449 5.483 59 HG2 GLN 731 HG2 GLN 731 1.270 -6.780 5.459 60 HG3 GLN 731 HG3 GLN 731 2.344 -5.411 5.705 61 HE21 GLN 731 HE21 GLN 731 1.584 -6.950 2.645 62 HE22 GLN 731 HE22 GLN 731 0.846 -5.533 1.940 63 H GLY 732 HN GLY 732 5.536 -6.025 5.858 64 HA2 GLY 732 HA3 GLY 732 4.783 -3.390 6.518 65 HA3 GLY 732 HA2 GLY 732 6.086 -4.287 7.264 66 H GLY 733 HN GLY 733 7.149 -4.547 4.358 67 HA2 GLY 733 HA3 GLY 733 8.124 -1.847 4.088 68 HA3 GLY 733 HA2 GLY 733 9.294 -3.146 4.251 69 H GLY 734 HN GLY 734 6.483 -2.269 2.325 70 HA2 GLY 734 HA3 GLY 734 7.907 -2.346 0.010 71 HA3 GLY 734 HA2 GLY 734 7.219 -3.944 0.149 72 H LYS 735 HN LYS 735 4.775 -3.714 0.960 73 HA LYS 735 HA LYS 735 3.369 -1.670 -0.513 74 HB2 LYS 735 HB2 LYS 735 2.387 -2.978 -2.132 75 HB3 LYS 735 HB3 LYS 735 4.032 -3.462 -2.293 76 HG2 LYS 735 HG2 LYS 735 1.758 -5.057 -1.086 77 HG3 LYS 735 HG3 LYS 735 2.663 -5.392 -2.525 78 HD2 LYS 735 HD2 LYS 735 3.879 -5.502 0.244 79 HD3 LYS 735 HD3 LYS 735 3.271 -6.900 -0.637 80 HE2 LYS 735 HE2 LYS 735 4.916 -6.372 -2.447 81 HE3 LYS 735 HE3 LYS 735 5.573 -5.108 -1.410 82 HZ1 LYS 735 HZ1 LYS 735 6.837 -7.174 -1.263 83 HZ2 LYS 735 HZ2 LYS 735 5.477 -8.001 -0.780 84 HZ3 LYS 735 HZ3 LYS 735 6.140 -6.818 0.232 85 H LEU 736 HN LEU 736 0.938 -1.960 -0.254 86 HA LEU 736 HA LEU 736 0.385 -3.682 2.118 87 HB2 LEU 736 HB2 LEU 736 -1.295 -1.270 1.732 88 HB3 LEU 736 HB3 LEU 736 -0.962 -2.191 3.109 89 HG LEU 736 HG LEU 736 1.218 -0.456 2.026 90 HD11 LEU 736 HD11 LEU 736 -0.632 0.985 2.417 91 HD12 LEU 736 HD12 LEU 736 0.520 1.149 3.756 92 HD13 LEU 736 HD13 LEU 736 -0.969 0.230 3.978 93 HD21 LEU 736 HD21 LEU 736 1.874 -0.552 4.404 94 HD22 LEU 736 HD22 LEU 736 1.954 -2.107 3.575 95 HD23 LEU 736 HD23 LEU 736 0.615 -1.753 4.672 96 H ASN 737 HN ASN 737 -1.268 -5.029 1.866 97 HA ASN 737 HA ASN 737 -3.261 -4.456 -0.216 98 HB2 ASN 737 HB2 ASN 737 -2.042 -7.207 0.002 99 HB3 ASN 737 HB3 ASN 737 -3.108 -6.718 -1.257 100 HD21 ASN 737 HD21 ASN 737 -1.268 -4.213 -1.553 101 HD22 ASN 737 HD22 ASN 737 0.027 -4.843 -2.474 102 H PHE 738 HN PHE 738 -5.347 -5.373 0.268 103 HA PHE 738 HA PHE 738 -6.011 -5.719 2.917 104 HB2 PHE 738 HB2 PHE 738 -7.622 -5.613 1.095 105 HB3 PHE 738 HB3 PHE 738 -7.052 -7.195 0.569 106 HD1 PHE 738 HD2 PHE 738 -8.211 -5.700 3.784 107 HD2 PHE 738 HD1 PHE 738 -8.558 -8.864 1.006 108 HE1 PHE 738 HE2 PHE 738 -9.888 -6.746 5.214 109 HE2 PHE 738 HE1 PHE 738 -10.271 -9.932 2.451 110 HZ PHE 738 HZ PHE 738 -10.920 -8.863 4.546 111 H ASP 739 HN ASP 739 -5.519 -8.692 0.900 112 HA ASP 739 HA ASP 739 -5.241 -10.283 3.225 113 HB2 ASP 739 HB2 ASP 739 -4.844 -10.840 0.330 114 HB3 ASP 739 HB3 ASP 739 -4.195 -11.969 1.507 115 H GLU 740 HN GLU 740 -2.934 -8.557 1.341 116 HA GLU 740 HA GLU 740 -0.652 -9.929 2.566 117 HB2 GLU 740 HB2 GLU 740 -0.862 -8.735 0.193 118 HB3 GLU 740 HB3 GLU 740 -0.396 -7.320 1.137 119 HG2 GLU 740 HG2 GLU 740 1.563 -8.125 0.172 120 HG3 GLU 740 HG3 GLU 740 1.621 -8.732 1.833 121 