NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
520861 | 2ljf | 17932 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H LYS 716 HT1 LYS 716 -0.265 0.533 0.278 2 HA LYS 716 HA LYS 716 2.013 0.936 -0.194 3 HB2 LYS 716 HB2 LYS 716 1.771 -0.283 2.572 4 HB3 LYS 716 HB1 LYS 716 2.961 0.902 2.060 5 HG2 LYS 716 HG2 LYS 716 1.106 2.507 1.665 6 HG3 LYS 716 HG1 LYS 716 0.003 1.294 2.327 7 HD2 LYS 716 HD2 LYS 716 0.573 2.889 4.078 8 HD3 LYS 716 HD1 LYS 716 1.299 1.330 4.453 9 HE2 LYS 716 HE2 LYS 716 3.449 2.116 3.568 10 HE3 LYS 716 HE1 LYS 716 2.714 3.668 3.166 11 HZ1 LYS 716 HZ1 LYS 716 2.306 4.045 5.528 12 HZ2 LYS 716 HZ2 LYS 716 3.936 3.794 5.254 13 HZ3 LYS 716 HZ3 LYS 716 3.009 2.574 5.937 14 H LEU 717 HN LEU 717 1.692 -2.236 1.368 15 HA LEU 717 HA LEU 717 4.270 -2.972 0.360 16 HB2 LEU 717 HB2 LEU 717 2.278 -4.443 2.061 17 HB3 LEU 717 HB1 LEU 717 3.843 -5.070 1.595 18 HG LEU 717 HG LEU 717 3.991 -4.341 3.792 19 HD11 LEU 717 HD11 LEU 717 5.949 -3.825 2.481 20 HD12 LEU 717 HD12 LEU 717 5.725 -2.564 3.696 21 HD13 LEU 717 HD13 LEU 717 5.270 -2.266 2.017 22 HD21 LEU 717 HD21 LEU 717 2.075 -2.889 3.951 23 HD22 LEU 717 HD22 LEU 717 2.870 -1.675 2.953 24 HD23 LEU 717 HD23 LEU 717 3.500 -2.046 4.560 25 H LEU 718 HN LEU 718 1.169 -4.808 0.381 26 HA LEU 718 HA LEU 718 1.814 -5.575 -2.382 27 HB2 LEU 718 HB2 LEU 718 0.813 -7.416 -0.207 28 HB3 LEU 718 HB1 LEU 718 0.935 -7.845 -1.897 29 HG LEU 718 HG LEU 718 3.214 -7.229 -0.016 30 HD11 LEU 718 HD11 LEU 718 3.833 -9.560 -0.402 31 HD12 LEU 718 HD12 LEU 718 2.393 -9.774 -1.395 32 HD13 LEU 718 HD13 LEU 718 2.231 -9.424 0.325 33 HD21 LEU 718 HD21 LEU 718 3.287 -7.952 -2.946 34 HD22 LEU 718 HD22 LEU 718 4.693 -7.814 -1.891 35 HD23 LEU 718 HD23 LEU 718 3.720 -6.389 -2.258 36 H ILE 719 HN ILE 719 -0.852 -5.743 0.006 37 HA ILE 719 HA ILE 719 -2.689 -5.654 -2.300 38 HB ILE 719 HB ILE 719 -3.640 -6.502 0.399 39 HG12 ILE 719 HG12 ILE 719 -2.115 -8.362 -1.448 40 HG13 ILE 719 HG11 ILE 719 -1.433 -7.664 0.012 41 HG21 ILE 719 HG21 ILE 719 -5.177 -6.329 -1.508 42 HG22 ILE 719 HG22 ILE 719 -5.024 -8.001 -0.978 43 HG23 ILE 719 HG23 ILE 719 -4.176 -7.455 -2.426 44 HD11 ILE 719 HD11 ILE 719 -3.808 -9.502 -0.132 45 HD12 ILE 719 HD12 ILE 719 -3.137 -8.795 1.341 46 HD13 ILE 719 HD13 ILE 719 -2.181 -9.934 0.393 47 H THR 720 HN THR 720 -1.899 -4.181 0.724 48 HA THR 720 HA THR 720 -2.387 -2.161 1.620 49 HB THR 720 HB THR 720 -4.108 -1.522 -0.823 50 HG1 THR 720 HG1 THR 720 -2.167 -1.994 -1.699 51 HG21 THR 720 HG21 THR 720 -3.472 0.807 -0.316 52 HG22 THR 720 HG22 THR 720 -2.521 0.249 1.061 53 HG23 THR 720 HG23 THR 720 -4.275 0.064 1.068 54 H ILE 721 HN ILE 721 -4.193 -4.630 1.775 55 HA ILE 721 HA ILE 721 -6.380 -3.244 3.109 56 HB ILE 721 HB ILE 721 -7.965 -5.086 2.445 57 HG12 ILE 721 HG12 ILE 721 -5.898 -5.614 0.289 58 HG13 ILE 721 HG11 ILE 721 -6.321 -6.752 1.557 59 HG21 ILE 721 HG21 ILE 721 -8.534 -4.059 0.265 60 HG22 ILE 721 HG22 ILE 721 -6.974 -3.236 0.279 61 HG23 ILE 721 HG23 ILE 721 -8.174 -2.867 1.517 62 HD11 ILE 721 HD11 ILE 721 -8.603 -6.872 0.640 63 HD12 ILE 721 HD12 ILE 721 -7.370 -7.367 -0.519 64 HD13 ILE 721 HD13 ILE 721 -8.118 -5.774 -0.652 65 H HIS 722 HN HIS 722 -5.095 -6.549 2.724 66 HA HIS 722 HA HIS 722 -5.872 -7.066 5.472 67 HB2 HIS 722 HB2 HIS 722 -4.835 -8.834 3.277 68 HB3 HIS 722 HB1 HIS 722 -4.897 -9.379 4.947 69 HD1 HIS 722 HD1 HIS 722 -6.921 -9.109 1.913 70 HD2 HIS 722 HD2 HIS 722 -7.544 -9.364 5.997 71 HE1 HIS 722 HE1 HIS 722 -9.304 -9.770 2.161 72 HE2 HIS 722 HE2 HIS 722 -9.749 -9.727 4.618 73 H ASP 723 HN ASP 723 -3.322 -5.914 3.782 74 HA ASP 723 HA ASP 723 -1.013 -6.725 5.068 75 HB2 ASP 723 HB2 ASP 723 -1.633 -3.885 4.234 76 HB3 ASP 723 HB1 ASP 723 -0.064 -4.673 4.290 77 H ARG 724 HN ARG 724 -3.617 -5.068 6.220 78 HA ARG 724 HA ARG 724 -2.240 -4.335 8.733 79 HB2 ARG 724 HB2 ARG 724 -2.789 -2.341 7.616 80 HB3 ARG 724 HB1 ARG 724 -4.382 -2.910 7.201 81 HG2 ARG 724 HG2 ARG 724 -4.688 -1.356 8.991 82 HG3 ARG 724 HG1 ARG 724 -4.923 -3.000 9.607 83 HD2 ARG 724 HD2 ARG 724 -3.665 -2.038 11.209 84 HD3 ARG 724 HD1 ARG 724 -2.537 -2.952 10.199 85 HE ARG 724 HE ARG 724 -2.375 -0.567 9.042 86 HH11 ARG 724 HH11 ARG 724 -2.175 -1.410 12.482 87 HH12 ARG 724 HH12 ARG 724 -1.180 -0.114 12.913 88 HH21 ARG 724 HH21 ARG 724 -1.009 1.262 9.619 89 HH22 ARG 724 HH22 ARG 724 -0.507 1.478 11.229 90 H LYS 725 HN LYS 725 -5.039 -5.785 7.224 91 HA LYS 725 HA LYS 725 -6.709 -5.392 9.488 92 HB2 LYS 725 HB2 LYS 725 -7.154 -6.873 6.907 93 HB3 LYS 725 HB1 LYS 725 -8.348 -6.917 8.190 94 HG2 LYS 725 HG2 LYS 725 -7.393 -4.245 7.289 95 HG3 LYS 725 HG1 LYS 725 -8.451 -5.148 6.208 96 HD2 LYS 725 HD2 LYS 725 -9.846 -3.739 7.555 97 HD3 LYS 725 HD1 LYS 725 -10.064 -5.385 8.137 98 HE2 LYS 725 HE2 LYS 725 -8.447 -4.903 9.949 99 HE3 LYS 725 HE1 LYS 725 -8.344 -3.238 9.374 100 HZ1 LYS 725 HZ1 LYS 725 -9.906 -3.319 11.171 101 HZ2 LYS 725 HZ2 LYS 725 -10.730 -4.615 10.466 102 HZ3 LYS 725 HZ3 LYS 725 -10.814 -3.108 9.752 103 H GLU 726 HN GLU 726 -4.675 -7.919 8.448 104 HA GLU 726 HA GLU 726 -5.900 -9.872 10.162 105 HB2 GLU 726 HB2 GLU 726 -3.867 -11.249 9.654 106 HB3 GLU 726 HB1 GLU 726 -4.940 -10.712 8.347 107 HG2 GLU 726 HG2 GLU 726 -3.204 -8.824 8.028 108 HG3 GLU 726 HG1 GLU 726 -2.154 -9.899 8.952 109 H PHE 727 HN PHE 727 -4.150 -7.365 10.699 110 HA PHE 727 HA PHE 727 -3.103 -8.364 13.268 111 HB2 PHE 727 HB2 PHE 727 -2.888 -5.592 12.173 112 HB3 PHE 727 HB1 PHE 727 -1.986 -6.317 13.501 113 HD1 PHE 727 HD2 PHE 727 -0.753 -8.583 12.770 114 HD2 PHE 727 HD1 PHE 727 -1.838 -5.378 10.218 115 HE1 PHE 727 HE2 PHE 727 0.936 -9.308 11.152 116 HE2 PHE 727 HE1 PHE 727 -0.191 -6.070 8.612 117 HZ PHE 727 HZ PHE 727 1.223 -8.056 9.056 118 H ALA 728 HN ALA 728 -5.878 -7.533 12.207 119 HA ALA 728 HA ALA 728 -6.666 -6.008 14.599 120 HB1 ALA 728 HB1 ALA 728 -8.149 -6.265 11.986 121 HB2 ALA 728 HB2 ALA 728 -7.210 -4.867 12.506 122 HB3 ALA 728 HB3 ALA 728 -8.673 -5.320 13.379 123 H LYS 729 HN LYS 729 -7.911 -8.535 12.418 124 HA LYS 729 HA LYS 729 -9.395 -9.652 14.678 125 HB2 LYS 729 HB2 LYS 729 -9.519 -10.639 11.839 126 HB3 LYS 729 HB1 LYS 729 -10.698 -10.858 13.120 127 HG2 LYS 729 HG2 LYS 729 -10.088 -8.359 11.578 128 HG3 LYS 729 HG1 LYS 729 -11.591 -9.281 11.612 129 HD2 LYS 729 HD2 LYS 729 -10.343 -8.024 13.961 130 HD3 LYS 729 HD1 LYS 729 -11.515 -7.140 12.975 131 HE2 LYS 729 HE2 LYS 729 -11.930 -9.691 14.578 132 HE3 LYS 729 HE1 LYS 729 -12.673 -8.127 14.919 133 HZ1 LYS 729 HZ1 LYS 729 -13.239 -9.968 12.664 134 HZ2 LYS 729 HZ2 LYS 729 -13.765 -8.364 12.670 135 HZ3 LYS 729 HZ3 LYS 729 -14.328 -9.440 13.846 136 H PHE 730 HN PHE 730 -6.766 -10.236 12.587 137 HA PHE 730 HA PHE 730 -5.084 -11.764 12.526 138 HB2 PHE 730 HB2 PHE 730 -5.996 -12.764 15.243 139 HB3 PHE 730 HB1 PHE 730 -4.421 -12.834 14.438 140 HD1 PHE 730 HD2 PHE 730 -6.845 -10.555 15.964 141 HD2 PHE 730 HD1 PHE 730 -2.852 -11.138 14.710 142 HE1 PHE 730 HE2 PHE 730 -6.291 -8.555 17.035 143 HE2 PHE 730 HE1 PHE 730 -2.196 -9.058 15.822 144 HZ PHE 730 HZ PHE 730 -3.895 -7.721 17.014 145 H GLU 731 HN GLU 731 -7.747 -12.389 11.663 146 HA GLU 731 HA GLU 731 -7.632 -15.347 11.855 147 HB2 GLU 731 HB2 GLU 731 -10.070 -13.646 11.466 148 HB3 GLU 731 HB1 GLU 731 -10.032 -15.406 11.492 149 HG2 GLU 731 HG2 GLU 731 -9.111 -15.264 13.808 150 HG3 GLU 731 HG1 GLU 731 -9.360 -13.532 13.737 151 H GLU 732 HN GLU 732 -7.317 -12.831 9.851 152 HA GLU 732 HA GLU 732 -8.144 -14.320 7.507 153 HB2 GLU 732 HB2 GLU 732 -7.343 -12.134 6.273 154 HB3 GLU 732 HB1 GLU 732 -8.878 -12.174 7.114 155 HG2 GLU 732 HG2 GLU 732 -6.356 -11.103 8.383 156 HG3 GLU 732 HG1 GLU 732 -7.449 -10.096 7.434 157 H GLU 733 HN GLU 733 -5.178 -12.206 7.531 158 HA GLU 733 HA GLU 733 -3.126 -12.558 6.777 159 HB2 GLU 733 HB2 GLU 733 -3.467 -15.360 7.678 160 HB3 GLU 733 HB1 GLU 733 -2.007 -14.469 7.245 161 HG2 GLU 733 HG2 GLU 733 -2.123 -13.033 9.124 162 HG3 GLU 733 HG1 GLU 733 -3.702 -13.656 9.618 163 H ARG 734 HN ARG 734 -3.563 -12.176 4.927 164 HA ARG 734 HA ARG 734 -4.060 -14.175 2.866 165 HB2 ARG 734 HB2 ARG 734 -2.816 -11.472 2.453 166 HB3 ARG 734 HB1 ARG 734 -3.561 -12.495 1.230 167 HG2 ARG 734 HG2 ARG 734 -4.915 -11.175 3.540 168 HG3 ARG 734 HG1 ARG 734 -5.033 -10.734 1.837 169 HD2 ARG 734 HD2 ARG 734 -5.746 -13.436 2.859 170 HD3 ARG 734 HD1 ARG 734 -6.896 -12.102 2.847 171 HE ARG 734 HE ARG 734 -5.868 -12.210 0.297 172 HH11 ARG 734 HH11 ARG 734 -7.586 -14.514 2.381 173 HH12 ARG 734 HH12 ARG 734 -8.329 -15.340 1.114 174 HH21 ARG 734 HH21 ARG 734 -6.914 -13.365 -1.497 175 HH22 ARG 734 HH22 ARG 734 -7.922 -14.687 -1.125 176 H ALA 735 HN ALA 735 -1.223 -12.277 3.674 177 HA ALA 735 HA ALA 735 0.410 -14.387 2.497 178 HB1 ALA 735 HB1 ALA 735 2.190 -12.735 2.453 179 HB2 ALA 735 HB2 ALA 735 1.141 -11.566 3.247 180 HB3 ALA 735 HB3 ALA 735 0.761 -12.127 1.613 181 H ARG 736 HN ARG 736 -0.969 -13.874 5.292 182 HA ARG 736 HA ARG 736 -0.674 -14.515 7.371 183 HB2 ARG 736 HB2 ARG 736 1.808 -15.877 6.358 184 HB3 ARG 736 HB1 ARG 736 0.968 -16.038 7.914 185 HG2 ARG 736 HG2 ARG 736 -0.902 -17.064 6.951 186 HG3 ARG 736 HG1 ARG 736 -0.395 -16.625 5.314 187 HD2 ARG 736 HD2 ARG 736 1.402 -18.168 5.380 188 HD3 ARG 736 HD1 ARG 736 1.173 -18.453 7.105 189 HE ARG 736 HE ARG 736 -1.041 -19.105 5.357 190 HH11 ARG 736 HH11 ARG 736 1.792 -20.258 7.161 191 HH12 ARG 736 HH12 ARG 736 1.278 -21.876 7.256 192 HH21 ARG 736 HH21 ARG 736 -1.773 -21.384 5.469 193 HH22 ARG 736 HH22 ARG 736 -0.808 -22.530 6.268 194 H ALA 737 HN ALA 737 -0.345 -12.185 7.599 195 HA ALA 737 HA ALA 737 0.549 -10.451 8.736 196 HB1 ALA 737 HB1 ALA 737 2.337 -10.765 10.333 197 HB2 ALA 737 HB2 ALA 737 2.715 -12.336 9.630 198 HB3 ALA 737 HB3 ALA 737 1.176 -12.085 10.454 199 H LYS 738 HN LYS 738 2.879 -12.322 7.234 200 HA LYS 738 HA LYS 738 4.945 -11.793 6.095 201 HB2 LYS 738 HB2 LYS 738 2.969 -12.159 4.547 202 HB3 LYS 738 HB1 LYS 738 3.004 -10.442 4.220 203 HG2 LYS 738 HG2 LYS 738 4.219 -11.427 2.504 204 HG3 LYS 738 HG1 LYS 738 5.450 -10.798 3.603 205 HD2 LYS 738 HD2 LYS 738 5.677 -13.033 4.605 206 HD3 LYS 738 HD1 LYS 738 4.468 -13.652 3.480 207 HE2 LYS 738 HE2 LYS 738 6.563 -14.215 2.550 208 HE3 LYS 738 HE1 LYS 738 5.937 -12.824 1.650 209 HZ1 LYS 738 HZ1 LYS 738 7.382 -11.384 3.032 210 HZ2 LYS 738 HZ2 LYS 738 8.246 -12.468 2.104 211 HZ3 LYS 738 HZ3 LYS 738 8.054 -12.764 3.749 212 H TRP 739 HN TRP 739 3.161 -8.990 5.237 213 HA TRP 739 HA TRP 739 5.346 -7.216 5.046 214 HB2 TRP 739 HB2 TRP 739 2.735 -6.001 5.716 215 HB3 TRP 739 HB1 TRP 739 3.810 -5.683 4.359 216 HD1 TRP 739 HD1 TRP 739 3.206 -6.867 2.084 217 HE1 TRP 739 HE1 TRP 739 1.200 -8.325 1.309 218 HE3 TRP 739 HE3 TRP 739 1.133 -7.865 6.546 219 HZ2 TRP 739 HZ2 TRP 739 -1.028 -9.736 2.512 220 HZ3 TRP 739 HZ3 TRP 739 -0.888 -9.213 6.655 221 HH2 TRP 739 HH2 TRP 739 -1.915 -10.112 4.667 222 H ASP 740 HN ASP 740 2.790 -7.467 7.488 223 HA ASP 740 HA ASP 740 2.644 -6.993 9.738 224 HB2 ASP 740 HB2 ASP 740 4.595 -8.765 9.490 225 HB3 ASP 740 HB1 ASP 740 5.572 -7.392 10.044 226 H THR 741 HN THR 741 3.427 -4.768 7.942 227 HA THR 741 HA THR 741 5.305 -3.094 9.270 228 HB THR 741 HB THR 741 4.349 -1.316 7.759 229 HG1 THR 741 HG1 THR 741 2.731 -1.797 6.499 230 HG21 THR 741 HG21 THR 741 5.280 -2.339 5.731 231 HG22 THR 741 HG22 THR 741 5.209 -3.920 6.518 232 HG23 THR 741 HG23 THR 741 6.289 -2.672 7.144 233 H ALA 742 HN ALA 742 2.240 -3.894 9.997 234 HA ALA 742 HA ALA 742 1.389 -1.400 11.181 235 HB1 ALA 742 HB1 ALA 742 -0.242 -2.953 10.245 236 HB2 ALA 742 HB2 ALA 742 -0.529 -2.668 11.961 237 HB3 ALA 742 HB3 ALA 742 0.236 -4.168 11.430 238 H ASN 743 HN ASN 743 3.618 -3.687 12.013 239 HA ASN 743 HA ASN 743 3.164 -3.243 14.857 240 HB2 ASN 743 HB2 ASN 743 4.303 -5.789 13.711 241 HB3 ASN 743 HB1 ASN 743 3.761 -5.498 15.353 242 HD21 ASN 743 HD21 ASN 743 2.824 -5.997 12.141 243 HD22 ASN 743 HD22 ASN 743 1.182 -6.492 12.373 244 H ASN 744 HN ASN 744 5.638 -4.784 12.839 245 HA ASN 744 HA ASN 744 7.593 -2.874 13.875 246 HB2 ASN 744 HB2 ASN 744 9.284 -4.848 13.722 247 HB3 ASN 744 HB1 ASN 744 8.132 -4.891 15.045 248 HD21 ASN 744 HD21 ASN 744 8.973 -6.220 11.935 249 HD22 ASN 744 HD22 ASN 744 7.991 -7.636 12.131 250 HA PRO 745 HA PRO 745 9.167 -2.033 9.811 251 HB2 PRO 745 HB2 PRO 745 11.622 -3.177 9.351 252 HB3 PRO 745 HB1 PRO 745 11.384 -1.743 10.355 253 HG2 PRO 745 HG2 PRO 745 11.720 -4.595 11.171 254 HG3 PRO 745 HG1 PRO 745 12.405 -3.136 11.906 255 HD2 PRO 745 HD2 PRO 745 10.291 -4.428 12.924 256 HD3 PRO 745 HD1 PRO 745 10.456 -2.680 13.063 257 H LEU 746 HN LEU 746 10.386 -5.310 10.117 258 HA LEU 746 HA LEU 746 8.769 -6.002 7.801 259 HB2 LEU 746 HB2 LEU 746 10.464 -7.988 7.653 260 HB3 LEU 746 HB1 LEU 746 10.838 -6.441 6.907 261 HG LEU 746 HG LEU 746 11.882 -7.154 9.667 262 HD11 LEU 746 HD11 LEU 746 13.909 -7.946 8.603 263 HD12 LEU 746 HD12 LEU 746 13.141 -7.787 7.018 264 HD13 LEU 746 HD13 LEU 746 12.518 -8.945 8.197 265 HD21 LEU 746 HD21 LEU 746 12.043 -4.820 8.940 266 HD22 LEU 746 HD22 LEU 746 12.891 -5.333 7.482 267 HD23 LEU 746 HD23 LEU 746 13.635 -5.569 9.066 268 H PTR 747 HN PTR 747 10.438 -8.084 10.081 269 HA PTR 747 HA PTR 747 8.205 -8.740 11.657 270 HB2 PTR 747 HB2 PTR 747 7.742 -10.993 10.886 271 HB3 PTR 747 HB1 PTR 747 7.245 -9.751 9.743 272 HD1 PTR 747 HD1 PTR 747 9.083 -12.810 10.136 273 HD2 PTR 747 HD2 PTR 747 8.822 -9.304 7.752 274 HE1 PTR 747 HE1 PTR 747 10.317 -13.942 8.333 275 HE2 PTR 747 HE2 PTR 747 10.047 -10.412 5.961 276 H LYS 748 HN LYS 748 11.013 -8.271 11.750 277 HA LYS 748 HA LYS 748 12.290 -10.711 12.528 278 HB2 LYS 748 HB2 LYS 748 14.159 -9.187 13.083 279 HB3 LYS 748 HB1 LYS 748 13.573 -9.023 11.431 280 HG2 LYS 748 HG2 LYS 748 12.130 -7.072 12.396 281 HG3 LYS 748 HG1 LYS 748 13.268 -7.152 13.734 282 HD2 LYS 748 HD2 LYS 748 14.041 -6.874 10.863 283 HD3 LYS 748 HD1 LYS 748 13.794 -5.533 11.987 284 HE2 LYS 748 HE2 LYS 748 15.736 -7.793 12.368 285 HE3 LYS 748 HE1 LYS 748 16.176 -6.197 11.725 286 HZ1 LYS 748 HZ1 LYS 748 16.698 -6.301 14.075 287 HZ2 LYS 748 HZ2 LYS 748 15.177 -6.839 14.459 288 HZ3 LYS 748 HZ3 LYS 748 15.384 -5.252 13.897 289 H GLU 749 HN GLU 749 10.514 -8.177 14.072 290 HA GLU 749 HA GLU 749 11.618 -8.742 16.675 291 HB2 GLU 749 HB2 GLU 749 9.506 -6.773 15.798 292 HB3 GLU 749 HB1 GLU 749 10.087 -6.937 17.448 293 HG2 GLU 749 HG2 GLU 749 12.338 -6.314 16.725 294 HG3 GLU 749 HG1 GLU 749 11.763 -6.170 15.065 295 H ALA 750 HN ALA 750 8.175 -8.367 15.714 296 HA ALA 750 HA ALA 750 7.616 -10.987 16.764 297 HB1 ALA 750 HB1 ALA 750 5.970 -10.208 18.382 298 HB2 ALA 750 HB2 ALA 750 6.368 -8.533 18.003 299 HB3 ALA 750 HB3 ALA 750 7.570 -9.573 18.770 300 H THR 751 HN THR 751 6.878 -11.525 14.755 301 HA THR 751 HA THR 751 4.733 -9.967 13.567 302 HB THR 751 HB THR 751 6.445 -10.950 12.076 303 HG1 THR 751 HG1 THR 751 4.246 -10.652 11.399 304 HG21 THR 751 HG21 THR 751 6.946 -12.985 13.333 305 HG22 THR 751 HG22 THR 751 6.499 -13.384 11.674 306 HG23 THR 751 HG23 THR 751 5.334 -13.612 12.987 307 H SER 752 HN SER 752 2.779 -11.345 12.743 308 HA SER 752 HA SER 752 1.883 -13.005 15.028 309 HB2 SER 752 HB2 SER 752 0.135 -11.047 13.617 310 HB3 SER 752 HB1 SER 752 -0.212 -11.938 15.077 311 HG SER 752 HG SER 752 1.831 -9.969 14.817 312 H THR 753 HN THR 753 1.350 -14.898 14.362 313 HA THR 753 HA THR 753 -0.218 -15.219 11.939 314 HB THR 753 HB THR 753 1.217 -17.195 11.317 315 HG1 THR 753 HG1 THR 753 2.858 -15.920 13.245 316 HG21 THR 753 HG21 THR 753 2.370 -14.424 11.001 317 HG22 THR 753 HG22 THR 753 1.166 -15.183 9.958 318 HG23 THR 753 HG23 THR 753 2.807 -15.815 10.014 319 H PHE 754 HN PHE 754 -1.760 -16.505 12.322 320 HA PHE 754 HA PHE 754 -1.610 -18.448 14.550 321 HB2 PHE 754 HB2 PHE 754 -3.987 -18.692 14.396 322 HB3 PHE 754 HB1 PHE 754 -3.638 -16.959 14.382 323 HD1 PHE 754 HD1 PHE 754 -3.679 -15.815 12.119 324 HD2 PHE 754 HD2 PHE 754 -5.238 -19.700 12.733 325 HE1 PHE 754 HE1 PHE 754 -4.961 -15.603 10.073 326 HE2 PHE 754 HE2 PHE 754 -6.548 -19.512 10.670 327 HZ PHE 754 HZ PHE 754 -6.419 -17.460 9.323 328 H THR 755 HN THR 755 -1.559 -18.218 11.196 329 HA THR 755 HA THR 755 -2.760 -20.573 10.335 330 HB THR 755 HB THR 755 -1.239 -20.161 8.284 331 HG1 THR 755 HG1 THR 755 -0.916 -17.548 9.224 332 HG21 THR 755 HG21 THR 755 -3.028 -18.048 9.363 333 HG22 THR 755 HG22 THR 755 -3.586 -19.497 8.497 334 HG23 THR 755 HG23 THR 755 -2.622 -18.253 7.659 335 H ASN 756 HN ASN 756 0.118 -20.325 11.980 336 HA ASN 756 HA ASN 756 1.439 -22.610 10.766 337 HB2 ASN 756 HB2 ASN 756 3.130 -22.132 12.660 338 HB3 ASN 756 HB1 ASN 756 2.920 -20.889 11.412 339 HD21 ASN 756 HD21 ASN 756 1.769 -19.106 11.916 340 HD22 ASN 756 HD22 ASN 756 1.557 -18.648 13.588 341 H ILE 757 HN ILE 757 -0.406 -21.867 13.458 342 HA ILE 757 HA ILE 757 -0.213 -24.680 14.278 343 HB ILE 757 HB ILE 757 -0.963 -24.003 16.577 344 HG12 ILE 757 HG12 ILE 757 -0.199 -21.542 17.146 345 HG13 ILE 757 HG11 ILE 757 -0.514 -21.256 15.438 346 HG21 ILE 757 HG21 ILE 757 1.318 -24.632 16.151 347 HG22 ILE 757 HG22 ILE 757 1.287 -23.304 17.313 348 HG23 ILE 757 HG23 ILE 757 1.703 -22.993 15.628 349 HD11 ILE 757 HD11 ILE 757 -2.456 -22.243 17.497 350 HD12 ILE 757 HD12 ILE 757 -2.775 -22.112 15.778 351 HD13 ILE 757 HD13 ILE 757 -2.451 -20.642 16.726 352 H THR 758 HN THR 758 -2.358 -22.162 13.417 353 HA THR 758 HA THR 758 -4.586 -23.980 13.794 354 HB THR 758 HB THR 758 -4.585 -21.223 12.721 355 HG1 THR 758 HG1 THR 758 -4.730 -22.288 15.356 356 HG21 THR 758 HG21 THR 758 -6.810 -22.935 13.837 357 HG22 THR 758 HG22 THR 758 -6.569 -22.476 12.151 358 HG23 THR 758 HG23 THR 758 -7.002 -21.252 13.345 359 H TYR 759 HN TYR 759 -3.812 -25.292 12.331 360 HA TYR 759 HA TYR 759 -3.544 -24.539 9.522 361 HB2 TYR 759 HB2 TYR 759 -3.293 -27.330 9.624 362 HB3 TYR 759 HB1 TYR 759 -1.978 -26.162 9.581 363 HD1 TYR 759 HD1 TYR 759 -4.081 -28.246 11.875 364 HD2 TYR 759 HD2 TYR 759 -0.581 -25.816 11.514 365 HE1 TYR 759 HE1 TYR 759 -3.408 -28.956 14.006 366 HE2 TYR 759 HE2 TYR 759 0.137 -26.552 13.721 367 HH TYR 759 HH TYR 759 -1.354 -29.148 15.393 368 H ARG 760 HN ARG 760 -5.284 -27.174 11.151 369 HA ARG 760 HA ARG 760 -7.565 -26.592 9.425 370 HB2 ARG 760 HB2 ARG 760 -8.017 -29.050 9.294 371 HB3 ARG 760 HB1 ARG 760 -6.497 -28.504 8.569 372 HG2 ARG 760 HG2 ARG 760 -6.364 -29.464 11.343 373 HG3 ARG 760 HG1 ARG 760 -6.667 -30.670 10.100 374 HD2 ARG 760 HD2 ARG 760 -4.367 -28.719 10.183 375 HD3 ARG 760 HD1 ARG 760 -4.273 -30.443 10.535 376 HE ARG 760 HE ARG 760 -5.228 -29.661 7.879 377 HH11 ARG 760 HH11 ARG 760 -2.487 -30.859 9.835 378 HH12 ARG 760 HH12 ARG 760 -1.694 -31.508 8.489 379 HH21 ARG 760 HH21 ARG 760 -4.096 -30.500 6.121 380 HH22 ARG 760 HH22 ARG 760 -2.577 -31.297 6.311 381 H GLY 761 HN GLY 761 -6.360 -27.495 12.523 382 HA2 GLY 761 HA2 GLY 761 -7.735 -26.674 14.351 383 HA3 GLY 761 HA1 GLY 761 -9.099 -27.538 13.603 384 H THR 762 HN THR 762 -5.724 -28.198 14.470 385 HA THR 762 HA THR 762 -6.634 -30.727 15.600 386 HB THR 762 HB THR 762 -3.864 -30.147 14.545 387 HG1 THR 762 HG1 THR 762 -6.162 -31.165 13.182 388 HG21 THR 762 HG21 THR 762 -5.406 -32.711 14.990 389 HG22 THR 762 HG22 THR 762 -4.114 -32.084 16.028 390 HG23 THR 762 HG23 THR 762 -3.760 -32.576 14.364 Start of MODEL 2 1 H LYS 716 HT1 LYS 716 0.343 0.224 -1.870 2 HA LYS 716 HA LYS 716 2.610 0.391 -1.073 3 HB2 LYS 716 HB2 LYS 716 0.848 1.416 0.290 4 HB3 LYS 716 HB1 LYS 716 0.594 -0.109 1.128 5 HG2 LYS 716 HG2 LYS 716 2.759 0.022 2.149 6 HG3 LYS 716 HG1 LYS 716 3.179 1.442 1.189 7 HD2 LYS 716 HD2 LYS 716 2.567 2.081 3.471 8 HD3 LYS 716 HD1 LYS 716 1.400 2.712 2.311 9 HE2 LYS 716 HE2 LYS 716 -0.154 0.929 2.864 10 HE3 LYS 716 HE1 LYS 716 1.035 0.192 3.936 11 HZ1 LYS 716 HZ1 LYS 716 -0.134 2.892 4.297 12 HZ2 LYS 716 HZ2 LYS 716 0.931 2.117 5.348 13 HZ3 LYS 716 HZ3 LYS 716 -0.635 1.519 5.152 14 H LEU 717 HN LEU 717 1.027 -2.477 0.450 15 HA LEU 717 HA LEU 717 3.636 -3.452 1.029 16 HB2 LEU 717 HB2 LEU 717 0.898 -4.506 1.772 17 HB3 LEU 717 HB1 LEU 717 2.440 -5.082 2.373 18 HG LEU 717 HG LEU 717 1.516 -3.896 4.073 19 HD11 LEU 717 HD11 LEU 717 3.814 -3.277 3.788 20 HD12 LEU 717 HD12 LEU 717 2.904 -1.899 4.409 21 HD13 LEU 717 HD13 LEU 717 3.357 -1.964 2.703 22 HD21 LEU 717 HD21 LEU 717 -0.325 -2.834 2.941 23 HD22 LEU 717 HD22 LEU 717 0.770 -1.696 2.160 24 HD23 LEU 717 HD23 LEU 717 0.534 -1.635 3.908 25 H LEU 718 HN LEU 718 0.748 -5.374 0.211 26 HA LEU 718 HA LEU 718 1.846 -5.992 -2.423 27 HB2 LEU 718 HB2 LEU 718 0.850 -8.049 -0.437 28 HB3 LEU 718 HB1 LEU 718 1.121 -8.359 -2.120 29 HG LEU 718 HG LEU 718 3.291 -7.577 -0.171 30 HD11 LEU 718 HD11 LEU 718 4.035 -9.899 -0.393 31 HD12 LEU 718 HD12 LEU 718 2.628 -10.253 -1.394 32 HD13 LEU 718 HD13 LEU 718 2.414 -9.799 0.297 33 HD21 LEU 718 HD21 LEU 718 3.772 -6.853 -2.446 34 HD22 LEU 718 HD22 LEU 718 3.415 -8.473 -3.050 35 HD23 LEU 718 HD23 LEU 718 4.809 -8.213 -2.002 36 H ILE 719 HN ILE 719 -0.880 -6.259 -0.165 37 HA ILE 719 HA ILE 719 -2.706 -5.985 -2.465 38 HB ILE 719 HB ILE 719 -3.926 -6.808 0.043 39 HG12 ILE 719 HG12 ILE 719 -1.976 -8.742 -1.249 40 HG13 ILE 719 HG11 ILE 719 -1.707 -7.941 0.294 41 HG21 ILE 719 HG21 ILE 719 -5.035 -6.854 -2.133 42 HG22 ILE 719 HG22 ILE 719 -4.954 -8.476 -1.448 43 HG23 ILE 719 HG23 ILE 719 -3.842 -8.007 -2.733 44 HD11 ILE 719 HD11 ILE 719 -2.481 -10.226 0.574 45 HD12 ILE 719 HD12 ILE 719 -3.951 -9.844 -0.327 46 HD13 ILE 719 HD13 ILE 719 -3.635 -9.068 1.228 47 H THR 720 HN THR 720 -1.784 -4.844 0.647 48 HA THR 720 HA THR 720 -2.193 -2.970 1.797 49 HB THR 720 HB THR 720 -3.203 -1.730 -0.783 50 HG1 THR 720 HG1 THR 720 -1.323 -2.469 -1.439 51 HG21 THR 720 HG21 THR 720 -1.653 -0.605 1.575 52 HG22 THR 720 HG22 THR 720 -3.373 -0.353 1.281 53 HG23 THR 720 HG23 THR 720 -2.179 0.307 0.158 54 H ILE 