H LEU 741 HN LEU 741 -2.358 -6.870 2.959 122 HA LEU 741 HA LEU 741 -0.690 -5.546 4.695 123 HB2 LEU 741 HB2 LEU 741 -2.490 -4.438 3.840 124 HB3 LEU 741 HB3 LEU 741 -3.711 -5.532 4.443 125 HG LEU 741 HG LEU 741 -2.472 -4.633 6.720 126 HD11 LEU 741 HD11 LEU 741 -2.167 -2.234 6.547 127 HD12 LEU 741 HD12 LEU 741 -2.417 -2.326 4.810 128 HD13 LEU 741 HD13 LEU 741 -1.011 -3.098 5.533 129 HD21 LEU 741 HD21 LEU 741 -4.821 -4.719 6.437 130 HD22 LEU 741 HD22 LEU 741 -4.745 -3.495 5.211 131 HD23 LEU 741 HD23 LEU 741 -4.382 -3.069 6.880 132 H ARG 742 HN ARG 742 -2.928 -8.163 5.089 133 HA ARG 742 HA ARG 742 -3.238 -8.280 7.894 134 HB2 ARG 742 HB2 ARG 742 -2.883 -10.876 6.489 135 HB3 ARG 742 HB3 ARG 742 -4.029 -10.354 7.688 136 HG2 ARG 742 HG2 ARG 742 -4.172 -9.379 4.961 137 HG3 ARG 742 HG3 ARG 742 -4.903 -10.936 5.402 138 HD2 ARG 742 HD2 ARG 742 -5.984 -9.144 7.276 139 HD3 ARG 742 HD3 ARG 742 -5.695 -8.161 5.891 140 HE ARG 742 HE ARG 742 -7.366 -9.005 4.836 141 HH11 ARG 742 HH11 ARG 742 -6.424 -11.623 7.108 142 HH12 ARG 742 HH12 ARG 742 -7.661 -12.622 6.565 143 HH21 ARG 742 HH21 ARG 742 -8.951 -10.523 4.079 144 HH22 ARG 742 HH22 ARG 742 -9.139 -11.971 4.906 145 H GLN 743 HN GLN 743 -0.653 -9.320 5.806 146 HA GLN 743 HA GLN 743 0.737 -10.861 7.595 147 HB2 GLN 743 HB2 GLN 743 1.267 -9.673 5.145 148 HB3 GLN 743 HB3 GLN 743 2.483 -9.074 6.223 149 HG2 GLN 743 HG2 GLN 743 3.595 -11.001 6.404 150 HG3 GLN 743 HG3 GLN 743 2.146 -11.981 6.421 151 HE21 GLN 743 HE21 GLN 743 1.079 -10.863 4.022 152 HE22 GLN 743 HE22 GLN 743 1.964 -11.449 2.701 153 H ASP 744 HN ASP 744 0.354 -7.540 7.331 154 HA ASP 744 HA ASP 744 2.258 -6.855 9.327 155 HB2 ASP 744 HB2 ASP 744 0.944 -5.362 7.422 156 HB3 ASP 744 HB3 ASP 744 0.217 -4.870 8.900 157 H LEU 745 HN LEU 745 -1.247 -6.835 9.075 158 HA LEU 745 HA LEU 745 -1.517 -6.838 11.978 159 HB2 LEU 745 HB2 LEU 745 -3.843 -5.934 11.326 160 HB3 LEU 745 HB3 LEU 745 -2.484 -4.827 11.500 161 HG LEU 745 HG LEU 745 -2.307 -5.127 8.914 162 HD11 LEU 745 HD11 LEU 745 -3.867 -7.025 9.019 163 HD12 LEU 745 HD12 LEU 745 -4.154 -5.854 7.753 164 HD13 LEU 745 HD13 LEU 745 -5.200 -5.871 9.183 165 HD21 LEU 745 HD21 LEU 745 -4.366 -3.597 10.443 166 HD22 LEU 745 HD22 LEU 745 -4.256 -3.423 8.707 167 HD23 LEU 745 HD23 LEU 745 -2.869 -3.042 9.694 168 H LYS 746 HN LYS 746 -1.160 -9.229 10.740 169 HA LYS 746 HA LYS 746 -3.392 -10.567 10.040 170 HB2 LYS 746 HB2 LYS 746 -0.891 -11.562 11.357 171 HB3 LYS 746 HB3 LYS 746 -2.169 -12.729 11.023 172 HG2 LYS 746 HG2 LYS 746 -1.741 -11.593 8.542 173 HG3 LYS 746 HG3 LYS 746 -0.229 -11.344 9.306 174 HD2 LYS 746 HD2 LYS 746 0.172 -13.571 9.844 175 HD3 LYS 746 HD3 LYS 746 -1.466 -14.052 9.416 176 HE2 LYS 746 HE2 LYS 746 -1.023 -13.483 7.088 177 HE3 LYS 746 HE3 LYS 746 0.618 -12.994 7.518 178 HZ1 LYS 746 HZ1 LYS 746 1.089 -15.220 8.205 179 HZ2 LYS 746 HZ2 LYS 746 0.522 -15.240 6.623 180 HZ3 LYS 746 HZ3 LYS 746 -0.499 -15.709 7.893 181 H GLY 747 HN GLY 747 -5.203 -11.156 11.113 182 HA2 GLY 747 HA3 GLY 747 -6.502 -12.012 12.894 183 HA3 GLY 747 HA2 GLY 747 -5.137 -11.750 13.942 184 H LYS 748 HN LYS 748 -8.089 -10.305 12.909 185 HA LYS 748 HA LYS 748 -7.829 -8.164 14.741 186 HB2 LYS 748 HB2 LYS 748 -7.577 -6.178 13.371 187 HB3 LYS 748 HB3 LYS 748 -6.337 -7.320 12.934 188 HG2 LYS 748 HG2 LYS 748 -8.869 -6.945 11.315 189 HG3 LYS 748 HG3 LYS 748 -7.312 -6.195 10.976 190 HD2 LYS 748 HD2 LYS 748 -6.348 -8.100 10.269 191 HD3 LYS 748 HD3 LYS 748 -7.241 -9.118 11.383 192 HE2 LYS 748 HE2 LYS 748 -9.219 -8.688 10.030 193 HE3 LYS 748 HE3 LYS 748 -8.200 -7.889 8.829 194 HZ1 LYS 748 HZ1 LYS 748 -8.073 -10.718 9.726 195 HZ2 LYS 748 HZ2 LYS 748 -6.943 -10.058 8.707 196 HZ3 LYS 748 HZ3 LYS 748 -8.562 -10.207 8.217 197 H GLY 749 HN GLY 749 -9.566 -9.690 12.138 198 HA2 GLY 749 HA3 GLY 749 -11.872 -8.073 12.839 199 HA3 GLY 749 HA2 GLY 749 -11.534 -8.423 11.176 200 H HIS 750 HN HIS 750 -13.904 -9.180 11.812 201 HA HIS 750 HA HIS 750 -13.937 -11.929 12.718 202 HB2 HIS 750 HB2 HIS 750 -16.127 -10.073 11.801 203 HB3 HIS 750 HB3 HIS 750 -16.431 -11.746 12.253 204 HD2 HIS 750 HD2 HIS 750 -15.095 -11.904 15.136 205 HE1 HIS 750 HE1 HIS 750 -16.862 -8.138 15.932 206 HE2 HIS 750 HE2 HIS 750 -15.522 -10.056 16.867 207 H THR 751 HN THR 751 -15.606 -10.529 9.900 208 HA THR 751 HA THR 751 -14.417 -12.727 8.379 209 HB THR 751 HB THR 751 -16.274 -12.202 6.711 210 HG1 THR 751 HG1 THR 751 -17.258 -10.745 8.903 211 HG21 THR 751 HG21 THR 751 -16.543 -13.654 9.251 212 HG22 THR 751 HG22 THR 751 -16.388 -14.303 7.615 213 HG23 THR 751 HG23 THR 751 -17.924 -13.608 8.158 214 H ASP 752 HN ASP 752 -13.702 -12.437 6.356 215 HA ASP 752 HA ASP 752 -12.001 -10.219 5.838 216 HB2 ASP 752 HB2 ASP 752 -13.215 -12.167 3.859 217 HB3 ASP 752 HB3 ASP 752 -11.752 -11.184 3.661 218 H ALA 753 HN ALA 753 -15.321 -10.837 4.905 219 HA ALA 753 HA ALA 753 -15.563 -8.766 3.023 220 HB1 ALA 753 HB1 ALA 753 -17.715 -9.967 4.738 221 HB2 ALA 753 HB2 ALA 753 -17.112 -10.650 3.239 222 HB3 ALA 753 HB3 ALA 753 -17.938 -9.088 3.226 223 H GLU 754 HN GLU 754 -16.213 -8.842 6.476 224 HA GLU 754 HA GLU 754 -17.253 -6.278 6.761 225 HB2 GLU 754 HB2 GLU 754 -15.874 -8.250 8.478 226 HB3 GLU 754 HB3 GLU 754 -16.159 -6.631 9.117 227 HG2 GLU 754 HG2 GLU 754 -18.536 -7.083 8.895 228 HG3 GLU 754 HG3 GLU 754 -18.183 -8.628 8.109 229 H ILE 755 HN ILE 755 -14.007 -7.497 6.910 230 HA ILE 755 HA ILE 755 -12.807 -5.000 7.740 231 HB ILE 755 HB ILE 755 -11.482 -7.433 6.535 232 HG12 ILE 755 HG12 ILE 755 -11.617 -6.962 9.452 233 HG13 ILE 755 HG13 ILE 755 -13.061 -7.604 8.665 234 HG21 ILE 755 HG21 ILE 755 -10.185 -5.265 6.731 235 HG22 ILE 755 HG22 ILE 755 -9.509 -6.637 7.568 236 HG23 ILE 755 HG23 ILE 755 -10.376 -5.402 8.485 237 HD11 ILE 755 HD11 ILE 755 -10.311 -8.800 8.507 238 HD12 ILE 755 HD12 ILE 755 -11.777 -9.437 7.793 239 HD13 ILE 755 HD13 ILE 755 -11.620 -9.393 9.535 240 H GLU 756 HN GLU 