721 HN ILE 721 -4.202 -4.950 1.747 55 HA ILE 721 HA ILE 721 -6.560 -3.296 2.331 56 HB ILE 721 HB ILE 721 -8.035 -5.159 1.547 57 HG12 ILE 721 HG12 ILE 721 -5.604 -6.105 0.047 58 HG13 ILE 721 HG11 ILE 721 -6.152 -6.938 1.488 59 HG21 ILE 721 HG21 ILE 721 -7.915 -4.562 -0.850 60 HG22 ILE 721 HG22 ILE 721 -6.339 -3.818 -0.562 61 HG23 ILE 721 HG23 ILE 721 -7.782 -3.152 0.204 62 HD11 ILE 721 HD11 ILE 721 -7.639 -6.599 -1.124 63 HD12 ILE 721 HD12 ILE 721 -8.312 -7.369 0.313 64 HD13 ILE 721 HD13 ILE 721 -6.921 -8.084 -0.499 65 H HIS 722 HN HIS 722 -5.048 -6.411 2.796 66 HA HIS 722 HA HIS 722 -6.307 -6.407 5.460 67 HB2 HIS 722 HB2 HIS 722 -6.004 -8.554 3.512 68 HB3 HIS 722 HB1 HIS 722 -5.424 -9.002 5.114 69 HD1 HIS 722 HD1 HIS 722 -8.344 -9.165 3.151 70 HD2 HIS 722 HD2 HIS 722 -7.498 -8.200 7.065 71 HE1 HIS 722 HE1 HIS 722 -10.524 -9.442 4.365 72 HE2 HIS 722 HE2 HIS 722 -10.043 -8.731 6.735 73 H ASP 723 HN ASP 723 -3.649 -5.790 3.873 74 HA ASP 723 HA ASP 723 -1.570 -7.114 5.088 75 HB2 ASP 723 HB2 ASP 723 -1.534 -4.286 4.013 76 HB3 ASP 723 HB1 ASP 723 -0.193 -5.419 4.096 77 H ARG 724 HN ARG 724 -3.475 -4.368 6.133 78 HA ARG 724 HA ARG 724 -1.807 -4.060 8.519 79 HB2 ARG 724 HB2 ARG 724 -2.793 -2.296 6.699 80 HB3 ARG 724 HB1 ARG 724 -4.081 -2.324 7.856 81 HG2 ARG 724 HG2 ARG 724 -1.209 -1.724 8.527 82 HG3 ARG 724 HG1 ARG 724 -2.532 -0.592 8.156 83 HD2 ARG 724 HD2 ARG 724 -3.792 -1.451 10.100 84 HD3 ARG 724 HD1 ARG 724 -2.438 -2.541 10.439 85 HE ARG 724 HE ARG 724 -1.305 -0.086 10.407 86 HH11 ARG 724 HH11 ARG 724 -4.038 -1.464 12.226 87 HH12 ARG 724 HH12 ARG 724 -3.780 -0.544 13.623 88 HH21 ARG 724 HH21 ARG 724 -0.943 1.228 12.352 89 HH22 ARG 724 HH22 ARG 724 -1.978 1.026 13.701 90 H LYS 725 HN LYS 725 -4.706 -5.505 7.339 91 HA LYS 725 HA LYS 725 -6.276 -4.774 9.680 92 HB2 LYS 725 HB2 LYS 725 -6.978 -6.033 7.053 93 HB3 LYS 725 HB1 LYS 725 -8.073 -6.152 8.413 94 HG2 LYS 725 HG2 LYS 725 -8.667 -4.287 6.919 95 HG3 LYS 725 HG1 LYS 725 -8.264 -3.729 8.539 96 HD2 LYS 725 HD2 LYS 725 -6.060 -3.039 7.777 97 HD3 LYS 725 HD1 LYS 725 -6.389 -3.700 6.171 98 HE2 LYS 725 HE2 LYS 725 -6.671 -1.280 6.166 99 HE3 LYS 725 HE1 LYS 725 -8.219 -2.081 5.898 100 HZ1 LYS 725 HZ1 LYS 725 -7.294 -1.010 8.514 101 HZ2 LYS 725 HZ2 LYS 725 -8.849 -1.623 8.164 102 HZ3 LYS 725 HZ3 LYS 725 -8.310 -0.200 7.449 103 H GLU 726 HN GLU 726 -4.427 -7.389 8.592 104 HA GLU 726 HA GLU 726 -5.761 -9.306 10.226 105 HB2 GLU 726 HB2 GLU 726 -3.754 -10.709 9.774 106 HB3 GLU 726 HB1 GLU 726 -4.691 -10.092 8.409 107 HG2 GLU 726 HG2 GLU 726 -2.952 -8.300 8.162 108 HG3 GLU 726 HG1 GLU 726 -1.990 -9.216 9.327 109 H PHE 727 HN PHE 727 -3.886 -6.831 10.827 110 HA PHE 727 HA PHE 727 -2.920 -7.878 13.407 111 HB2 PHE 727 HB2 PHE 727 -2.620 -5.085 12.354 112 HB3 PHE 727 HB1 PHE 727 -1.722 -5.858 13.652 113 HD1 PHE 727 HD2 PHE 727 -0.870 -8.362 12.587 114 HD2 PHE 727 HD1 PHE 727 -1.230 -4.617 10.641 115 HE1 PHE 727 HE2 PHE 727 0.808 -9.062 10.943 116 HE2 PHE 727 HE1 PHE 727 0.414 -5.279 9.014 117 HZ PHE 727 HZ PHE 727 1.460 -7.526 9.147 118 H ALA 728 HN ALA 728 -5.652 -7.051 12.380 119 HA ALA 728 HA ALA 728 -6.459 -5.523 14.772 120 HB1 ALA 728 HB1 ALA 728 -8.412 -4.737 13.546 121 HB2 ALA 728 HB2 ALA 728 -7.925 -5.682 12.139 122 HB3 ALA 728 HB3 ALA 728 -6.930 -4.329 12.682 123 H LYS 729 HN LYS 729 -7.450 -8.153 12.608 124 HA LYS 729 HA LYS 729 -9.189 -9.153 14.750 125 HB2 LYS 729 HB2 LYS 729 -9.128 -10.061 11.851 126 HB3 LYS 729 HB1 LYS 729 -10.298 -10.542 13.065 127 HG2 LYS 729 HG2 LYS 729 -11.439 -8.973 11.725 128 HG3 LYS 729 HG1 LYS 729 -10.958 -8.049 13.150 129 HD2 LYS 729 HD2 LYS 729 -9.076 -7.098 11.941 130 HD3 LYS 729 HD1 LYS 729 -9.426 -8.113 10.541 131 HE2 LYS 729 HE2 LYS 729 -11.248 -5.995 11.667 132 HE3 LYS 729 HE1 LYS 729 -10.179 -5.792 10.274 133 HZ1 LYS 729 HZ1 LYS 729 -12.509 -7.639 10.481 134 HZ2 LYS 729 HZ2 LYS 729 -11.416 -7.650 9.200 135 HZ3 LYS 729 HZ3 LYS 729 -12.368 -6.301 9.458 136 H PHE 730 HN PHE 730 -6.374 -9.882 12.794 137 HA PHE 730 HA PHE 730 -4.675 -11.302 13.014 138 HB2 PHE 730 HB2 PHE 730 -5.804 -12.197 15.663 139 HB3 PHE 730 HB1 PHE 730 -4.143 -12.222 15.044 140 HD1 PHE 730 HD1 PHE 730 -2.811 -10.258 15.045 141 HD2 PHE 730 HD2 PHE 730 -6.776 -10.201 16.463 142 HE1 PHE 730 HE1 PHE 730 -2.395 -8.093 16.084 143 HE2 PHE 730 HE2 PHE 730 -6.438 -8.089 17.488 144 HZ PHE 730 HZ PHE 730 -4.204 -6.966 17.335 145 H GLU 731 HN GLU 731 -7.349 -12.110 12.098 146 HA GLU 731 HA GLU 731 -6.980 -15.032 12.346 147 HB2 GLU 731 HB2 GLU 731 -9.548 -13.531 12.008 148 HB3 GLU 731 HB1 GLU 731 -9.389 -15.286 11.976 149 HG2 GLU 731 HG2 GLU 731 -8.381 -15.128 14.235 150 HG3 GLU 731 HG1 GLU 731 -8.823 -13.431 14.249 151 H GLU 732 HN GLU 732 -7.097 -12.468 10.227 152 HA GLU 732 HA GLU 732 -7.816 -14.092 7.963 153 HB2 GLU 732 HB2 GLU 732 -7.216 -11.912 6.656 154 HB3 GLU 732 HB1 GLU 732 -8.685 -11.983 7.607 155 HG2 GLU 732 HG2 GLU 732 -6.133 -10.775 8.702 156 HG3 GLU 732 HG1 GLU 732 -7.312 -9.848 7.772 157 H GLU 733 HN GLU 733 -4.949 -11.811 7.953 158 HA GLU 733 HA GLU 733 -2.947 -12.051 7.212 159 HB2 GLU 733 HB2 GLU 733 -3.233 -14.738 8.352 160 HB3 GLU 733 HB1 GLU 733 -1.726 -13.980 7.825 161 HG2 GLU 733 HG2 GLU 733 -1.932 -12.226 9.464 162 HG3 GLU 733 HG1 GLU 733 -3.466 -12.870 10.044 163 H ARG 734 HN ARG 734 -3.456 -11.827 5.339 164 HA ARG 734 HA ARG 734 -3.989 -13.964 3.450 165 HB2 ARG 734 HB2 ARG 734 -2.967 -11.221 2.735 166 HB3 ARG 734 HB1 ARG 734 -3.846 -12.342 1.703 167 HG2 ARG 734 HG2 ARG 734 -4.925 -10.921 4.121 168 HG3 ARG 734 HG1 ARG 734 -5.286 -10.550 2.436 169 HD2 ARG 734 HD2 ARG 734 -5.808 -13.218 3.686 170 HD3 ARG 734 HD1 ARG 734 -6.988 -11.907 3.705 171 HE ARG 734 HE ARG 734 -6.266 -12.174 1.071 172 HH11 ARG 734 HH11 ARG 734 -7.605 -14.391 3.493 173 HH12 ARG 734 HH12 ARG 734 -8.476 -15.339 2.386 174 HH21 ARG 734 HH21 ARG 734 -7.444 -13.491 -0.493 175 HH22 ARG 734 HH22 ARG 734 -8.383 -14.792 0.042 176 H ALA 735 HN ALA 735 -1.191 -12.048 4.304 177 HA ALA 735 HA ALA 735 0.462 -14.107 3.031 178 HB1 ALA 735 HB1 ALA 735 0.695 -11.953 1.910 179 HB2 ALA 735 HB2 ALA 735 2.194 -12.410 2.726 180 HB3 ALA 735 HB3 ALA 735 1.132 -11.198 3.443 181 H ARG 736 HN ARG 736 -0.739 -13.327 5.871 182 HA ARG 736 HA ARG 736 -0.284 -13.703 7.973 183 HB2 ARG 736 HB2 ARG 736 1.972 -15.450 6.940 184 HB3 ARG 736 HB1 ARG 736 1.275 -15.334 8.561 185 HG2 ARG 736 HG2 ARG 736 0.346 -17.313 7.573 186 HG3 ARG 736 HG1 ARG 736 -0.923 -16.094 7.606 187 HD2 ARG 736 HD2 ARG 736 -0.892 -17.321 5.469 188 HD3 ARG 736 HD1 ARG 736 -0.536 -15.611 5.233 189 HE ARG 736 HE ARG 736 1.895 -16.950 5.540 190 HH11 ARG 736 HH11 ARG 736 -0.783 -16.860 3.178 191 HH12 ARG 736 HH12 ARG 736 0.185 -17.243 1.840 192 HH21 ARG 736 HH21 ARG 736 3.232 -17.502 3.670 193 HH22 ARG 736 HH22 ARG 736 2.514 -17.651 2.132 194 H ALA 737 HN ALA 737 0.294 -11.411 8.033 195 HA ALA 737 HA ALA 737 1.598 -9.656 8.791 196 HB1 ALA 737 HB1 ALA 737 3.040 -11.864 10.248 197 HB2 ALA 737 HB2 ALA 737 1.562 -11.062 10.789 198 HB3 ALA 737 HB3 ALA 737 3.069 -10.151 10.663 199 H LYS 738 HN LYS 738 2.448 -11.104 6.515 200 HA LYS 738 HA LYS 738 5.214 -11.416 6.087 201 HB2 LYS 738 HB2 LYS 738 3.498 -12.076 4.457 202 HB3 LYS 738 HB1 LYS 738 3.221 -10.388 4.073 203 HG2 LYS 738 HG2 LYS 738 4.562 -11.281 2.365 204 HG3 LYS 738 HG1 LYS 738 5.620 -10.271 3.355 205 HD2 LYS 738 HD2 LYS 738 6.434 -12.247 4.505 206 HD3 LYS 738 HD1 LYS 738 5.355 -13.261 3.545 207 HE2 LYS 738 HE2 LYS 738 7.473 -13.401 2.517 208 HE3 LYS 738 HE1 LYS 738 6.465 -12.323 1.537 209 HZ1 LYS 738 HZ1 LYS 738 7.585 -10.420 2.762 210 HZ2 LYS 738 HZ2 LYS 738 8.493 -11.303 1.687 211 HZ3 LYS 738 HZ3 LYS 738 8.724 -11.571 3.315 212 H TRP 739 HN TRP 739 3.374 -8.641 5.019 213 HA TRP 739 HA TRP 739 5.631 -6.982 4.555 214 HB2 TRP 739 HB2 TRP 739 3.129 -5.563 4.986 215 HB3 TRP 739 HB1 TRP 739 4.146 -5.645 3.555 216 HD1 TRP 739 HD1 TRP 739 3.191 -6.958 1.588 217 HE1 TRP 739 HE1 TRP 739 1.113 -8.508 1.223 218 HE3 TRP 739 HE3 TRP 739 1.572 -7.381 6.339 219 HZ2 TRP 739 HZ2 TRP 739 -0.909 -9.691 2.713 220 HZ3 TRP 739 HZ3 TRP 739 -0.446 -8.719 6.793 221 HH2 TRP 739 HH2 TRP 739 -1.657 -9.844 4.959 222 H ASP 740 HN ASP 740 3.185 -7.196 7.043 223 HA ASP 740 HA ASP 740 2.880 -6.274 9.111 224 HB2 ASP 740 HB2 ASP 740 5.178 -7.194 9.567 225 HB3 ASP 740 HB1 ASP 740 5.817 -5.649 9.045 226 H THR 741 HN THR 741 1.767 -4.553 9.249 227 HA THR 741 HA THR 741 2.914 -2.029 8.337 228 HB THR 741 HB THR 741 -0.015 -2.580 8.039 229 HG1 THR 741 HG1 THR 741 0.529 -4.173 6.693 230 HG21 THR 741 HG21 THR 741 0.911 -0.369 7.735 231 HG22 THR 741 HG22 THR 741 0.254 -0.996 6.202 232 HG23 THR 741 HG23 THR 741 2.009 -0.983 6.503 233 H ALA 742 HN ALA 742 2.582 -3.314 10.984 234 HA ALA 742 HA ALA 742 1.305 -1.102 12.395 235 HB1 ALA 742 HB1 ALA 742 -0.386 -2.375 13.572 236 HB2 ALA 742 HB2 ALA 742 0.085 -3.839 12.708 237 HB3 ALA 742 HB3 ALA 742 -0.631 -2.489 11.831 238 H ASN 743 HN ASN 743 3.290 -3.929 12.485 239 HA ASN 743 HA ASN 743 3.459 -3.837 15.372 240 HB2 ASN 743 HB2 ASN 743 4.798 -5.823 13.535 241 HB3 ASN 743 HB1 ASN 743 4.435 -5.999 15.239 242 HD21 ASN 743 HD21 ASN 743 3.117 -5.826 12.085 243 HD22 ASN 743 HD22 ASN 743 1.679 -6.728 12.338 244 H ASN 744 HN ASN 744 5.877 -4.567 12.865 245 HA ASN 744 HA ASN 744 7.519 -2.403 13.892 246 HB2 ASN 744 HB2 ASN 744 9.539 -3.897 13.825 247 HB3 ASN 744 HB1 ASN 744 8.366 -4.472 14.992 248 HD21 ASN 744 HD21 ASN 744 8.328 -4.932 11.483 249 HD22 ASN 744 HD22 ASN 744 8.425 -6.638 11.548 250 HA PRO 745 HA PRO 745 8.637 -1.317 9.690 251 HB2 PRO 745 HB2 PRO 745 11.215 -2.044 9.101 252 HB3 PRO 745 HB1 PRO 745 10.806 -0.670 10.137 253 HG2 PRO 745 HG2 PRO 745 11.606 -3.460 10.967 254 HG3 PRO 745 HG1 PRO 745 12.117 -1.936 11.621 255 HD2 PRO 745 HD2 PRO 745 10.305 -3.373 12.818 256 HD3 PRO 745 HD1 PRO 745 10.210 -1.610 12.801 257 H LEU 746 HN LEU 746 10.520 -4.298 9.844 258 HA LEU 746 HA LEU 746 9.103 -5.304 7.507 259 HB2 LEU 746 HB2 LEU 746 11.052 -6.960 7.517 260 HB3 LEU 746 HB1 LEU 746 11.372 -5.311 7.000 261 HG LEU 746 HG LEU 746 11.887 -5.722 9.863 262 HD11 LEU 746 HD11 LEU 746 13.525 -7.252 7.860 263 HD12 LEU 746 HD12 LEU 746 12.483 -7.944 9.106 264 HD13 LEU 746 HD13 LEU 746 13.914 -7.021 9.565 265 HD21 LEU 746 HD21 LEU 746 12.550 -3.758 8.628 266 HD22 LEU 746 HD22 LEU 746 13.613 -4.741 7.602 267 HD23 LEU 746 HD23 LEU 746 13.917 -4.601 9.343 268 H PTR 747 HN PTR 747 10.866 -7.063 10.034 269 HA PTR 747 HA PTR 747 8.905 -7.808 11.676 270 HB2 PTR 747 HB2 PTR 747 8.260 -10.016 11.030 271 HB3 PTR 747 HB1 PTR 747 7.687 -8.854 9.877 272 HD1 PTR 747 HD1 PTR 747 8.958 -8.604 7.644 273 HD2 PTR 747 HD2 PTR 747 9.594 -11.920 10.228 274 HE1 PTR 747 HE1 PTR 747 9.937 -9.858 5.785 275 HE2 PTR 747 HE2 PTR 747 10.586 -13.181 8.368 276 H LYS 748 HN LYS 748 10.535 -7.664 13.113 277 HA LYS 748 HA LYS 748 12.336 -9.964 13.094 278 HB2 LYS 748 HB2 LYS 748 14.188 -8.706 13.833 279 HB3 LYS 748 HB1 LYS 748 13.553 -7.861 12.433 280 HG2 LYS 748 HG2 LYS 748 12.952 -7.080 15.279 281 HG3 LYS 748 HG1 LYS 748 14.301 -6.387 14.360 282 HD2 LYS 748 HD2 LYS 748 12.608 -5.603 12.697 283 HD3 LYS 748 HD1 LYS 748 11.347 -6.203 13.774 284 HE2 LYS 748 HE2 LYS 748 11.658 -3.820 14.101 285 HE3 LYS 748 HE1 LYS 748 12.147 -4.709 15.540 286 HZ1 LYS 748 HZ1 LYS 748 14.031 -3.716 13.460 287 HZ2 LYS 748 HZ2 LYS 748 14.450 -4.419 14.942 288 HZ3 LYS 748 HZ3 LYS 748 13.701 -2.920 14.910 289 H GLU 749 HN GLU 749 10.413 -7.716 14.955 290 HA GLU 749 HA GLU 749 11.000 -9.273 17.360 291 HB2 GLU 749 HB2 GLU 749 10.223 -7.328 18.640 292 HB3 GLU 749 HB1 GLU 749 11.560 -6.928 17.572 293 HG2 GLU 749 HG2 GLU 749 10.022 -5.919 15.989 294 HG3 GLU 749 HG1 GLU 749 8.665 -6.352 17.025 295 H ALA 750 HN ALA 750 8.514 -8.124 15.209 296 HA ALA 750 HA ALA 750 6.637 -9.826 16.609 297 HB1 ALA 750 HB1 ALA 750 6.043 -7.075 15.536 298 HB2 ALA 750 HB2 ALA 750 6.184 -7.510 17.240 299 HB3 ALA 750 HB3 ALA 750 4.882 -8.188 16.260 300 H THR 751 HN THR 751 6.075 -11.327 15.282 301 HA THR 751 HA THR 751 5.138 -10.634 12.613 302 HB THR 751 HB THR 751 6.812 -13.112 12.973 303 HG1 THR 751 HG1 THR 751 7.583 -10.454 12.564 304 HG21 THR 751 HG21 THR 751 6.182 -11.356 10.594 305 HG22 THR 751 HG22 THR 751 5.406 -12.897 10.968 306 HG23 THR 751 HG23 THR 751 7.120 -12.848 10.542 307 H SER 752 HN SER 752 3.404 -12.071 11.964 308 HA SER 752 HA SER 752 2.574 -13.784 14.176 309 HB2 SER 752 HB2 SER 752 1.247 -11.735 14.220 310 HB3 SER 752 HB1 SER 752 0.794 -11.985 12.528 311 HG SER 752 HG SER 752 -0.555 -13.459 13.094 312 H THR 753 HN THR 753 1.723 -15.673 13.750 313 HA THR 753 HA THR 753 0.535 -16.309 11.248 314 HB THR 753 HB THR 753 1.817 -18.492 11.316 315 HG1 THR 753 HG1 THR 753 3.868 -16.735 12.277 316 HG21 THR 753 HG21 THR 753 3.104 -16.005 10.188 317 HG22 THR 753 HG22 THR 753 1.898 -17.025 9.404 318 HG23 THR 753 HG23 THR 753 3.520 -17.649 9.702 319 H PHE 754 HN PHE 754 -0.994 -17.737 11.607 320 HA PHE 754 HA PHE 754 -1.096 -19.026 14.262 321 HB2 PHE 754 HB2 PHE 754 -3.607 -19.016 13.975 322 HB3 PHE 754 HB1 PHE 754 -2.823 -17.437 14.095 323 HD1 PHE 754 HD2 PHE 754 -4.017 -19.853 11.535 324 HD2 PHE 754 HD1 PHE 754 -3.346 -15.803 12.586 325 HE1 PHE 754 HE2 PHE 754 -5.047 -19.164 9.462 326 HE2 PHE 754 HE1 PHE 754 -4.387 -15.090 10.521 327 HZ PHE 754 HZ PHE 754 -5.256 -16.761 8.925 328 H THR 755 HN THR 755 -1.165 -19.414 10.917 329 HA THR 755 HA THR 755 -2.629 -21.805 10.631 330 HB THR 755 HB THR 755 -2.170 -20.377 8.786 331 HG1 THR 755 HG1 THR 755 -1.507 -23.094 8.722 332 HG21 THR 755 HG21 THR 755 0.043 -19.661 9.288 333 HG22 THR 755 HG22 THR 755 0.034 -20.344 7.659 334 HG23 THR 755 HG23 THR 755 0.700 -21.277 9.014 335 H ASN 756 HN ASN 756 0.378 -21.345 11.895 336 HA ASN 756 HA ASN 756 1.647 -23.818 11.454 337 HB2 ASN 756 HB2 ASN 756 2.706 -23.432 13.820 338 HB3 ASN 756 HB1 ASN 756 3.031 -22.237 12.563 339 HD21 ASN 756 HD21 ASN 756 2.194 -20.282 12.790 340 HD22 ASN 756 HD22 ASN 756 1.467 -19.736 14.284 341 H ILE 757 HN ILE 757 -0.639 -22.956 13.802 342 HA ILE 757 HA ILE 757 -1.109 -25.824 14.238 343 HB ILE 757 HB ILE 757 -1.975 -25.313 16.498 344 HG12 ILE 757 HG12 ILE 757 -0.624 -22.661 16.022 345 HG13 ILE 757 HG11 ILE 757 -2.354 -22.929 16.205 346 HG21 ILE 757 HG21 ILE 757 0.222 -26.311 16.179 347 HG22 ILE 757 HG22 ILE 757 0.286 -25.168 17.523 348 HG23 ILE 757 HG23 ILE 757 0.938 -24.715 15.949 349 HD11 ILE 757 HD11 ILE 757 -1.364 -22.075 18.257 350 HD12 ILE 757 HD12 ILE 757 -0.264 -23.484 18.245 351 HD13 ILE 757 HD13 ILE 757 -1.997 -23.726 18.426 352 H THR 758 HN THR 758 -2.489 -22.988 13.239 353 HA THR 758 HA THR 758 -5.179 -24.060 13.506 354 HB THR 758 HB THR 758 -4.299 -21.553 12.207 355 HG1 THR 758 HG1 THR 758 -5.098 -22.143 14.887 356 HG21 THR 758 HG21 THR 758 -6.553 -22.211 11.602 357 HG22 THR 758 HG22 THR 758 -6.660 -20.800 12.659 358 HG23 THR 758 HG23 THR 758 -6.992 -22.407 13.300 359 H TYR 759 HN TYR 759 -4.695 -25.709 12.187 360 HA TYR 759 HA TYR 759 -4.347 -25.094 9.326 361 HB2 TYR 759 HB2 TYR 759 -3.632 -27.651 9.203 362 HB3 TYR 759 HB1 TYR 759 -2.497 -26.410 9.709 363 HD1 TYR 759 HD1 TYR 759 -4.562 -29.213 10.829 364 HD2 TYR 759 HD2 TYR 759 -1.684 -26.334 11.992 365 HE1 TYR 759 HE1 TYR 759 -4.188 -30.441 12.914 366 HE2 TYR 759 HE2 TYR 759 -1.297 -27.561 14.104 367 HH TYR 759 HH TYR 759 -2.401 -29.095 15.504 368 H ARG 760 HN ARG 760 -5.823 -27.731 11.175 369 HA ARG 760 HA ARG 760 -8.155 -27.486 9.408 370 HB2 ARG 760 HB2 ARG 760 -8.302 -29.765 9.024 371 HB3 ARG 760 HB1 ARG 760 -6.655 -29.235 8.691 372 HG2 ARG 760 HG2 ARG 760 -6.101 -30.072 11.024 373 HG3 ARG 760 HG1 ARG 760 -7.676 -30.842 10.961 374 HD2 ARG 760 HD2 ARG 760 -7.133 -31.918 8.957 375 HD3 ARG 760 HD1 ARG 760 -5.567 -31.089 8.966 376 HE ARG 760 HE ARG 760 -6.374 -33.053 11.016 377 HH11 ARG 760 HH11 ARG 760 -3.879 -31.584 8.955 378 HH12 ARG 760 HH12 ARG 760 -2.618 -32.591 9.476 379 HH21 ARG 760 HH21 ARG 760 -4.631 -34.476 11.744 380 HH22 ARG 760 HH22 ARG 760 -3.047 -34.278 11.120 381 H GLY 761 HN GLY 761 -6.914 -27.996 12.552 382 HA2 GLY 761 HA2 GLY 761 -8.100 -27.793 14.462 383 HA3 GLY 761 HA1 GLY 761 -9.607 -28.167 13.603 384 H THR 762 HN THR 762 -6.716 -29.430 15.056 385 HA THR 762 HA THR 762 -7.655 -32.141 14.799 386 HB THR 762 HB THR 762 -5.517 -32.484 16.311 387 HG1 THR 762 HG1 THR 762 -4.015 -30.682 15.528 388 HG21 THR 762 HG21 THR 762 -4.132 -32.504 14.248 389 HG22 THR 762 HG22 THR 762 -5.449 -31.667 13.401 390 HG23 THR 762 HG23 THR 762 -5.697 -33.283 14.040 Start of MODEL 3 1 H LYS 716 HT1 LYS 716 -0.428 1.474 1.843 2 HA LYS 716 HA LYS 716 1.539 1.910 0.607 3 HB2 LYS 716 HB2 LYS 716 2.915 2.820 2.454 4 HB3 LYS 716 HB1 LYS 716 1.209 3.141 2.692 5 HG2 LYS 716 HG2 LYS 716 1.133 1.205 4.249 6 HG3 LYS 716 HG1 LYS 716 2.879 1.059 4.073 7 HD2 LYS 716 HD2 LYS 716 1.480 3.560 5.069 8 HD3 LYS 716 HD1 LYS 716 2.133 2.316 6.128 9 HE2 LYS 716 HE2 LYS 716 3.812 3.987 6.055 10 HE3 LYS 716 HE1 LYS 716 4.382 2.731 4.965 11 HZ1 LYS 716 HZ1 LYS 716 4.617 5.043 4.147 12 HZ2 LYS 716 HZ2 LYS 716 2.942 5.179 4.049 13 HZ3 LYS 716 HZ3 LYS 716 3.755 4.081 3.064 14 H LEU 717 HN LEU 717 1.761 -1.043 2.541 15 HA LEU 717 HA LEU 717 4.421 -1.507 1.711 16 HB2 LEU 717 HB2 LEU 717 2.337 -3.151 3.112 17 HB3 LEU 717 HB1 LEU 717 3.878 -3.812 2.614 18 HG LEU 717 HG LEU 717 3.954 -3.313 4.893 19 HD11 LEU 717 HD11 LEU 717 6.011 -2.896 3.692 20 HD12 LEU 717 HD12 LEU 717 5.867 -1.740 5.015 21 HD13 LEU 717 HD13 LEU 717 5.514 -1.238 3.361 22 HD21 LEU 717 HD21 LEU 717 3.683 -1.047 5.831 23 HD22 LEU 717 HD22 LEU 717 2.206 -1.678 5.105 24 HD23 LEU 717 HD23 LEU 717 3.171 -0.485 4.239 25 H LEU 718 HN LEU 718 1.490 -3.520 1.161 26 HA LEU 718 HA LEU 718 2.265 -3.745 -1.660 27 HB2 LEU 718 HB2 LEU 718 1.747 -6.109 0.153 28 HB3 LEU 718 HB1 LEU 718 1.795 -6.223 -1.591 29 HG LEU 718 HG LEU 718 4.095 -5.529 0.240 30 HD11 LEU 718 HD11 LEU 718 3.583 -7.895 0.259 31 HD12 LEU 718 HD12 LEU 718 5.075 -7.609 -0.626 32 HD13 LEU 718 HD13 LEU 718 3.582 -7.924 -1.504 33 HD21 LEU 718 HD21 LEU 718 4.242 -4.251 -1.838 34 HD22 LEU 718 HD22 LEU 718 4.037 -5.737 -2.770 35 HD23 LEU 718 HD23 LEU 718 5.482 -5.503 -1.785 36 H ILE 719 HN ILE 719 -0.198 -5.077 0.579 37 HA ILE 719 HA ILE 719 -2.115 -4.789 -1.600 38 HB ILE 719 HB ILE 719 -3.552 -6.359 -0.220 39 HG12 ILE 719 HG12 ILE 719 -0.994 -6.730 1.357 40 HG13 ILE 719 HG11 ILE 719 -2.430 -5.908 1.954 41 HG21 ILE 719 HG21 ILE 719 -0.861 -7.346 -1.115 42 HG22 ILE 719 HG22 ILE 719 -2.291 -7.130 -2.125 43 HG23 ILE 719 HG23 ILE 719 -2.290 -8.344 -0.845 44 HD11 ILE 719 HD11 ILE 719 -3.698 -7.977 1.743 45 HD12 ILE 719 HD12 ILE 719 -2.287 -8.180 2.783 46 HD13 ILE 719 HD13 ILE 719 -2.262 -8.795 1.128 47 H THR 720 HN THR 720 -1.695 -3.940 1.811 48 HA THR 720 HA THR 720 -2.795 -2.508 3.200 49 HB THR 720 HB THR 720 -3.954 -1.127 0.751 50 HG1 THR 720 HG1 THR 720 -1.974 -0.994 0.102 51 HG21 THR 720 HG21 THR 720 -3.589 0.904 2.102 52 HG22 THR 720 HG22 THR 720 -2.895 -0.075 3.393 53 HG23 THR 720 HG23 THR 720 -4.599 -0.253 2.969 54 H ILE 721 HN ILE 721 -4.190 -4.948 2.356 55 HA ILE 721 HA ILE 721 -6.958 -4.144 2.906 56 HB ILE 721 HB ILE 721 -7.779 -5.945 1.350 57 HG12 ILE 721 HG12 ILE 721 -4.985 -5.787 0.216 58 HG13 ILE 721 HG11 ILE 721 -5.562 -7.158 1.143 59 HG21 ILE 721 HG21 ILE 721 -7.943 -3.599 0.723 60 HG22 ILE 721 HG22 ILE 721 -7.565 -4.572 -0.699 61 HG23 ILE 721 HG23 ILE 721 -6.298 -3.631 0.088 62 HD11 ILE 721 HD11 ILE 721 -6.604 -6.202 -1.523 63 HD12 ILE 721 HD12 ILE 721 -7.258 -7.565 -0.613 64 HD13 ILE 721 HD13 ILE 721 -5.608 -7.626 -1.230 65 H HIS 722 HN HIS 722 -4.536 -6.617 3.117 66 HA HIS 722 HA HIS 722 -6.012 -7.722 5.382 67 HB2 HIS 722 HB2 HIS 722 -5.165 -9.257 2.968 68 HB3 HIS 722 HB1 HIS 722 -5.100 -9.958 4.602 69 HD1 HIS 722 HD1 HIS 722 -7.360 -9.686 1.791 70 HD2 HIS 722 HD2 HIS 722 -7.673 -9.662 5.907 71 HE1 HIS 722 HE1 HIS 722 -9.776 -10.130 2.246 72 HE2 HIS 722 HE2 HIS 722 -9.925 -10.363 4.741 73 H ASP 723 HN ASP 723 -3.857 -6.048 4.998 74 HA ASP 723 HA ASP 723 -1.539 -7.577 5.903 75 HB2 ASP 723 HB2 ASP 723 -0.265 -5.537 5.392 76 HB3 ASP 723 HB1 ASP 723 -1.210 -6.116 4.024 77 H ARG 724 HN ARG 724 -3.962 -5.414 6.929 78 HA ARG 724 HA ARG 724 -2.713 -5.122 9.562 79 HB2 ARG 724 HB2 ARG 724 -3.755 -3.284 7.878 80 HB3 ARG 724 HB1 ARG 724 -5.190 -3.774 8.696 81 HG2 ARG 724 HG2 ARG 724 -2.715 -2.708 10.047 82 HG3 ARG 724 HG1 ARG 724 -4.247 -1.907 9.615 83 HD2 ARG 724 HD2 ARG 724 -4.107 -4.298 11.430 84 HD3 ARG 724 HD1 ARG 724 -4.037 -2.662 12.071 85 HE ARG 724 HE ARG 724 -6.273 -2.691 10.476 86 HH11 ARG 724 HH11 ARG 724 -5.225 -4.552 13.354 87 HH12 ARG 724 HH12 ARG 724 -6.796 -4.844 13.911 88 HH21 ARG 724 HH21 ARG 724 -8.468 -3.074 11.289 89 HH22 ARG 724 HH22 ARG 724 -8.678 -3.988 12.711 90 H LYS 725 HN LYS 725 -5.423 -6.286 7.684 91 HA LYS 725 HA LYS 725 -7.114 -6.847 9.887 92 HB2 LYS 725 HB2 LYS 725 -7.120 -7.942 7.081 93 HB3 LYS 725 HB1 LYS 725 -8.388 -8.230 8.263 94 HG2 LYS 725 HG2 LYS 725 -7.584 -5.545 7.144 95 HG3 LYS 725 HG1 LYS 725 -9.017 -6.475 6.696 96 HD2 LYS 725 HD2 LYS 725 -9.789 -6.330 9.048 97 HD3 LYS 725 HD1 LYS 725 -8.398 -5.308 9.411 98 HE2 LYS 725 HE2 LYS 725 -10.531 -4.672 7.370 99 HE3 LYS 725 HE1 LYS 725 -10.481 -4.026 9.010 100 HZ1 LYS 725 HZ1 LYS 725 -8.438 -3.586 6.889 101 HZ2 LYS 725 HZ2 LYS 725 -8.369 -2.937 8.459 102 HZ3 LYS 725 HZ3 LYS 725 -9.570 -2.471 7.415 103 H GLU 726 HN GLU 726 -4.385 -8.480 8.614 104 HA GLU 726 HA GLU 726 -5.035 -11.077 9.439 105 HB2 GLU 726 HB2 GLU 726 -2.593 -11.469 9.261 106 HB3 GLU 726 HB1 GLU 726 -3.319 -10.667 7.871 107 HG2 GLU 726 HG2 GLU 726 -2.459 -8.538 8.605 108 HG3 GLU 726 HG1 GLU 726 -1.758 -9.295 10.032 109 H PHE 727 HN PHE 727 -4.167 -8.290 