756 -13.179 -6.786 4.722 241 HA GLU 756 HA GLU 756 -11.515 -5.249 3.162 242 HB2 GLU 756 HB2 GLU 756 -12.421 -7.494 2.587 243 HB3 GLU 756 HB3 GLU 756 -13.988 -6.711 2.288 244 HG2 GLU 756 HG2 GLU 756 -12.803 -5.412 0.430 245 HG3 GLU 756 HG3 GLU 756 -11.433 -6.461 0.727 246 H ALA 757 HN ALA 757 -14.952 -5.008 3.742 247 HA ALA 757 HA ALA 757 -15.462 -2.735 2.116 248 HB1 ALA 757 HB1 ALA 757 -16.963 -4.101 4.309 249 HB2 ALA 757 HB2 ALA 757 -17.392 -3.885 2.584 250 HB3 ALA 757 HB3 ALA 757 -17.497 -2.545 3.694 251 H ILE 758 HN ILE 758 -14.921 -3.128 5.617 252 HA ILE 758 HA ILE 758 -15.544 -0.547 6.376 253 HB ILE 758 HB ILE 758 -15.337 -2.409 8.002 254 HG12 ILE 758 HG12 ILE 758 -15.135 0.142 8.597 255 HG13 ILE 758 HG13 ILE 758 -14.881 -1.072 9.843 256 HG21 ILE 758 HG21 ILE 758 -13.216 -3.281 7.125 257 HG22 ILE 758 HG22 ILE 758 -13.286 -3.208 8.881 258 HG23 ILE 758 HG23 ILE 758 -12.362 -1.996 7.974 259 HD11 ILE 758 HD11 ILE 758 -13.268 0.780 9.943 260 HD12 ILE 758 HD12 ILE 758 -12.677 0.343 8.326 261 HD13 ILE 758 HD13 ILE 758 -12.485 -0.764 9.671 262 H PHE 759 HN PHE 759 -12.404 -1.963 5.489 263 HA PHE 759 HA PHE 759 -10.936 0.324 6.122 264 HB2 PHE 759 HB2 PHE 759 -9.053 -0.807 5.288 265 HB3 PHE 759 HB3 PHE 759 -10.176 -2.087 5.663 266 HD1 PHE 759 HD2 PHE 759 -9.296 -0.010 2.613 267 HD2 PHE 759 HD1 PHE 759 -10.328 -3.828 4.176 268 HE1 PHE 759 HE2 PHE 759 -9.072 -0.978 0.387 269 HE2 PHE 759 HE1 PHE 759 -10.065 -4.796 1.916 270 HZ PHE 759 HZ PHE 759 -9.451 -3.379 0.041 271 H THR 760 HN THR 760 -12.774 -0.485 3.333 272 HA THR 760 HA THR 760 -11.462 1.150 1.468 273 HB THR 760 HB THR 760 -14.374 0.288 1.538 274 HG1 THR 760 HG1 THR 760 -13.153 -1.578 1.432 275 HG21 THR 760 HG21 THR 760 -13.897 2.159 -0.035 276 HG22 THR 760 HG22 THR 760 -14.404 0.678 -0.821 277 HG23 THR 760 HG23 THR 760 -12.694 1.138 -0.840 278 H LYS 761 HN LYS 761 -13.977 1.723 3.770 279 HA LYS 761 HA LYS 761 -14.102 4.525 2.925 280 HB2 LYS 761 HB2 LYS 761 -16.163 3.049 3.525 281 HB3 LYS 761 HB3 LYS 761 -15.760 3.465 5.177 282 HG2 LYS 761 HG2 LYS 761 -16.099 5.850 4.755 283 HG3 LYS 761 HG3 LYS 761 -16.187 5.522 3.038 284 HD2 LYS 761 HD2 LYS 761 -18.253 4.234 3.427 285 HD3 LYS 761 HD3 LYS 761 -18.161 4.644 5.139 286 HE2 LYS 761 HE2 LYS 761 -18.292 7.015 4.598 287 HE3 LYS 761 HE3 LYS 761 -18.321 6.630 2.883 288 HZ1 LYS 761 HZ1 LYS 761 -20.400 5.938 4.883 289 HZ2 LYS 761 HZ2 LYS 761 -20.380 5.406 3.276 290 HZ3 LYS 761 HZ3 LYS 761 -20.534 7.033 3.592 291 H TYR 762 HN TYR 762 -13.205 2.630 5.825 292 HA TYR 762 HA TYR 762 -12.528 5.098 7.195 293 HB2 TYR 762 HB2 TYR 762 -13.174 2.372 8.079 294 HB3 TYR 762 HB3 TYR 762 -12.085 3.307 9.093 295 HD1 TYR 762 HD1 TYR 762 -12.834 5.477 9.966 296 HD2 TYR 762 HD2 TYR 762 -15.524 2.811 8.050 297 HE1 TYR 762 HE1 TYR 762 -14.715 6.674 10.972 298 HE2 TYR 762 HE2 TYR 762 -17.422 3.997 9.049 299 HH TYR 762 HH TYR 762 -17.078 7.035 10.541 300 H ASP 763 HN ASP 763 -10.773 2.537 5.598 301 HA ASP 763 HA ASP 763 -8.410 2.660 7.124 302 HB2 ASP 763 HB2 ASP 763 -9.027 0.958 5.294 303 HB3 ASP 763 HB3 ASP 763 -8.500 2.134 4.176 304 H GLN 764 HN GLN 764 -6.425 3.607 6.566 305 HA GLN 764 HA GLN 764 -6.513 6.307 6.146 306 HB2 GLN 764 HB2 GLN 764 -4.744 4.968 7.317 307 HB3 GLN 764 HB3 GLN 764 -4.154 4.439 5.768 308 HG2 GLN 764 HG2 GLN 764 -4.156 7.318 6.678 309 HG3 GLN 764 HG3 GLN 764 -2.813 6.214 6.908 310 HE21 GLN 764 HE21 GLN 764 -1.660 5.517 5.107 311 HE22 GLN 764 HE22 GLN 764 -1.756 6.331 3.595 312 H ASP 765 HN ASP 765 -5.653 3.757 3.748 313 HA ASP 765 HA ASP 765 -5.878 5.923 1.760 314 HB2 ASP 765 HB2 ASP 765 -4.247 3.470 1.795 315 HB3 ASP 765 HB3 ASP 765 -4.836 4.047 0.239 316 H GLY 766 HN GLY 766 -7.654 3.326 2.878 317 HA2 GLY 766 HA3 GLY 766 -9.611 2.259 2.028 318 HA3 GLY 766 HA2 GLY 766 -9.724 3.656 0.976 319 H ASP 767 HN ASP 767 -6.822 2.118 0.587 320 HA ASP 767 HA ASP 767 -7.685 0.968 -1.954 321 HB2 ASP 767 HB2 ASP 767 -5.074 2.020 -0.915 322 HB3 ASP 767 HB3 ASP 767 -5.083 0.950 -2.336 323 H GLN 768 HN GLN 768 -5.227 0.231 0.450 324 HA GLN 768 HA GLN 768 -4.326 -1.803 1.148 325 HB2 GLN 768 HB2 GLN 768 -6.615 -1.093 2.379 326 HB3 GLN 768 HB3 GLN 768 -7.098 -2.648 1.798 327 HG2 GLN 768 HG2 GLN 768 -5.377 -3.707 2.949 328 HG3 GLN 768 HG3 GLN 768 -4.686 -2.152 3.431 329 HE21 GLN 768 HE21 GLN 768 -7.143 -4.465 4.067 330 HE22 GLN 768 HE22 GLN 768 -7.796 -3.642 5.444 331 H GLU 769 HN GLU 769 -3.659 -2.695 -0.763 332 HA GLU 769 HA GLU 769 -3.983 -5.130 -1.555 333 HB2 GLU 769 HB2 GLU 769 -5.604 -5.475 -3.366 334 HB3 GLU 769 HB3 GLU 769 -6.470 -4.819 -1.992 335 HG2 GLU 769 HG2 GLU 769 -7.287 -3.158 -3.286 336 HG3 GLU 769 HG3 GLU 769 -5.650 -2.679 -3.748 337 H LEU 770 HN LEU 770 -2.452 -2.486 -1.917 338 HA LEU 770 HA LEU 770 -2.156 -2.638 -4.798 339 HB2 LEU 770 HB2 LEU 770 -2.098 -0.241 -3.001 340 HB3 LEU 770 HB3 LEU 770 -0.953 -0.234 -4.277 341 HG LEU 770 HG LEU 770 -2.802 -0.265 -5.929 342 HD11 LEU 770 HD11 LEU 770 -5.106 -0.006 -5.168 343 HD12 LEU 770 HD12 LEU 770 -4.546 -0.508 -3.558 344 HD13 LEU 770 HD13 LEU 770 -4.389 -1.596 -4.929 345 HD21 LEU 770 HD21 LEU 770 -3.768 1.911 -5.411 346 HD22 LEU 770 HD22 LEU 770 -2.030 1.871 -5.143 347 HD23 LEU 770 HD23 LEU 770 -3.129 1.797 -3.768 348 H THR 771 HN THR 771 -0.201 -3.337 -5.528 349 HA THR 771 HA THR 771 1.782 -3.887 -3.546 350 HB THR 771 HB THR 771 2.844 -5.253 -5.103 351 HG1 THR 771 HG1 THR 771 2.713 -5.015 -7.134 352 HG21 THR 771 HG21 THR 771 -0.072 -5.169 -5.736 353 HG22 THR 771 HG22 THR 771 0.799 -6.247 -4.633 354 HG23 THR 771 HG23 THR 771 1.011 -6.409 -6.369 355 H GLU 772 HN GLU 772 4.199 -3.391 -4.147 356 HA GLU 772 HA GLU 772 4.668 -0.660 -4.306 357 HB2 GLU 772 HB2 GLU 772 6.112 -2.571 -3.388 358 HB3 GLU 772 HB3 GLU 772 6.667 -2.838 -5.016 359 HG2 GLU 772 HG2 GLU 772 6.898 -0.248 -3.605 360 HG3 GLU 772 HG3 GLU 772 8.187 -1.458 -3.616 361 H HIS 773 HN HIS 773 4.469 -3.201 -6.713 