11.077 110 HA PHE 727 HA PHE 727 -3.510 -9.738 13.540 111 HB2 PHE 727 HB2 PHE 727 -3.644 -6.781 13.111 112 HB3 PHE 727 HB1 PHE 727 -2.880 -7.657 14.426 113 HD1 PHE 727 HD2 PHE 727 -1.074 -9.440 13.551 114 HD2 PHE 727 HD1 PHE 727 -2.315 -5.927 11.531 115 HE1 PHE 727 HE2 PHE 727 1.014 -9.443 12.269 116 HE2 PHE 727 HE1 PHE 727 -0.283 -5.904 10.258 117 HZ PHE 727 HZ PHE 727 1.424 -7.676 10.611 118 H ALA 728 HN ALA 728 -6.144 -9.029 12.037 119 HA ALA 728 HA ALA 728 -7.639 -8.110 14.379 120 HB1 ALA 728 HB1 ALA 728 -8.047 -6.860 12.311 121 HB2 ALA 728 HB2 ALA 728 -9.508 -7.679 12.866 122 HB3 ALA 728 HB3 ALA 728 -8.580 -8.344 11.520 123 H LYS 729 HN LYS 729 -7.987 -10.539 11.779 124 HA LYS 729 HA LYS 729 -9.425 -12.193 13.736 125 HB2 LYS 729 HB2 LYS 729 -9.462 -12.405 10.726 126 HB3 LYS 729 HB1 LYS 729 -10.343 -13.445 11.831 127 HG2 LYS 729 HG2 LYS 729 -12.033 -12.014 11.438 128 HG3 LYS 729 HG1 LYS 729 -11.211 -11.007 12.633 129 HD2 LYS 729 HD2 LYS 729 -11.564 -9.563 10.836 130 HD3 LYS 729 HD1 LYS 729 -9.895 -10.086 10.644 131 HE2 LYS 729 HE2 LYS 729 -10.733 -11.882 9.086 132 HE3 LYS 729 HE1 LYS 729 -12.306 -11.089 9.141 133 HZ1 LYS 729 HZ1 LYS 729 -11.103 -9.029 8.361 134 HZ2 LYS 729 HZ2 LYS 729 -11.175 -10.316 7.244 135 HZ3 LYS 729 HZ3 LYS 729 -9.761 -10.055 8.123 136 H PHE 730 HN PHE 730 -6.549 -12.033 11.811 137 HA PHE 730 HA PHE 730 -4.735 -13.309 11.642 138 HB2 PHE 730 HB2 PHE 730 -5.767 -14.894 14.015 139 HB3 PHE 730 HB1 PHE 730 -4.115 -14.707 13.394 140 HD1 PHE 730 HD2 PHE 730 -6.889 -12.944 14.958 141 HD2 PHE 730 HD1 PHE 730 -2.754 -12.982 14.150 142 HE1 PHE 730 HE2 PHE 730 -6.654 -11.125 16.413 143 HE2 PHE 730 HE1 PHE 730 -2.435 -11.078 15.662 144 HZ PHE 730 HZ PHE 730 -4.371 -10.117 16.832 145 H GLU 731 HN GLU 731 -6.809 -13.872 10.150 146 HA GLU 731 HA GLU 731 -6.575 -16.799 9.788 147 HB2 GLU 731 HB2 GLU 731 -9.004 -15.132 9.181 148 HB3 GLU 731 HB1 GLU 731 -8.830 -16.853 8.881 149 HG2 GLU 731 HG2 GLU 731 -8.459 -17.123 11.355 150 HG3 GLU 731 HG1 GLU 731 -8.913 -15.445 11.528 151 H GLU 732 HN GLU 732 -6.328 -13.736 8.420 152 HA GLU 732 HA GLU 732 -6.482 -14.707 5.710 153 HB2 GLU 732 HB2 GLU 732 -5.883 -12.236 5.158 154 HB3 GLU 732 HB1 GLU 732 -7.481 -12.625 5.767 155 HG2 GLU 732 HG2 GLU 732 -5.284 -11.669 7.620 156 HG3 GLU 732 HG1 GLU 732 -6.316 -10.560 6.718 157 H GLU 733 HN GLU 733 -4.006 -12.280 6.597 158 HA GLU 733 HA GLU 733 -1.879 -12.096 6.014 159 HB2 GLU 733 HB2 GLU 733 -1.800 -14.938 6.730 160 HB3 GLU 733 HB1 GLU 733 -0.442 -13.828 6.687 161 HG2 GLU 733 HG2 GLU 733 -1.467 -12.501 8.451 162 HG3 GLU 733 HG1 GLU 733 -2.751 -13.695 8.629 163 H ARG 734 HN ARG 734 -2.277 -11.841 3.956 164 HA ARG 734 HA ARG 734 -2.161 -13.919 1.974 165 HB2 ARG 734 HB2 ARG 734 -1.501 -11.005 1.548 166 HB3 ARG 734 HB1 ARG 734 -1.939 -12.179 0.310 167 HG2 ARG 734 HG2 ARG 734 -3.693 -11.132 2.510 168 HG3 ARG 734 HG1 ARG 734 -3.823 -10.787 0.784 169 HD2 ARG 734 HD2 ARG 734 -4.011 -13.541 1.944 170 HD3 ARG 734 HD1 ARG 734 -5.412 -12.500 1.707 171 HE ARG 734 HE ARG 734 -4.420 -12.464 -0.724 172 HH11 ARG 734 HH11 ARG 734 -4.759 -15.320 1.447 173 HH12 ARG 734 HH12 ARG 734 -4.868 -16.397 0.134 174 HH21 ARG 734 HH21 ARG 734 -4.610 -14.065 -2.474 175 HH22 ARG 734 HH22 ARG 734 -4.790 -15.711 -2.049 176 H ALA 735 HN ALA 735 0.257 -11.571 3.059 177 HA ALA 735 HA ALA 735 2.317 -13.352 1.998 178 HB1 ALA 735 HB1 ALA 735 2.454 -11.028 1.247 179 HB2 ALA 735 HB2 ALA 735 3.851 -11.467 2.232 180 HB3 ALA 735 HB3 ALA 735 2.553 -10.492 2.923 181 H ARG 736 HN ARG 736 0.602 -12.970 4.665 182 HA ARG 736 HA ARG 736 0.736 -13.884 6.726 183 HB2 ARG 736 HB2 ARG 736 1.975 -15.664 5.329 184 HB3 ARG 736 HB1 ARG 736 3.367 -14.762 5.976 185 HG2 ARG 736 HG2 ARG 736 2.925 -15.390 8.181 186 HG3 ARG 736 HG1 ARG 736 1.345 -16.063 7.748 187 HD2 ARG 736 HD2 ARG 736 2.994 -17.825 8.095 188 HD3 ARG 736 HD1 ARG 736 2.431 -17.786 6.424 189 HE ARG 736 HE ARG 736 4.876 -16.320 6.983 190 HH11 ARG 736 HH11 ARG 736 3.453 -19.369 5.858 191 HH12 ARG 736 HH12 ARG 736 4.835 -19.854 4.989 192 HH21 ARG 736 HH21 ARG 736 6.817 -17.048 5.838 193 HH22 ARG 736 HH22 ARG 736 6.797 -18.536 5.019 194 H ALA 737 HN ALA 737 0.949 -11.635 7.406 195 HA ALA 737 HA ALA 737 1.814 -9.980 8.704 196 HB1 ALA 737 HB1 ALA 737 3.475 -12.211 9.851 197 HB2 ALA 737 HB2 ALA 737 1.814 -11.825 10.307 198 HB3 ALA 737 HB3 ALA 737 3.112 -10.669 10.632 199 H LYS 738 HN LYS 738 3.137 -10.609 6.274 200 HA LYS 738 HA LYS 738 5.975 -10.319 6.456 201 HB2 LYS 738 HB2 LYS 738 4.802 -11.138 4.425 202 HB3 LYS 738 HB1 LYS 738 4.272 -9.481 4.127 203 HG2 LYS 738 HG2 LYS 738 6.643 -8.798 3.990 204 HG3 LYS 738 HG1 LYS 738 7.111 -10.488 4.162 205 HD2 LYS 738 HD2 LYS 738 5.805 -11.004 2.126 206 HD3 LYS 738 HD1 LYS 738 5.473 -9.279 1.944 207 HE2 LYS 738 HE2 LYS 738 7.326 -9.895 0.520 208 HE3 LYS 738 HE1 LYS 738 7.901 -8.861 1.828 209 HZ1 LYS 738 HZ1 LYS 738 9.379 -10.760 1.439 210 HZ2 LYS 738 HZ2 LYS 738 8.119 -11.824 1.746 211 HZ3 LYS 738 HZ3 LYS 738 8.709 -10.852 2.990 212 H TRP 739 HN TRP 739 3.488 -7.984 5.616 213 HA TRP 739 HA TRP 739 5.263 -5.789 5.668 214 HB2 TRP 739 HB2 TRP 739 2.395 -5.349 6.030 215 HB3 TRP 739 HB1 TRP 739 3.533 -4.609 4.911 216 HD1 TRP 739 HD1 TRP 739 3.663 -5.599 2.570 217 HE1 TRP 739 HE1 TRP 739 2.224 -7.400 1.295 218 HE3 TRP 739 HE3 TRP 739 1.273 -7.534 6.431 219 HZ2 TRP 739 HZ2 TRP 739 0.367 -9.301 1.911 220 HZ3 TRP 739 HZ3 TRP 739 -0.368 -9.376 6.070 221 HH2 TRP 739 HH2 TRP 739 -0.797 -10.219 3.860 222 H ASP 740 HN ASP 740 2.716 -7.129 7.749 223 HA ASP 740 HA ASP 740 2.221 -6.808 9.998 224 HB2 ASP 740 HB2 ASP 740 4.617 -7.544 10.080 225 HB3 ASP 740 HB1 ASP 740 5.078 -5.834 10.185 226 H THR 741 HN THR 741 1.443 -4.906 8.270 227 HA THR 741 HA THR 741 2.368 -2.330 8.401 228 HB THR 741 HB THR 741 -0.537 -3.071 8.042 229 HG1 THR 741 HG1 THR 741 0.073 -3.420 5.866 230 HG21 THR 741 HG21 THR 741 1.221 -0.966 6.800 231 HG22 THR 741 HG22 THR 741 -0.020 -0.672 8.035 232 HG23 THR 741 HG23 THR 741 -0.476 -1.252 6.420 233 H ALA 742 HN ALA 742 0.657 -3.964 10.853 234 HA ALA 742 HA ALA 742 -0.476 -1.521 11.950 235 HB1 ALA 742 HB1 ALA 742 -0.827 -4.336 12.899 236 HB2 ALA 742 HB2 ALA 742 -1.898 -3.482 11.788 237 HB3 ALA 742 HB3 ALA 742 -1.717 -2.919 13.450 238 H ASN 743 HN ASN 743 2.386 -3.386 12.440 239 HA ASN 743 HA ASN 743 2.440 -2.414 15.188 240 HB2 ASN 743 HB2 ASN 743 3.883 -4.923 14.410 241 HB3 ASN 743 HB1 ASN 743 3.276 -4.434 15.982 242 HD21 ASN 743 HD21 ASN 743 2.491 -5.603 12.966 243 HD22 ASN 743 HD22 ASN 743 0.985 -6.407 13.249 244 H ASN 744 HN ASN 744 4.680 -3.840 12.787 245 HA ASN 744 HA ASN 744 6.422 -1.530 13.193 246 HB2 ASN 744 HB2 ASN 744 8.405 -3.130 13.140 247 HB3 ASN 744 HB1 ASN 744 7.426 -3.218 14.597 248 HD21 ASN 744 HD21 ASN 744 8.441 -4.798 11.723 249 HD22 ASN 744 HD22 ASN 744 7.722 -6.320 12.098 250 HA PRO 745 HA PRO 745 6.995 -1.170 8.882 251 HB2 PRO 745 HB2 PRO 745 9.627 -1.338 8.265 252 HB3 PRO 745 HB1 PRO 745 8.941 0.020 9.168 253 HG2 PRO 745 HG2 PRO 745 10.336 -2.419 10.200 254 HG3 PRO 745 HG1 PRO 745 10.606 -0.749 10.677 255 HD2 PRO 745 HD2 PRO 745 9.153 -2.421 12.112 256 HD3 PRO 745 HD1 PRO 745 8.693 -0.730 12.031 257 H LEU 746 HN LEU 746 8.855 -3.942 9.952 258 HA LEU 746 HA LEU 746 7.708 -5.473 7.798 259 HB2 LEU 746 HB2 LEU 746 10.026 -6.549 7.481 260 HB3 LEU 746 HB1 LEU 746 9.675 -5.036 6.660 261 HG LEU 746 HG LEU 746 10.990 -4.717 9.291 262 HD11 LEU 746 HD11 LEU 746 13.184 -5.362 8.470 263 HD12 LEU 746 HD12 LEU 746 12.446 -6.031 7.004 264 HD13 LEU 746 HD13 LEU 746 12.086 -6.733 8.591 265 HD21 LEU 746 HD21 LEU 746 10.582 -2.896 7.787 266 HD22 LEU 746 HD22 LEU 746 11.562 -3.670 6.529 267 HD23 LEU 746 HD23 LEU 746 12.311 -3.128 8.045 268 H PTR 747 HN PTR 747 10.413 -6.208 9.906 269 HA PTR 747 HA PTR 747 9.148 -7.385 11.967 270 HB2 PTR 747 HB2 PTR 747 9.423 -9.775 11.498 271 HB3 PTR 747 HB1 PTR 747 8.121 -9.053 10.591 272 HD1 PTR 747 HD1 PTR 747 10.952 -11.199 10.335 273 HD2 PTR 747 HD2 PTR 747 8.755 -8.331 8.093 274 HE1 PTR 747 HE1 PTR 747 11.850 -12.141 8.250 275 HE2 PTR 747 HE2 PTR 747 9.646 -9.256 6.012 276 H LYS 748 HN LYS 748 10.817 -6.298 12.808 277 HA LYS 748 HA LYS 748 13.537 -6.788 12.288 278 HB2 LYS 748 HB2 LYS 748 14.037 -5.598 14.388 279 HB3 LYS 748 HB1 LYS 748 12.835 -4.739 13.446 280 HG2 LYS 748 HG2 LYS 748 12.149 -6.500 15.837 281 HG3 LYS 748 HG1 LYS 748 12.423 -4.763 15.948 282 HD2 LYS 748 HD2 LYS 748 10.559 -4.552 14.178 283 HD3 LYS 748 HD1 LYS 748 10.206 -6.242 14.546 284 HE2 LYS 748 HE2 LYS 748 10.259 -4.031 16.598 285 HE3 LYS 748 HE1 LYS 748 8.806 -4.581 15.769 286 HZ1 LYS 748 HZ1 LYS 748 10.498 -6.277 17.601 287 HZ2 LYS 748 HZ2 LYS 748 9.100 -6.774 16.785 288 HZ3 LYS 748 HZ3 LYS 748 9.005 -5.589 17.916 289 H GLU 749 HN GLU 749 11.270 -8.463 14.309 290 HA GLU 749 HA GLU 749 13.470 -10.078 15.335 291 HB2 GLU 749 HB2 GLU 749 10.766 -9.554 16.540 292 HB3 GLU 749 HB1 GLU 749 11.994 -10.617 17.217 293 HG2 GLU 749 HG2 GLU 749 13.511 -8.740 17.448 294 HG3 GLU 749 HG1 GLU 749 12.323 -7.682 16.721 295 H ALA 750 HN ALA 750 9.960 -10.372 14.386 296 HA ALA 750 HA ALA 750 10.463 -12.682 12.912 297 HB1 ALA 750 HB1 ALA 750 9.267 -14.270 14.318 298 HB2 ALA 750 HB2 ALA 750 9.113 -13.050 15.583 299 HB3 ALA 750 HB3 ALA 750 10.706 -13.666 15.143 300 H THR 751 HN THR 751 8.613 -13.321 11.821 301 HA THR 751 HA THR 751 6.504 -11.428 11.700 302 HB THR 751 HB THR 751 5.824 -13.393 10.043 303 HG1 THR 751 HG1 THR 751 7.519 -14.747 10.624 304 HG21 THR 751 HG21 THR 751 8.013 -11.382 9.521 305 HG22 THR 751 HG22 THR 751 6.281 -11.071 9.402 306 HG23 THR 751 HG23 THR 751 7.057 -12.196 8.283 307 H SER 752 HN SER 752 4.269 -12.870 11.198 308 HA SER 752 HA SER 752 3.905 -14.534 13.586 309 HB2 SER 752 HB2 SER 752 1.902 -12.790 12.151 310 HB3 SER 752 HB1 SER 752 1.550 -13.813 13.541 311 HG SER 752 HG SER 752 3.067 -12.619 14.720 312 H THR 753 HN THR 753 2.845 -16.480 13.392 313 HA THR 753 HA THR 753 1.662 -17.181 10.837 314 HB THR 753 HB THR 753 2.643 -19.408 10.953 315 HG1 THR 753 HG1 THR 753 4.578 -18.228 12.748 316 HG21 THR 753 HG21 THR 753 3.584 -17.818 9.401 317 HG22 THR 753 HG22 THR 753 4.888 -18.813 10.048 318 HG23 THR 753 HG23 THR 753 4.646 -17.171 10.649 319 H PHE 754 HN PHE 754 -0.322 -17.760 11.336 320 HA PHE 754 HA PHE 754 -0.873 -18.877 13.975 321 HB2 PHE 754 HB2 PHE 754 -3.224 -18.451 13.500 322 HB3 PHE 754 HB1 PHE 754 -2.256 -17.022 13.152 323 HD1 PHE 754 HD1 PHE 754 -1.788 -16.402 10.833 324 HD2 PHE 754 HD2 PHE 754 -4.458 -19.549 11.795 325 HE1 PHE 754 HE1 PHE 754 -2.687 -16.295 8.601 326 HE2 PHE 754 HE2 PHE 754 -5.388 -19.455 9.528 327 HZ PHE 754 HZ PHE 754 -4.512 -17.829 7.915 328 H THR 755 HN THR 755 -0.773 -19.807 10.643 329 HA THR 755 HA THR 755 -2.637 -21.798 10.369 330 HB THR 755 HB THR 755 -1.101 -22.785 8.634 331 HG1 THR 755 HG1 THR 755 0.901 -21.999 