362 HA HIS 773 HA HIS 773 5.627 -1.583 -8.733 363 HB2 HIS 773 HB2 HIS 773 3.912 -4.056 -9.169 364 HB3 HIS 773 HB3 HIS 773 4.766 -3.182 -10.400 365 HD2 HIS 773 HD2 HIS 773 5.691 -5.495 -7.364 366 HE1 HIS 773 HE1 HIS 773 9.014 -5.183 -9.963 367 HE2 HIS 773 HE2 HIS 773 8.192 -5.950 -7.740 368 H GLU 774 HN GLU 774 2.321 -2.086 -7.668 369 HA GLU 774 HA GLU 774 1.261 -0.476 -9.845 370 HB2 GLU 774 HB2 GLU 774 -0.242 -1.078 -7.241 371 HB3 GLU 774 HB3 GLU 774 -0.818 -0.628 -8.849 372 HG2 GLU 774 HG2 GLU 774 -0.199 -2.759 -9.816 373 HG3 GLU 774 HG3 GLU 774 0.626 -3.186 -8.361 374 H HIS 775 HN HIS 775 2.092 0.048 -6.545 375 HA HIS 775 HA HIS 775 1.244 2.769 -6.200 376 HB2 HIS 775 HB2 HIS 775 1.668 1.169 -4.324 377 HB3 HIS 775 HB3 HIS 775 3.356 1.112 -4.787 378 HD2 HIS 775 HD2 HIS 775 4.582 2.374 -2.805 379 HE1 HIS 775 HE1 HIS 775 2.062 5.768 -2.569 380 HE2 HIS 775 HE2 HIS 775 4.015 4.600 -1.570 381 H GLN 776 HN GLN 776 4.154 1.327 -7.536 382 HA GLN 776 HA GLN 776 5.788 3.540 -7.546 383 HB2 GLN 776 HB2 GLN 776 6.349 1.198 -8.344 384 HB3 GLN 776 HB3 GLN 776 5.563 1.629 -9.858 385 HG2 GLN 776 HG2 GLN 776 7.940 1.870 -10.108 386 HG3 GLN 776 HG3 GLN 776 7.239 3.481 -10.143 387 HE21 GLN 776 HE21 GLN 776 9.211 1.267 -8.415 388 HE22 GLN 776 HE22 GLN 776 9.841 2.389 -7.272 389 H GLN 777 HN GLN 777 3.205 2.635 -9.687 390 HA GLN 777 HA GLN 777 3.584 4.916 -11.458 391 HB2 GLN 777 HB2 GLN 777 1.273 2.993 -11.478 392 HB3 GLN 777 HB3 GLN 777 1.938 3.897 -12.819 393 HG2 GLN 777 HG2 GLN 777 3.583 2.386 -13.229 394 HG3 GLN 777 HG3 GLN 777 3.743 1.938 -11.533 395 HE21 GLN 777 HE21 GLN 777 0.901 1.397 -11.169 396 HE22 GLN 777 HE22 GLN 777 0.573 -0.087 -11.957 397 H MET 778 HN MET 778 1.313 3.781 -9.036 398 HA MET 778 HA MET 778 -0.409 5.943 -9.614 399 HB2 MET 778 HB2 MET 778 -0.796 3.377 -8.182 400 HB3 MET 778 HB3 MET 778 -2.037 4.626 -8.216 401 HG2 MET 778 HG2 MET 778 -0.822 3.324 -10.620 402 HG3 MET 778 HG3 MET 778 -2.396 2.866 -9.958 403 HE1 MET 778 HE1 MET 778 -3.442 4.644 -13.254 404 HE2 MET 778 HE2 MET 778 -3.654 3.232 -12.219 405 HE3 MET 778 HE3 MET 778 -2.094 3.538 -12.983 406 H ARG 779 HN ARG 779 -0.133 7.555 -8.123 407 HA ARG 779 HA ARG 779 -0.371 8.615 -6.284 408 HB2 ARG 779 HB2 ARG 779 0.353 6.181 -4.718 409 HB3 ARG 779 HB3 ARG 779 0.345 7.766 -3.985 410 HG2 ARG 779 HG2 ARG 779 -1.993 8.030 -4.527 411 HG3 ARG 779 HG3 ARG 779 -1.987 6.438 -5.305 412 HD2 ARG 779 HD2 ARG 779 -1.321 7.025 -2.434 413 HD3 ARG 779 HD3 ARG 779 -2.816 6.283 -3.005 414 HE ARG 779 HE ARG 779 -0.714 4.832 -4.014 415 HH11 ARG 779 HH11 ARG 779 -1.937 5.604 -0.805 416 HH12 ARG 779 HH12 ARG 779 -1.540 4.161 -0.063 417 HH21 ARG 779 HH21 ARG 779 -0.138 2.730 -3.023 418 HH22 ARG 779 HH22 ARG 779 -0.464 2.420 -1.379 419 H ASP 780 HN ASP 780 0.753 9.767 -4.889 420 HA ASP 780 HA ASP 780 3.656 9.835 -5.323 421 HB2 ASP 780 HB2 ASP 780 1.820 12.229 -5.613 422 HB3 ASP 780 HB3 ASP 780 3.568 12.174 -5.599 423 H ASP 781 HN ASP 781 3.798 9.149 -3.096 424 HA ASP 781 HA ASP 781 2.746 10.936 -0.996 425 HB2 ASP 781 HB2 ASP 781 2.869 8.362 -0.768 426 HB3 ASP 781 HB3 ASP 781 4.589 8.580 -0.533 427 H LEU 782 HN LEU 782 5.863 9.893 -2.145 428 HA LEU 782 HA LEU 782 7.422 11.616 -0.324 429 HB2 LEU 782 HB2 LEU 782 8.143 9.394 -1.595 430 HB3 LEU 782 HB3 LEU 782 8.449 10.491 -2.924 431 HG LEU 782 HG LEU 782 10.003 11.752 -1.433 432 HD11 LEU 782 HD11 LEU 782 10.872 10.564 0.509 433 HD12 LEU 782 HD12 LEU 782 9.642 9.320 0.299 434 HD13 LEU 782 HD13 LEU 782 9.172 10.973 0.702 435 HD21 LEU 782 HD21 LEU 782 10.775 10.200 -3.143 436 HD22 LEU 782 HD22 LEU 782 10.640 8.858 -2.001 437 HD23 LEU 782 HD23 LEU 782 11.807 10.153 -1.718 438 H GLU 783 HN GLU 783 6.019 11.898 -3.451 439 HA GLU 783 HA GLU 783 7.220 14.059 -4.586 440 HB2 GLU 783 HB2 GLU 783 5.208 12.939 -5.415 441 HB3 GLU 783 HB3 GLU 783 4.236 13.933 -4.347 442 HG2 GLU 783 HG2 GLU 783 4.270 15.060 -6.596 443 HG3 GLU 783 HG3 GLU 783 5.146 15.955 -5.383 444 H LYS 784 HN LYS 784 5.185 13.937 -1.660 445 HA LYS 784 HA LYS 784 5.195 16.848 -1.571 446 HB2 LYS 784 HB2 LYS 784 3.068 15.420 -2.284 447 HB3 LYS 784 HB3 LYS 784 2.865 15.479 -0.537 448 HG2 LYS 784 HG2 LYS 784 2.841 17.816 -0.488 449 HG3 LYS 784 HG3 LYS 784 3.199 17.872 -2.229 450 HD2 LYS 784 HD2 LYS 784 0.910 18.184 -1.918 451 HD3 LYS 784 HD3 LYS 784 1.238 16.595 -2.667 452 HE2 LYS 784 HE2 LYS 784 0.997 15.603 -0.308 453 HE3 LYS 784 HE3 LYS 784 0.370 17.176 0.176 454 HZ1 LYS 784 HZ1 LYS 784 -1.446 16.877 -1.409 455 HZ2 LYS 784 HZ2 LYS 784 -1.375 15.582 -0.325 456 HZ3 LYS 784 HZ3 LYS 784 -0.784 15.399 -1.882 457 H GLU 785 HN GLU 785 6.817 15.401 -0.040 458 HA GLU 785 HA GLU 785 6.023 15.951 2.676 459 HB2 GLU 785 HB2 GLU 785 5.036 13.721 2.253 460 HB3 GLU 785 HB3 GLU 785 6.636 13.052 1.956 461 HG2 GLU 785 HG2 GLU 785 7.181 13.569 4.385 462 HG3 GLU 785 HG3 GLU 785 5.492 14.115 4.554 463 H ARG 786 HN ARG 786 7.861 16.272 3.993 464 HA ARG 786 HA ARG 786 10.432 15.719 2.725 465 HB2 ARG 786 HB2 ARG 786 9.967 18.102 3.160 466 HB3 ARG 786 HB3 ARG 786 9.753 17.738 4.863 467 HG2 ARG 786 HG2 ARG 786 12.080 17.140 5.084 468 HG3 ARG 786 HG3 ARG 786 12.332 17.326 3.349 469 HD2 ARG 786 HD2 ARG 786 11.536 19.517 5.263 470 HD3 ARG 786 HD3 ARG 786 13.140 19.269 4.587 471 HE ARG 786 HE ARG 786 11.943 19.552 2.351 472 HH11 ARG 786 HH11 ARG 786 10.919 21.270 5.281 473 HH12 ARG 786 HH12 ARG 786 10.388 22.658 4.448 474 HH21 ARG 786 HH21 ARG 786 11.173 21.399 1.230 475 HH22 ARG 786 HH22 ARG 786 10.494 22.719 2.076 476 H GLU 787 HN GLU 787 11.922 14.493 3.688 477 HA GLU 787 HA GLU 787 11.102 12.914 5.942 478 HB2 GLU 787 HB2 GLU 787 13.641 12.842 4.310 479 HB3 GLU 787 HB3 GLU 787 13.321 11.769 5.654 480 HG2 GLU 787 HG2 GLU 787 12.854 10.512 3.763 481 HG3 GLU 787 HG3 GLU 787 11.273 11.029 4.333 482 H ASP 788 HN ASP 788 12.312 12.607 7.814 483 HA ASP 788 HA ASP 788 13.396 14.980 8.949 484 HB2 ASP 788 HB2 ASP 