8.442 332 HG21 THR 755 HG21 THR 755 -1.136 -20.794 7.220 333 HG22 THR 755 HG22 THR 755 -1.365 -19.805 8.662 334 HG23 THR 755 HG23 THR 755 -2.642 -20.921 8.152 335 H ASN 756 HN ASN 756 0.420 -22.077 11.922 336 HA ASN 756 HA ASN 756 0.696 -24.866 12.013 337 HB2 ASN 756 HB2 ASN 756 2.193 -24.332 14.073 338 HB3 ASN 756 HB1 ASN 756 2.637 -23.638 12.506 339 HD21 ASN 756 HD21 ASN 756 2.361 -21.471 12.196 340 HD22 ASN 756 HD22 ASN 756 2.098 -20.437 13.576 341 H ILE 757 HN ILE 757 -0.935 -22.782 14.145 342 HA ILE 757 HA ILE 757 -2.077 -25.188 15.396 343 HB ILE 757 HB ILE 757 -2.408 -23.950 17.513 344 HG12 ILE 757 HG12 ILE 757 -0.388 -22.063 16.319 345 HG13 ILE 757 HG11 ILE 757 -2.076 -21.690 16.649 346 HG21 ILE 757 HG21 ILE 757 0.422 -24.487 16.610 347 HG22 ILE 757 HG22 ILE 757 -0.709 -25.658 17.292 348 HG23 ILE 757 HG23 ILE 757 -0.092 -24.342 18.293 349 HD11 ILE 757 HD11 ILE 757 0.002 -22.441 18.638 350 HD12 ILE 757 HD12 ILE 757 -1.697 -22.135 18.976 351 HD13 ILE 757 HD13 ILE 757 -0.656 -20.803 18.399 352 H THR 758 HN THR 758 -2.806 -22.330 13.868 353 HA THR 758 HA THR 758 -5.575 -22.578 14.672 354 HB THR 758 HB THR 758 -4.381 -20.576 12.853 355 HG1 THR 758 HG1 THR 758 -4.745 -20.481 15.712 356 HG21 THR 758 HG21 THR 758 -6.320 -19.188 13.588 357 HG22 THR 758 HG22 THR 758 -6.859 -20.535 14.592 358 HG23 THR 758 HG23 THR 758 -6.813 -20.707 12.838 359 H TYR 759 HN TYR 759 -5.836 -24.379 13.640 360 HA TYR 759 HA TYR 759 -5.449 -24.562 10.722 361 HB2 TYR 759 HB2 TYR 759 -6.175 -27.138 11.467 362 HB3 TYR 759 HB1 TYR 759 -4.528 -26.561 11.260 363 HD1 TYR 759 HD1 TYR 759 -7.191 -27.231 13.834 364 HD2 TYR 759 HD2 TYR 759 -3.058 -26.363 13.152 365 HE1 TYR 759 HE1 TYR 759 -6.752 -27.690 16.097 366 HE2 TYR 759 HE2 TYR 759 -2.606 -26.858 15.551 367 HH TYR 759 HH TYR 759 -4.012 -26.779 17.693 368 H ARG 760 HN ARG 760 -7.906 -25.930 12.928 369 HA ARG 760 HA ARG 760 -9.946 -24.999 11.050 370 HB2 ARG 760 HB2 ARG 760 -11.221 -27.127 11.490 371 HB3 ARG 760 HB1 ARG 760 -9.716 -27.292 10.587 372 HG2 ARG 760 HG2 ARG 760 -9.557 -27.683 13.503 373 HG3 ARG 760 HG1 ARG 760 -10.398 -28.925 12.588 374 HD2 ARG 760 HD2 ARG 760 -7.587 -27.934 12.134 375 HD3 ARG 760 HD1 ARG 760 -8.036 -29.494 12.822 376 HE ARG 760 HE ARG 760 -9.182 -29.129 10.245 377 HH11 ARG 760 HH11 ARG 760 -6.112 -30.047 11.860 378 HH12 ARG 760 HH12 ARG 760 -5.503 -30.850 10.514 379 HH21 ARG 760 HH21 ARG 760 -8.289 -30.245 8.380 380 HH22 ARG 760 HH22 ARG 760 -6.767 -30.993 8.487 381 H GLY 761 HN GLY 761 -9.058 -25.736 14.294 382 HA2 GLY 761 HA2 GLY 761 -9.969 -23.954 15.799 383 HA3 GLY 761 HA1 GLY 761 -11.571 -24.532 15.294 384 H THR 762 HN THR 762 -8.580 -26.208 16.150 385 HA THR 762 HA THR 762 -10.135 -27.809 18.007 386 HB THR 762 HB THR 762 -7.412 -28.413 16.860 387 HG1 THR 762 HG1 THR 762 -10.027 -28.908 15.840 388 HG21 THR 762 HG21 THR 762 -8.080 -29.694 18.842 389 HG22 THR 762 HG22 THR 762 -8.005 -30.701 17.390 390 HG23 THR 762 HG23 THR 762 -9.574 -30.178 18.017 Start of MODEL 4 1 H LYS 716 HT1 LYS 716 3.843 1.036 0.609 2 HA LYS 716 HA LYS 716 6.167 0.209 0.538 3 HB2 LYS 716 HB2 LYS 716 4.885 0.690 2.668 4 HB3 LYS 716 HB1 LYS 716 4.520 -1.024 2.755 5 HG2 LYS 716 HG2 LYS 716 6.362 -0.627 4.237 6 HG3 LYS 716 HG1 LYS 716 7.011 -1.460 2.830 7 HD2 LYS 716 HD2 LYS 716 7.077 1.559 3.022 8 HD3 LYS 716 HD1 LYS 716 8.323 0.575 3.785 9 HE2 LYS 716 HE2 LYS 716 8.870 -0.415 1.602 10 HE3 LYS 716 HE1 LYS 716 7.594 0.541 0.851 11 HZ1 LYS 716 HZ1 LYS 716 8.781 2.539 1.337 12 HZ2 LYS 716 HZ2 LYS 716 9.855 1.508 0.580 13 HZ3 LYS 716 HZ3 LYS 716 9.940 1.737 2.253 14 H LEU 717 HN LEU 717 4.351 -2.618 1.761 15 HA LEU 717 HA LEU 717 6.159 -4.274 0.289 16 HB2 LEU 717 HB2 LEU 717 3.917 -4.944 2.181 17 HB3 LEU 717 HB1 LEU 717 4.950 -6.128 1.416 18 HG LEU 717 HG LEU 717 5.669 -5.884 3.586 19 HD11 LEU 717 HD11 LEU 717 7.539 -4.297 1.838 20 HD12 LEU 717 HD12 LEU 717 7.497 -6.053 2.018 21 HD13 LEU 717 HD13 LEU 717 7.991 -5.035 3.374 22 HD21 LEU 717 HD21 LEU 717 5.767 -2.903 3.211 23 HD22 LEU 717 HD22 LEU 717 6.361 -3.757 4.637 24 HD23 LEU 717 HD23 LEU 717 4.648 -3.814 4.225 25 H LEU 718 HN LEU 718 2.649 -4.749 0.704 26 HA LEU 718 HA LEU 718 2.459 -4.997 -2.227 27 HB2 LEU 718 HB2 LEU 718 1.080 -6.797 -0.225 28 HB3 LEU 718 HB1 LEU 718 0.826 -6.834 -1.954 29 HG LEU 718 HG LEU 718 3.310 -7.619 -0.449 30 HD11 LEU 718 HD11 LEU 718 2.903 -9.815 -1.439 31 HD12 LEU 718 HD12 LEU 718 1.419 -9.194 -2.164 32 HD13 LEU 718 HD13 LEU 718 1.575 -9.277 -0.411 33 HD21 LEU 718 HD21 LEU 718 2.886 -7.496 -3.442 34 HD22 LEU 718 HD22 LEU 718 4.293 -8.186 -2.641 35 HD23 LEU 718 HD23 LEU 718 3.961 -6.457 -2.508 36 H ILE 719 HN ILE 719 0.211 -4.918 0.627 37 HA ILE 719 HA ILE 719 -1.292 -3.017 -0.941 38 HB ILE 719 HB ILE 719 -3.272 -3.843 0.577 39 HG12 ILE 719 HG12 ILE 719 -2.999 -6.440 0.826 40 HG13 ILE 719 HG11 ILE 719 -1.279 -6.084 0.831 41 HG21 ILE 719 HG21 ILE 719 -3.252 -4.017 -1.813 42 HG22 ILE 719 HG22 ILE 719 -3.889 -5.501 -1.103 43 HG23 ILE 719 HG23 ILE 719 -2.240 -5.458 -1.728 44 HD11 ILE 719 HD11 ILE 719 -2.136 -6.294 3.074 45 HD12 ILE 719 HD12 ILE 719 -3.331 -5.037 2.760 46 HD13 ILE 719 HD13 ILE 719 -1.616 -4.635 2.783 47 H THR 720 HN THR 720 -0.114 -3.786 2.316 48 HA THR 720 HA THR 720 -0.068 -2.610 4.254 49 HB THR 720 HB THR 720 0.344 -0.167 2.484 50 HG1 THR 720 HG1 THR 720 1.735 -1.504 1.557 51 HG21 THR 720 HG21 THR 720 1.969 0.445 4.243 52 HG22 THR 720 HG22 THR 720 1.606 -1.050 5.104 53 HG23 THR 720 HG23 THR 720 0.367 0.193 4.936 54 H ILE 721 HN ILE 721 -2.708 -3.032 3.461 55 HA ILE 721 HA ILE 721 -4.114 -0.667 4.438 56 HB ILE 721 HB ILE 721 -5.932 -1.112 2.730 57 HG12 ILE 721 HG12 ILE 721 -3.721 -2.463 1.201 58 HG13 ILE 721 HG11 ILE 721 -4.977 -3.394 1.987 59 HG21 ILE 721 HG21 ILE 721 -4.525 0.840 2.586 60 HG22 ILE 721 HG22 ILE 721 -4.851 0.210 0.969 61 HG23 ILE 721 HG23 ILE 721 -3.291 -0.087 1.733 62 HD11 ILE 721 HD11 ILE 721 -5.441 -3.150 -0.374 63 HD12 ILE 721 HD12 ILE 721 -5.304 -1.394 -0.259 64 HD13 ILE 721 HD13 ILE 721 -6.638 -2.229 0.539 65 H HIS 722 HN HIS 722 -4.230 -4.026 3.479 66 HA HIS 722 HA HIS 722 -6.437 -4.521 5.315 67 HB2 HIS 722 HB2 HIS 722 -6.015 -5.437 2.885 68 HB3 HIS 722 HB1 HIS 722 -4.955 -6.521 3.798 69 HD1 HIS 722 HD1 HIS 722 -8.638 -5.554 3.566 70 HD2 HIS 722 HD2 HIS 722 -6.207 -8.631 4.935 71 HE1 HIS 722 HE1 HIS 722 -10.165 -7.408 4.107 72 HE2 HIS 722 HE2 HIS 722 -8.621 -9.323 4.395 73 H ASP 723 HN ASP 723 -3.148 -4.421 5.094 74 HA ASP 723 HA ASP 723 -2.025 -6.530 6.398 75 HB2 ASP 723 HB2 ASP 723 -0.604 -4.959 5.366 76 HB3 ASP 723 HB1 ASP 723 -1.331 -3.606 6.210 77 H ARG 724 HN ARG 724 -3.172 -3.534 7.792 78 HA ARG 724 HA ARG 724 -2.504 -4.440 10.409 79 HB2 ARG 724 HB2 ARG 724 -2.213 -2.158 9.734 80 HB3 ARG 724 HB1 ARG 724 -3.923 -1.984 9.463 81 HG2 ARG 724 HG2 ARG 724 -3.205 -1.009 11.661 82 HG3 ARG 724 HG1 ARG 724 -4.430 -2.309 11.704 83 HD2 ARG 724 HD2 ARG 724 -2.952 -3.866 12.412 84 HD3 ARG 724 HD1 ARG 724 -1.505 -2.869 12.136 85 HE ARG 724 HE ARG 724 -3.310 -1.683 14.031 86 HH11 ARG 724 HH11 ARG 724 -0.800 -4.207 13.829 87 HH12 ARG 724 HH12 ARG 724 -0.423 -4.122 15.489 88 HH21 ARG 724 HH21 ARG 724 -2.779 -1.599 16.259 89 HH22 ARG 724 HH22 ARG 724 -1.566 -2.596 16.913 90 H LYS 725 HN LYS 725 -5.158 -4.711 8.397 91 HA LYS 725 HA LYS 725 -6.956 -4.637 10.613 92 HB2 LYS 725 HB2 LYS 725 -7.393 -4.807 7.670 93 HB3 LYS 725 HB1 LYS 725 -8.683 -5.384 8.719 94 HG2 LYS 725 HG2 LYS 725 -8.692 -3.179 9.850 95 HG3 LYS 725 HG1 LYS 725 -7.477 -2.619 8.700 96 HD2 LYS 725 HD2 LYS 725 -10.105 -3.762 7.784 97 HD3 LYS 725 HD1 LYS 725 -9.948 -2.064 8.234 98 HE2 LYS 725 HE2 LYS 725 -8.217 -3.425 6.178 99 HE3 LYS 725 HE1 LYS 725 -9.701 -2.557 5.783 100 HZ1 LYS 725 HZ1 LYS 725 -7.287 -1.413 7.079 101 HZ2 LYS 725 HZ2 LYS 725 -8.721 -0.573 6.808 102 HZ3 LYS 725 HZ3 LYS 725 -7.800 -1.085 5.500 103 H GLU 726 HN GLU 726 -5.363 -6.981 8.707 104 HA GLU 726 HA GLU 726 -6.872 -9.131 9.763 105 HB2 GLU 726 HB2 GLU 726 -5.079 -10.564 8.729 106 HB3 GLU 726 HB1 GLU 726 -5.963 -9.447 7.696 107 HG2 GLU 726 HG2 GLU 726 -4.045 -7.882 7.856 108 HG3 GLU 726 HG1 GLU 726 -3.147 -9.174 8.659 109 H PHE 727 HN PHE 727 -4.342 -7.251 10.804 110 HA PHE 727 HA PHE 727 -3.447 -9.064 12.926 111 HB2 PHE 727 HB2 PHE 727 -3.109 -6.068 12.762 112 HB3 PHE 727 HB1 PHE 727 -2.258 -7.153 13.849 113 HD1 PHE 727 HD2 PHE 727 -1.727 -9.318 11.796 114 HD2 PHE 727 HD1 PHE 727 -1.319 -5.100 11.705 115 HE1 PHE 727 HE2 PHE 727 0.027 -9.532 10.108 116 HE2 PHE 727 HE1 PHE 727 0.447 -5.311 10.015 117 HZ PHE 727 HZ PHE 727 1.111 -7.534 9.216 118 H ALA 728 HN ALA 728 -6.248 -7.749 12.534 119 HA ALA 728 HA ALA 728 -6.592 -7.024 15.357 120 HB1 ALA 728 HB1 ALA 728 -7.243 -5.290 13.778 121 HB2 ALA 728 HB2 ALA 728 -8.621 -5.871 14.713 122 HB3 ALA 728 HB3 ALA 728 -8.402 -6.398 13.043 123 H LYS 729 HN LYS 729 -8.218 -8.759 12.755 124 HA LYS 729 HA LYS 729 -9.592 -10.337 14.829 125 HB2 LYS 729 HB2 LYS 729 -10.400 -10.081 11.928 126 HB3 LYS 729 HB1 LYS 729 -11.299 -10.888 13.198 127 HG2 LYS 729 HG2 LYS 729 -12.434 -8.882 12.979 128 HG3 LYS 729 HG1 LYS 729 -11.331 -8.531 14.312 129 HD2 LYS 729 HD2 LYS 729 -9.762 -7.490 12.695 130 HD3 LYS 729 HD1 LYS 729 -10.932 -7.788 11.407 131 HE2 LYS 729 HE2 LYS 729 -12.564 -6.417 12.652 132 HE3 LYS 729 HE1 LYS 729 -11.288 -6.105 13.844 133 HZ1 LYS 729 HZ1 LYS 729 -10.020 -4.882 12.200 134 HZ2 LYS 729 HZ2 LYS 729 -11.595 -4.305 12.114 135 HZ3 LYS 729 HZ3 LYS 729 -11.045 -5.397 10.967 136 H PHE 730 HN PHE 730 -7.408 -10.475 12.176 137 HA PHE 730 HA PHE 730 -6.025 -12.052 11.362 138 HB2 PHE 730 HB2 PHE 730 -6.711 -13.726 13.781 139 HB3 PHE 730 HB1 PHE 730 -5.259 -13.738 12.748 140 HD1 PHE 730 HD2 PHE 730 -7.115 -12.046 15.354 141 HD2 PHE 730 HD1 PHE 730 -3.540 -12.154 13.108 142 HE1 PHE 730 HE2 PHE 730 -6.173 -10.546 16.890 143 HE2 PHE 730 HE1 PHE 730 -2.505 -10.607 14.674 144 HZ PHE 730 HZ PHE 730 -3.796 -9.771 16.608 145 H GLU 731 HN GLU 731 -8.901 -12.190 10.891 146 HA GLU 731 HA GLU 731 -9.121 -15.034 10.109 147 HB2 GLU 731 HB2 GLU 731 -11.308 -12.993 10.370 148 HB3 GLU 731 HB1 GLU 731 -11.519 -14.686 9.943 149 HG2 GLU 731 HG2 GLU 731 -10.663 -15.340 12.135 150 HG3 GLU 731 HG1 GLU 731 -10.428 -13.651 12.548 151 H GLU 732 HN GLU 732 -8.694 -11.981 8.908 152 HA GLU 732 HA GLU 732 -9.732 -12.641 6.284 153 HB2 GLU 732 HB2 GLU 732 -8.866 -10.258 5.723 154 HB3 GLU 732 HB1 GLU 732 -10.336 -10.440 6.689 155 HG2 GLU 732 HG2 GLU 732 -8.636 -10.231 8.691 156 HG3 GLU 732 HG1 GLU 732 -7.610 -9.505 7.456 157 H GLU 733 HN GLU 733 -6.561 -10.723 6.622 158 HA GLU 733 HA GLU 733 -4.570 -11.140 5.951 159 HB2 GLU 733 HB2 GLU 733 -5.347 -13.968 6.029 160 HB3 GLU 733 HB1 GLU 733 -3.718 -13.317 5.982 161 HG2 GLU 733 HG2 GLU 733 -3.892 -12.381 8.162 162 HG3 GLU 733 HG1 GLU 733 -5.606 -12.818 8.305 163 H ARG 734 HN ARG 734 -4.666 -10.288 4.114 164 HA ARG 734 HA ARG 734 -5.359 -11.488 1.617 165 HB2 ARG 734 HB2 ARG 734 -3.250 -9.394 2.146 166 HB3 ARG 734 HB1 ARG 734 -3.876 -9.827 0.566 167 HG2 ARG 734 HG2 ARG 734 -5.295 -8.472 2.818 168 HG3 ARG 734 HG1 ARG 734 -4.927 -7.844 1.210 169 HD2 ARG 734 HD2 ARG 734 -6.285 -9.926 0.473 170 HD3 ARG 734 HD1 ARG 734 -6.911 -9.842 2.079 171 HE ARG 734 HE ARG 734 -7.046 -7.253 0.989 172 HH11 ARG 734 HH11 ARG 734 -8.676 -10.393 0.650 173 HH12 ARG 734 HH12 ARG 734 -10.187 -9.717 0.265 174 HH21 ARG 734 HH21 ARG 734 -9.177 -6.328 0.424 175 HH22 ARG 734 HH22 ARG 734 -10.479 -7.398 0.144 176 H ALA 735 HN ALA 735 -2.323 -11.218 3.334 177 HA ALA 735 HA ALA 735 -1.348 -13.497 1.792 178 HB1 ALA 735 HB1 ALA 735 -0.328 -11.447 0.958 179 HB2 ALA 735 HB2 ALA 735 0.865 -12.484 1.751 180 HB3 ALA 735 HB3 ALA 735 0.235 -11.065 2.585 181 H ARG 736 HN ARG 736 -2.491 -12.772 4.634 182 HA ARG 736 HA ARG 736 -2.378 -13.532 6.659 183 HB2 ARG 736 HB2 ARG 736 -0.441 -15.593 5.589 184 HB3 ARG 736 HB1 ARG 736 -1.261 -15.507 7.156 185 HG2 ARG 736 HG2 ARG 736 -2.553 -17.048 5.960 186 HG3 ARG 736 HG1 ARG 736 -3.443 -15.532 5.841 187 HD2 ARG 736 HD2 ARG 736 -3.458 -16.513 3.692 188 HD3 ARG 736 HD1 ARG 736 -2.307 -15.179 3.629 189 HE ARG 736 HE ARG 736 -0.583 -16.977 4.034 190 HH11 ARG 736 HH11 ARG 736 -3.603 -17.539 2.262 191 HH12 ARG 736 HH12 ARG 736 -2.987 -18.834 1.334 192 HH21 ARG 736 HH21 ARG 736 0.264 -18.778 2.752 193 HH22 ARG 736 HH22 ARG 736 -0.737 -19.547 1.602 194 H ALA 737 HN ALA 737 -1.376 -11.435 7.054 195 HA ALA 737 HA ALA 737 0.187 -10.071 8.074 196 HB1 ALA 737 HB1 ALA 737 0.908 -12.653 9.456 197 HB2 ALA 737 HB2 ALA 737 -0.386 -11.558 9.932 198 HB3 ALA 737 HB3 ALA 737 1.297 -11.034 10.026 199 H LYS 738 HN LYS 738 0.905 -11.463 5.802 200 HA LYS 738 HA LYS 738 3.508 -12.479 5.534 201 HB2 LYS 738 HB2 LYS 738 1.833 -12.418 3.728 202 HB3 LYS 738 HB1 LYS 738 2.179 -10.705 3.529 203 HG2 LYS 738 HG2 LYS 738 3.349 -11.828 1.825 204 HG3 LYS 738 HG1 LYS 738 4.555 -11.368 3.028 205 HD2 LYS 738 HD2 LYS 738 4.609 -13.587 3.907 206 HD3 LYS 738 HD1 LYS 738 3.241 -14.071 2.906 207 HE2 LYS 738 HE2 LYS 738 4.601 -13.614 0.903 208 HE3 LYS 738 HE1 LYS 738 5.969 -13.245 1.955 209 HZ1 LYS 738 HZ1 LYS 738 4.561 -15.853 1.804 210 HZ2 LYS 738 HZ2 LYS 738 5.848 -15.486 2.827 211 HZ3 LYS 738 HZ3 LYS 738 6.085 -15.500 1.144 212 H TRP 739 HN TRP 739 2.533 -9.206 4.942 213 HA TRP 739 HA TRP 739 5.199 -8.264 4.634 214 HB2 TRP 739 HB2 TRP 739 3.131 -6.291 5.169 215 HB3 TRP 739 HB1 TRP 739 4.234 -6.448 3.810 216 HD1 TRP 739 HD1 TRP 739 3.279 -7.428 1.649 217 HE1 TRP 739 HE1 TRP 739 0.870 -8.224 0.903 218 HE3 TRP 739 HE3 TRP 739 1.071 -7.547 6.100 219 HZ2 TRP 739 HZ2 TRP 739 -1.538 -8.779 2.075 220 HZ3 TRP 739 HZ3 TRP 739 -1.326 -8.203 6.281 221 HH2 TRP 739 HH2 TRP 739 -2.603 -8.804 4.297 222 H ASP 740 HN ASP 740 2.734 -8.253 7.057 223 HA ASP 740 HA ASP 740 2.544 -7.383 9.211 224 HB2 ASP 740 HB2 ASP 740 4.182 -9.356 9.429 225 HB3 ASP 740 HB1 ASP 740 5.419 -8.079 9.458 226 H THR 741 HN THR 741 2.354 -5.345 8.299 227 HA THR 741 HA THR 741 4.730 -3.653 8.418 228 HB THR 741 HB THR 741 2.083 -2.741 7.381 229 HG1 THR 741 HG1 THR 741 2.433 -4.776 6.481 230 HG21 THR 741 HG21 THR 741 4.931 -2.339 6.510 231 HG22 THR 741 HG22 THR 741 3.997 -1.242 7.533 232 HG23 THR 741 HG23 THR 741 3.518 -1.503 5.837 233 H ALA 742 HN ALA 742 3.346 -4.548 10.741 234 HA ALA 742 HA ALA 742 2.676 -1.967 11.904 235 HB1 ALA 742 HB1 ALA 742 0.690 -4.202 12.066 236 HB2 ALA 742 HB2 ALA 742 0.554 -2.777 11.032 237 HB3 ALA 742 HB3 ALA 742 0.535 -2.601 12.788 238 H ASN 743 HN ASN 743 3.554 -5.285 12.428 239 HA ASN 743 HA ASN 743 3.522 -4.809 15.309 240 HB2 ASN 743 HB2 ASN 743 4.035 -7.459 13.983 241 HB3 ASN 743 HB1 ASN 743 3.447 -7.144 15.606 242 HD21 ASN 743 HD21 ASN 743 2.746 -7.131 12.364 243 HD22 ASN 743 HD22 ASN 743 1.031 -7.285 12.339 244 H ASN 744 HN ASN 744 5.511 -6.374 12.841 245 HA ASN 744 HA ASN 744 7.855 -5.462 14.303 246 HB2 ASN 744 HB2 ASN 744 8.932 -7.705 13.946 247 HB3 ASN 744 HB1 ASN 744 7.515 -7.809 14.973 248 HD21 ASN 744 HD21 ASN 744 7.813 -7.692 11.420 249 HD22 ASN 744 HD22 ASN 744 6.987 -9.186 11.184 250 HA PRO 745 HA PRO 745 9.824 -4.302 10.481 251 HB2 PRO 745 HB2 PRO 745 11.960 -5.924 9.975 252 HB3 PRO 745 HB1 PRO 745 11.960 -4.700 11.253 253 HG2 PRO 745 HG2 PRO 745 11.407 -7.654 11.495 254 HG3 PRO 745 HG1 PRO 745 12.417 -6.661 12.501 255 HD2 PRO 745 HD2 PRO 745 10.018 -7.316 13.254 256 HD3 PRO 745 HD1 PRO 745 10.647 -5.696 13.590 257 H LEU 746 HN LEU 746 10.114 -7.827 10.290 258 HA LEU 746 HA LEU 746 8.999 -7.751 7.571 259 HB2 LEU 746 HB2 LEU 746 10.180 -9.965 7.328 260 HB3 LEU 746 HB1 LEU 746 11.225 -8.563 7.426 261 HG LEU 746 HG LEU 746 10.860 -9.661 10.063 262 HD11 LEU 746 HD11 LEU 746 11.959 -11.817 9.730 263 HD12 LEU 746 HD12 LEU 746 11.837 -11.611 7.979 264 HD13 LEU 746 HD13 LEU 746 10.375 -11.756 8.961 265 HD21 LEU 746 HD21 LEU 746 12.680 -8.244 9.365 266 HD22 LEU 746 HD22 LEU 746 13.288 -9.526 8.290 267 HD23 LEU 746 HD23 LEU 746 13.226 -9.771 10.049 268 H PTR 747 HN PTR 747 9.347 -10.408 9.899 269 HA PTR 747 HA PTR 747 6.887 -10.444 10.902 270 HB2 PTR 747 HB2 PTR 747 5.621 -11.984 9.713 271 HB3 PTR 747 HB1 PTR 747 6.034 -10.714 8.611 272 HD1 PTR 747 HD1 PTR 747 8.146 -11.177 7.048 273 HD2 PTR 747 HD2 PTR 747 5.908 -14.247 8.953 274 HE1 PTR 747 HE1 PTR 747 8.993 -12.805 5.419 275 HE2 PTR 747 HE2 PTR 747 6.751 -15.881 7.338 276 H LYS 748 HN LYS 748 8.035 -11.044 12.608 277 HA LYS 748 HA LYS 748 8.905 -13.860 12.654 278 HB2 LYS 748 HB2 LYS 748 10.834 -13.116 14.056 279 HB3 LYS 748 HB1 LYS 748 10.897 -12.628 12.363 280 HG2 LYS 748 HG2 LYS 748 9.639 -10.506 13.437 281 HG3 LYS 748 HG1 LYS 748 10.654 -11.003 14.791 282 HD2 LYS 748 HD2 LYS 748 11.699 -10.689 12.017 283 HD3 LYS 748 HD1 LYS 748 11.538 -9.336 13.147 284 HE2 LYS 748 HE2 LYS 748 13.125 -11.870 13.659 285 HE3 LYS 748 HE1 LYS 748 13.841 -10.341 13.158 286 HZ1 LYS 748 HZ1 LYS 748 12.891 -9.362 15.257 287 HZ2 LYS 748 HZ2 LYS 748 14.057 -10.554 15.500 288 HZ3 LYS 748 HZ3 LYS 748 12.457 -10.932 15.724 289 H GLU 749 HN GLU 749 7.325 -11.235 14.311 290 HA GLU 749 HA GLU 749 7.392 -12.798 16.789 291 HB2 GLU 749 HB2 GLU 749 7.112 -9.820 16.487 292 HB3 GLU 749 HB1 GLU 749 7.026 -10.691 18.010 293 HG2 GLU 749 HG2 GLU 749 9.331 -11.529 17.545 294 HG3 GLU 749 HG1 GLU 749 9.379 -10.426 16.176 295 H ALA 750 HN ALA 750 5.226 -10.162 15.731 296 HA ALA 750 HA ALA 750 3.028 -11.697 16.902 297 HB1 ALA 750 HB1 ALA 750 3.056 -8.849 15.926 298 HB2 ALA 750 HB2 ALA 750 3.332 -9.366 17.587 299 HB3 ALA 750 HB3 ALA 750 1.761 -9.631 16.829 300 H THR 751 HN THR 751 4.329 -11.906 14.128 301 HA THR 751 HA THR 751 2.376 -11.464 12.206 302 HB THR 751 HB THR 751 4.348 -13.695 12.288 303 HG1 THR 751 HG1 THR 751 4.624 -10.879 11.927 304 HG21 THR 751 HG21 THR 751 3.230 -12.021 10.044 305 HG22 THR 751 HG22 THR 751 2.817 -13.700 10.398 306 HG23 THR 751 HG23 THR 751 4.446 -13.282 9.864 307 H SER 752 HN SER 752 0.824 -13.008 11.255 308 HA SER 752 HA SER 752 0.189 -15.263 12.957 309 HB2 SER 752 HB2 SER 752 -1.766 -13.037 12.391 310 HB3 SER 752 HB1 SER 752 -2.090 -14.524 13.279 311 HG SER 752 HG SER 752 0.018 -12.880 14.076 312 H THR 753 HN THR 753 -0.896 -16.914 11.890 313 HA THR 753 HA THR 753 -2.161 -16.403 9.372 314 HB THR 753 HB THR 753 -1.090 -18.324 8.348 315 HG1 THR 753 HG1 THR 753 0.641 -18.257 10.636 316 HG21 THR 753 HG21 THR 753 1.177 -17.388 7.896 317 HG22 THR 753 HG22 THR 753 0.959 -16.291 9.259 318 HG23 THR 753 HG23 THR 753 -0.085 -16.156 7.848 319 H PHE 754 HN PHE 754 -3.785 -17.863 9.113 320 HA PHE 754 HA PHE 754 -4.022 -20.039 11.125 321 HB2 PHE 754 HB2 PHE 754 -6.392 -19.814 11.145 322 HB3 PHE 754 HB1 PHE 754 -5.638 -18.244 11.524 323 HD1 PHE 754 HD1 PHE 754 -5.675 -16.489 9.797 324 HD2 PHE 754 HD2 PHE 754 -7.834 -20.103 9.316 325 HE1 PHE 754 HE1 PHE 754 -6.983 -15.453 8.050 326 HE2 PHE 754 HE2 PHE 754 -9.174 -19.077 7.544 327 HZ PHE 754 HZ PHE 754 -8.762 -16.745 6.895 328 H THR 755 HN THR 755 -3.905 -19.257 7.966 329 HA THR 755 HA THR 755 -5.615 -21.139 6.769 330 HB THR 755 HB THR 755 -4.038 -20.738 4.753 331 HG1 THR 755 HG1 THR 755 -2.273 -19.725 5.388 332 HG21 THR 755 HG21 THR 755 -6.236 -19.682 5.067 333 HG22 THR 755 HG22 THR 755 -5.057 -18.549 4.393 334 HG23 THR 755 HG23 THR 755 -5.486 -18.465 6.103 335 H ASN 756 HN ASN 756 -2.442 -21.505 8.063 336 HA ASN 756 HA ASN 756 -2.167 -24.103 6.717 337 HB2 ASN 756 HB2 ASN 756 0.313 -23.884 7.245 338 HB3 ASN 756 HB1 ASN 756 -0.424 -22.678 6.152 339 HD21 ASN 756 HD21 ASN 756 -0.446 -20.657 6.732 340 HD22 ASN 756 HD22 ASN 756 0.370 -20.067 8.171 341 H ILE 757 HN ILE 757 -2.790 -22.712 9.561 342 HA ILE 757 HA ILE 757 -2.887 -23.324 11.799 343 HB ILE 757 HB ILE 757 -3.070 -26.097 10.637 344 HG12 ILE 757 HG12 ILE 757 -4.499 -24.291 9.649 345 HG13 ILE 757 HG11 ILE 757 -5.398 -25.685 10.182 346 HG21 ILE 757 HG21 ILE 757 -4.505 -26.573 12.640 347 HG22 ILE 757 HG22 ILE 757 -4.248 -24.922 13.206 348 HG23 ILE 757 HG23 ILE 757 -2.894 -26.049 13.134 349 HD11 ILE 757 HD11 ILE 757 -5.077 -23.034 11.574 350 HD12 ILE 757 HD12 ILE 757 -5.944 -24.405 12.270 351 HD13 ILE 757 HD13 ILE 757 -6.541 -23.635 10.795 352 H THR 758 HN THR 758 -0.276 -23.194 10.584 353 HA THR 758 HA THR 758 1.188 -24.811 12.542 354 HB THR 758 HB THR 758 2.323 -23.655 10.082 355 HG1 THR 758 HG1 THR 758 0.544 -25.497 10.038 356 HG21 THR 758 HG21 THR 758 3.248 -25.890 11.894 357 HG22 THR 758 HG22 THR 758 3.928 -24.268 11.790 358 HG23 THR 758 HG23 THR 758 4.095 -25.383 10.433 359 H TYR 759 HN TYR 759 0.704 -23.115 13.878 360 HA TYR 759 HA TYR 759 2.431 -20.789 13.489 361 HB2 TYR 759 HB2 TYR 759 0.697 -19.489 14.940 362 HB3 TYR 759 HB1 TYR 759 0.365 -19.796 13.245 363 HD1 TYR 759 HD2 TYR 759 -1.398 -21.474 12.591 364 HD2 TYR 759 HD1 TYR 759 -0.684 -20.449 16.674 365 HE1 TYR 759 HE2 TYR 759 -3.539 -22.443 13.208 366 HE2 TYR 759 HE1 TYR 759 -2.844 -21.435 17.284 367 HH TYR 759 HH TYR 759 -4.948 -21.962 16.259 368 H ARG 760 HN ARG 760 0.713 -22.417 16.090 369 HA ARG 760 HA ARG 760 3.230 -22.522 17.566 370 HB2 ARG 760 HB2 ARG 760 2.311 -21.596 19.575 371 HB3 ARG 760 HB1 ARG 760 2.216 -20.433 18.250 372 HG2 ARG 760 HG2 ARG 760 0.098 -20.133 19.114 373 HG3 ARG 760 HG1 ARG 760 -0.200 -21.492 18.058 374 HD2 ARG 760 HD2 ARG 760 -1.189 -21.890 20.245 375 HD3 ARG 760 HD1 ARG 760 0.082 -23.051 19.862 376 HE ARG 760 HE ARG 760 1.256 -20.989 21.296 377 HH11 ARG 760 HH11 ARG 760 -1.151 -23.525 21.830 378 HH12 ARG 760 HH12 ARG 760 -0.885 -23.631 23.502 379 HH21 ARG 760 HH21 ARG 760 1.650 -21.145 23.541 380 HH22 ARG 760 HH22 ARG 760 0.751 -22.244 24.528 381 H GLY 761 HN GLY 761 -0.005 -23.649 17.128 382 HA2 GLY 761 HA2 GLY 761 -0.645 -25.881 17.396 383 HA3 GLY 761 HA1 GLY 761 0.726 -26.128 18.473 384 H THR 762 HN THR 