788 12.079 13.483 10.276 485 HB3 ASP 788 HB3 ASP 788 13.157 12.118 9.932 486 H LEU 789 HN LEU 789 15.618 14.883 9.967 487 HA LEU 789 HA LEU 789 17.526 13.739 8.093 488 HB2 LEU 789 HB2 LEU 789 17.378 16.096 9.176 489 HB3 LEU 789 HB3 LEU 789 18.189 15.318 10.511 490 HG LEU 789 HG LEU 789 20.085 14.664 8.977 491 HD11 LEU 789 HD11 LEU 789 18.622 16.364 6.985 492 HD12 LEU 789 HD12 LEU 789 18.875 14.620 6.871 493 HD13 LEU 789 HD13 LEU 789 20.247 15.713 6.818 494 HD21 LEU 789 HD21 LEU 789 19.413 17.567 9.010 495 HD22 LEU 789 HD22 LEU 789 20.997 16.795 8.783 496 HD23 LEU 789 HD23 LEU 789 20.175 16.675 10.344 497 H ASP 790 HN ASP 790 17.471 11.706 8.533 498 HA ASP 790 HA ASP 790 17.680 10.656 11.293 499 HB2 ASP 790 HB2 ASP 790 15.931 9.823 9.510 500 HB3 ASP 790 HB3 ASP 790 17.285 8.898 8.865 501 H LEU 791 HN LEU 791 18.956 8.389 11.020 502 HA LEU 791 HA LEU 791 21.584 9.123 9.916 503 HB2 LEU 791 HB2 LEU 791 21.363 8.963 12.424 504 HB3 LEU 791 HB3 LEU 791 21.057 7.265 12.254 505 HG LEU 791 HG LEU 791 23.615 8.701 11.570 506 HD11 LEU 791 HD11 LEU 791 23.269 8.778 13.896 507 HD12 LEU 791 HD12 LEU 791 24.415 7.457 13.562 508 HD13 LEU 791 HD13 LEU 791 22.739 7.095 13.928 509 HD21 LEU 791 HD21 LEU 791 22.934 5.749 11.526 510 HD22 LEU 791 HD22 LEU 791 24.562 6.341 11.763 511 HD23 LEU 791 HD23 LEU 791 23.748 6.706 10.261 512 H ASP 792 HN ASP 792 19.373 6.461 10.431 513 HA ASP 792 HA ASP 792 20.602 5.078 8.111 514 HB2 ASP 792 HB2 ASP 792 21.860 4.337 10.026 515 HB3 ASP 792 HB3 ASP 792 20.433 3.698 10.799 516 H HIS 793 HN HIS 793 18.477 3.991 10.570 517 HA HIS 793 HA HIS 793 16.163 3.539 8.645 518 HB2 HIS 793 HB2 HIS 793 17.710 1.483 8.767 519 HB3 HIS 793 HB3 HIS 793 17.209 1.250 10.418 520 HD2 HIS 793 HD2 HIS 793 15.658 1.067 6.798 521 HE1 HIS 793 HE1 HIS 793 13.146 -1.065 9.466 522 HE2 HIS 793 HE2 HIS 793 13.372 -0.057 7.197 523 H SER 794 HN SER 794 15.048 1.853 10.800 524 HA SER 794 HA SER 794 14.430 3.720 13.016 525 HB2 SER 794 HB2 SER 794 11.967 3.233 12.452 526 HB3 SER 794 HB3 SER 794 12.769 4.429 11.442 527 HG SER 794 HG SER 794 11.617 2.130 10.752 528 H SER 795 HN SER 795 15.741 1.341 12.521 529 HA SER 795 HA SER 795 15.295 -0.120 14.797 530 HB2 SER 795 HB2 SER 795 14.283 -1.632 12.319 531 HB3 SER 795 HB3 SER 795 14.700 -2.373 13.853 532 HG SER 795 HG SER 795 12.942 -0.294 14.118 533 H LEU 796 HN LEU 796 17.372 -0.688 15.283 534 HA LEU 796 HA LEU 796 19.022 -1.960 13.193 535 HB2 LEU 796 HB2 LEU 796 19.976 0.416 13.863 536 HB3 LEU 796 HB3 LEU 796 20.184 -0.265 15.461 537 HG LEU 796 HG LEU 796 21.742 -1.904 14.570 538 HD11 LEU 796 HD11 LEU 796 20.906 -2.104 12.298 539 HD12 LEU 796 HD12 LEU 796 22.607 -1.646 12.295 540 HD13 LEU 796 HD13 LEU 796 21.369 -0.436 11.964 541 HD21 LEU 796 HD21 LEU 796 22.543 0.210 15.464 542 HD22 LEU 796 HD22 LEU 796 22.357 0.968 13.884 543 HD23 LEU 796 HD23 LEU 796 23.549 -0.311 14.113
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