762 -2.457 -24.594 18.237 385 HA THR 762 HA THR 762 -2.610 -24.329 21.087 386 HB THR 762 HB THR 762 -5.090 -23.730 20.308 387 HG1 THR 762 HG1 THR 762 -4.960 -22.780 18.196 388 HG21 THR 762 HG21 THR 762 -4.360 -21.400 20.016 389 HG22 THR 762 HG22 THR 762 -2.695 -21.948 19.819 390 HG23 THR 762 HG23 THR 762 -3.520 -22.168 21.362 Start of MODEL 5 1 H LYS 716 HT1 LYS 716 -0.662 -1.942 -1.884 2 HA LYS 716 HA LYS 716 1.632 -1.406 -1.369 3 HB2 LYS 716 HB2 LYS 716 1.263 -1.183 1.197 4 HB3 LYS 716 HB1 LYS 716 0.191 -0.328 0.109 5 HG2 LYS 716 HG2 LYS 716 -1.494 -2.100 0.412 6 HG3 LYS 716 HG1 LYS 716 -0.429 -2.921 1.550 7 HD2 LYS 716 HD2 LYS 716 -0.453 -0.910 2.979 8 HD3 LYS 716 HD1 LYS 716 -1.559 -0.140 1.839 9 HE2 LYS 716 HE2 LYS 716 -3.214 -1.873 2.255 10 HE3 LYS 716 HE1 LYS 716 -2.102 -2.692 3.350 11 HZ1 LYS 716 HZ1 LYS 716 -3.728 -1.356 4.546 12 HZ2 LYS 716 HZ2 LYS 716 -3.219 0.034 3.731 13 HZ3 LYS 716 HZ3 LYS 716 -2.170 -0.739 4.798 14 H LEU 717 HN LEU 717 0.978 -3.897 1.132 15 HA LEU 717 HA LEU 717 3.719 -4.530 1.082 16 HB2 LEU 717 HB2 LEU 717 1.373 -5.757 2.528 17 HB3 LEU 717 HB1 LEU 717 3.041 -6.240 2.753 18 HG LEU 717 HG LEU 717 2.469 -4.902 4.573 19 HD11 LEU 717 HD11 LEU 717 3.986 -2.981 4.410 20 HD12 LEU 717 HD12 LEU 717 4.042 -3.196 2.660 21 HD13 LEU 717 HD13 LEU 717 4.672 -4.453 3.724 22 HD21 LEU 717 HD21 LEU 717 1.576 -2.611 4.405 23 HD22 LEU 717 HD22 LEU 717 0.480 -3.820 3.738 24 HD23 LEU 717 HD23 LEU 717 1.442 -2.812 2.658 25 H LEU 718 HN LEU 718 1.037 -6.859 0.985 26 HA LEU 718 HA LEU 718 2.149 -7.849 -1.536 27 HB2 LEU 718 HB2 LEU 718 1.265 -9.561 0.774 28 HB3 LEU 718 HB1 LEU 718 1.631 -10.164 -0.815 29 HG LEU 718 HG LEU 718 3.635 -8.864 1.043 30 HD11 LEU 718 HD11 LEU 718 2.963 -11.072 1.798 31 HD12 LEU 718 HD12 LEU 718 4.620 -11.089 1.198 32 HD13 LEU 718 HD13 LEU 718 3.317 -11.741 0.205 33 HD21 LEU 718 HD21 LEU 718 4.015 -10.149 -1.668 34 HD22 LEU 718 HD22 LEU 718 5.305 -9.562 -0.621 35 HD23 LEU 718 HD23 LEU 718 4.147 -8.427 -1.314 36 H ILE 719 HN ILE 719 -0.602 -8.349 0.665 37 HA ILE 719 HA ILE 719 -2.217 -8.820 -1.735 38 HB ILE 719 HB ILE 719 -3.143 -9.353 1.086 39 HG12 ILE 719 HG12 ILE 719 -0.992 -10.546 0.746 40 HG13 ILE 719 HG11 ILE 719 -2.350 -11.656 0.863 41 HG21 ILE 719 HG21 ILE 719 -3.876 -10.505 -1.611 42 HG22 ILE 719 HG22 ILE 719 -4.836 -9.366 -0.664 43 HG23 ILE 719 HG23 ILE 719 -4.569 -11.003 -0.067 44 HD11 ILE 719 HD11 ILE 719 -0.997 -10.785 -1.689 45 HD12 ILE 719 HD12 ILE 719 -2.351 -11.909 -1.569 46 HD13 ILE 719 HD13 ILE 719 -0.788 -12.340 -0.878 47 H THR 720 HN THR 720 -1.840 -6.665 0.914 48 HA THR 720 HA THR 720 -2.628 -4.579 1.276 49 HB THR 720 HB THR 720 -4.134 -4.797 -1.373 50 HG1 THR 720 HG1 THR 720 -2.262 -4.853 -2.218 51 HG21 THR 720 HG21 THR 720 -3.056 -2.394 0.137 52 HG22 THR 720 HG22 THR 720 -4.756 -2.850 0.025 53 HG23 THR 720 HG23 THR 720 -3.884 -2.341 -1.421 54 H ILE 721 HN ILE 721 -4.147 -7.128 1.957 55 HA ILE 721 HA ILE 721 -6.582 -5.753 2.781 56 HB ILE 721 HB ILE 721 -7.898 -7.855 2.559 57 HG12 ILE 721 HG12 ILE 721 -5.609 -8.799 0.815 58 HG13 ILE 721 HG11 ILE 721 -6.021 -9.484 2.380 59 HG21 ILE 721 HG21 ILE 721 -8.332 -7.630 0.139 60 HG22 ILE 721 HG22 ILE 721 -6.848 -6.688 -0.013 61 HG23 ILE 721 HG23 ILE 721 -8.185 -6.073 0.958 62 HD11 ILE 721 HD11 ILE 721 -8.177 -10.209 1.479 63 HD12 ILE 721 HD12 ILE 721 -6.816 -10.867 0.561 64 HD13 ILE 721 HD13 ILE 721 -7.743 -9.510 -0.083 65 H HIS 722 HN HIS 722 -4.755 -8.745 3.327 66 HA HIS 722 HA HIS 722 -5.740 -8.751 6.093 67 HB2 HIS 722 HB2 HIS 722 -4.405 -10.826 4.381 68 HB3 HIS 722 HB1 HIS 722 -4.568 -11.011 6.126 69 HD1 HIS 722 HD1 HIS 722 -7.531 -9.366 4.543 70 HD2 HIS 722 HD2 HIS 722 -6.294 -13.238 5.453 71 HE1 HIS 722 HE1 HIS 722 -9.541 -10.764 4.364 72 HE2 HIS 722 HE2 HIS 722 -8.796 -13.107 4.810 73 H ASP 723 HN ASP 723 -3.354 -7.541 4.427 74 HA ASP 723 HA ASP 723 -1.001 -8.055 5.817 75 HB2 ASP 723 HB2 ASP 723 -1.732 -5.425 4.493 76 HB3 ASP 723 HB1 ASP 723 -0.136 -6.133 4.676 77 H ARG 724 HN ARG 724 -3.727 -6.271 6.554 78 HA ARG 724 HA ARG 724 -2.556 -4.990 8.995 79 HB2 ARG 724 HB2 ARG 724 -2.690 -3.311 7.289 80 HB3 ARG 724 HB1 ARG 724 -4.286 -3.798 6.834 81 HG2 ARG 724 HG2 ARG 724 -4.349 -1.706 8.123 82 HG3 ARG 724 HG1 ARG 724 -5.200 -3.046 8.906 83 HD2 ARG 724 HD2 ARG 724 -3.460 -3.396 10.407 84 HD3 ARG 724 HD1 ARG 724 -2.376 -2.259 9.584 85 HE ARG 724 HE ARG 724 -3.995 -0.511 10.273 86 HH11 ARG 724 HH11 ARG 724 -3.886 -3.570 12.078 87 HH12 ARG 724 HH12 ARG 724 -4.396 -2.889 13.554 88 HH21 ARG 724 HH21 ARG 724 -4.731 0.423 12.322 89 HH22 ARG 724 HH22 ARG 724 -4.895 -0.574 13.694 90 H LYS 725 HN LYS 725 -5.263 -6.559 7.444 91 HA LYS 725 HA LYS 725 -7.040 -5.785 9.562 92 HB2 LYS 725 HB2 LYS 725 -7.377 -7.301 7.003 93 HB3 LYS 725 HB1 LYS 725 -8.604 -7.449 8.252 94 HG2 LYS 725 HG2 LYS 725 -9.199 -5.746 6.575 95 HG3 LYS 725 HG1 LYS 725 -9.015 -5.046 8.180 96 HD2 LYS 725 HD2 LYS 725 -6.794 -4.241 7.582 97 HD3 LYS 725 HD1 LYS 725 -6.932 -5.001 5.997 98 HE2 LYS 725 HE2 LYS 725 -7.390 -2.634 5.827 99 HE3 LYS 725 HE1 LYS 725 -8.851 -3.557 5.496 100 HZ1 LYS 725 HZ1 LYS 725 -8.223 -2.341 8.127 101 HZ2 LYS 725 HZ2 LYS 725 -9.688 -3.047 7.649 102 HZ3 LYS 725 HZ3 LYS 725 -9.156 -1.608 6.921 103 H GLU 726 HN GLU 726 -4.804 -8.183 9.110 104 HA GLU 726 HA GLU 726 -6.051 -10.277 10.450 105 HB2 GLU 726 HB2 GLU 726 -3.820 -11.160 10.765 106 HB3 GLU 726 HB1 GLU 726 -4.049 -10.609 9.118 107 HG2 GLU 726 HG2 GLU 726 -2.595 -8.822 9.375 108 HG3 GLU 726 HG1 GLU 726 -2.758 -8.816 11.133 109 H PHE 727 HN PHE 727 -4.457 -7.385 11.405 110 HA PHE 727 HA PHE 727 -3.982 -8.133 14.128 111 HB2 PHE 727 HB2 PHE 727 -4.089 -5.382 12.906 112 HB3 PHE 727 HB1 PHE 727 -3.328 -5.827 14.417 113 HD1 PHE 727 HD2 PHE 727 -1.532 -7.912 14.032 114 HD2 PHE 727 HD1 PHE 727 -2.694 -4.954 11.188 115 HE1 PHE 727 HE2 PHE 727 0.536 -8.260 12.808 116 HE2 PHE 727 HE1 PHE 727 -0.606 -5.322 9.968 117 HZ PHE 727 HZ PHE 727 1.009 -6.974 10.777 118 H ALA 728 HN ALA 728 -6.706 -7.890 12.748 119 HA ALA 728 HA ALA 728 -8.056 -6.451 14.917 120 HB1 ALA 728 HB1 ALA 728 -10.020 -6.354 13.495 121 HB2 ALA 728 HB2 ALA 728 -9.179 -7.287 12.258 122 HB3 ALA 728 HB3 ALA 728 -8.618 -5.668 12.675 123 H LYS 729 HN LYS 729 -7.769 -9.537 13.291 124 HA LYS 729 HA LYS 729 -9.580 -10.646 15.343 125 HB2 LYS 729 HB2 LYS 729 -9.114 -11.902 12.626 126 HB3 LYS 729 HB1 LYS 729 -10.280 -12.400 13.834 127 HG2 LYS 729 HG2 LYS 729 -11.614 -11.309 12.322 128 HG3 LYS 729 HG1 LYS 729 -11.250 -10.005 13.453 129 HD2 LYS 729 HD2 LYS 729 -9.547 -9.140 12.003 130 HD3 LYS 729 HD1 LYS 729 -9.687 -10.537 10.934 131 HE2 LYS 729 HE2 LYS 729 -12.018 -9.884 10.499 132 HE3 LYS 729 HE1 LYS 729 -11.728 -8.425 11.465 133 HZ1 LYS 729 HZ1 LYS 729 -10.083 -9.131 9.110 134 HZ2 LYS 729 HZ2 LYS 729 -10.240 -7.589 9.859 135 HZ3 LYS 729 HZ3 LYS 729 -11.504 -8.236 8.969 136 H PHE 730 HN PHE 730 -6.541 -11.022 13.603 137 HA PHE 730 HA PHE 730 -4.769 -12.298 13.860 138 HB2 PHE 730 HB2 PHE 730 -5.747 -12.890 16.677 139 HB3 PHE 730 HB1 PHE 730 -4.088 -12.884 16.036 140 HD1 PHE 730 HD2 PHE 730 -6.970 -10.769 16.893 141 HD2 PHE 730 HD1 PHE 730 -2.816 -10.891 16.051 142 HE1 PHE 730 HE2 PHE 730 -6.840 -8.533 17.553 143 HE2 PHE 730 HE1 PHE 730 -2.618 -8.537 16.746 144 HZ PHE 730 HZ PHE 730 -4.612 -7.318 17.515 145 H GLU 731 HN GLU 731 -7.155 -13.345 12.907 146 HA GLU 731 HA GLU 731 -6.750 -16.238 13.397 147 HB2 GLU 731 HB2 GLU 731 -9.383 -14.934 12.709 148 HB3 GLU 731 HB1 GLU 731 -9.108 -16.639 13.022 149 HG2 GLU 731 HG2 GLU 731 -8.429 -16.066 15.321 150 HG3 GLU 731 HG1 GLU 731 -8.795 -14.391 14.980 151 H GLU 732 HN GLU 732 -7.320 -13.706 11.065 152 HA GLU 732 HA GLU 732 -7.634 -15.482 8.864 153 HB2 GLU 732 HB2 GLU 732 -7.227 -13.248 7.540 154 HB3 GLU 732 HB1 GLU 732 -8.732 -13.518 8.398 155 HG2 GLU 732 HG2 GLU 732 -8.025 -12.120 10.206 156 HG3 GLU 732 HG1 GLU 732 -6.412 -11.934 9.532 157 H GLU 733 HN GLU 733 -5.136 -12.834 8.713 158 HA GLU 733 HA GLU 733 -3.001 -12.869 8.108 159 HB2 GLU 733 HB2 GLU 733 -3.105 -15.162 9.878 160 HB3 GLU 733 HB1 GLU 733 -1.620 -14.364 9.375 161 HG2 GLU 733 HG2 GLU 733 -2.183 -12.366 10.417 162 HG3 GLU 733 HG1 GLU 733 -3.807 -12.924 10.872 163 H ARG 734 HN ARG 734 -3.334 -13.499 5.974 164 HA ARG 734 HA ARG 734 -3.047 -16.107 4.982 165 HB2 ARG 734 HB2 ARG 734 -2.076 -13.548 3.768 166 HB3 ARG 734 HB1 ARG 734 -2.327 -15.071 2.919 167 HG2 ARG 734 HG2 ARG 734 -4.642 -14.981 3.287 168 HG3 ARG 734 HG1 ARG 734 -4.469 -13.602 4.374 169 HD2 ARG 734 HD2 ARG 734 -5.222 -12.847 2.432 170 HD3 ARG 734 HD1 ARG 734 -3.568 -12.322 2.534 171 HE ARG 734 HE ARG 734 -2.987 -14.331 1.053 172 HH11 ARG 734 HH11 ARG 734 -6.173 -12.791 0.736 173 HH12 ARG 734 HH12 ARG 734 -6.298 -13.092 -0.938 174 HH21 ARG 734 HH21 ARG 734 -3.183 -14.750 -1.244 175 HH22 ARG 734 HH22 ARG 734 -4.557 -14.243 -2.092 176 H ALA 735 HN ALA 735 -0.531 -13.606 5.174 177 HA ALA 735 HA ALA 735 1.477 -15.695 5.140 178 HB1 ALA 735 HB1 ALA 735 1.751 -13.795 3.627 179 HB2 ALA 735 HB2 ALA 735 3.076 -13.888 4.785 180 HB3 ALA 735 HB3 ALA 735 1.797 -12.698 5.003 181 H ARG 736 HN ARG 736 -0.278 -13.953 7.462 182 HA ARG 736 HA ARG 736 -0.199 -13.727 9.618 183 HB2 ARG 736 HB2 ARG 736 1.886 -15.911 9.530 184 HB3 ARG 736 HB1 ARG 736 0.995 -15.305 10.931 185 HG2 ARG 736 HG2 ARG 736 -1.098 -16.029 9.971 186 HG3 ARG 736 HG1 ARG 736 -0.254 -16.613 8.538 187 HD2 ARG 736 HD2 ARG 736 0.103 -17.612 11.350 188 HD3 ARG 736 HD1 ARG 736 -0.786 -18.428 10.061 189 HE ARG 736 HE ARG 736 2.102 -18.020 10.209 190 HH11 ARG 736 HH11 ARG 736 -0.700 -19.595 8.703 191 HH12 ARG 736 HH12 ARG 736 0.206 -20.761 7.887 192 HH21 ARG 736 HH21 ARG 736 3.348 -19.592 9.064 193 HH22 ARG 736 HH22 ARG 736 2.592 -20.770 8.080 194 H ALA 737 HN ALA 737 0.480 -11.632 9.593 195 HA ALA 737 HA ALA 737 1.784 -9.835 10.047 196 HB1 ALA 737 HB1 ALA 737 1.655 -10.887 12.243 197 HB2 ALA 737 HB2 ALA 737 3.155 -9.985 12.024 198 HB3 ALA 737 HB3 ALA 737 3.155 -11.750 11.915 199 H LYS 738 HN LYS 738 2.673 -11.566 8.030 200 HA LYS 738 HA LYS 738 5.559 -11.520 7.886 201 HB2 LYS 738 HB2 LYS 738 4.227 -12.926 6.359 202 HB3 LYS 738 HB1 LYS 738 3.665 -11.440 5.572 203 HG2 LYS 738 HG2 LYS 738 5.910 -10.917 4.842 204 HG3 LYS 738 HG1 LYS 738 6.553 -12.308 5.716 205 HD2 LYS 738 HD2 LYS 738 5.264 -13.792 4.264 206 HD3 LYS 738 HD1 LYS 738 4.636 -12.390 3.393 207 HE2 LYS 738 HE2 LYS 738 6.498 -13.394 2.180 208 HE3 LYS 738 HE1 LYS 738 6.869 -11.763 2.752 209 HZ1 LYS 738 HZ1 LYS 738 8.704 -13.434 3.086 210 HZ2 LYS 738 HZ2 LYS 738 7.719 -14.212 4.222 211 HZ3 LYS 738 HZ3 LYS 738 8.239 -12.655 4.500 212 H TRP 739 HN TRP 739 3.122 -9.416 6.617 213 HA TRP 739 HA TRP 739 4.957 -7.401 5.843 214 HB2 TRP 739 HB2 TRP 739 2.138 -6.758 6.391 215 HB3 TRP 739 HB1 TRP 739 3.136 -6.371 4.996 216 HD1 TRP 739 HD1 TRP 739 3.073 -8.041 2.984 217 HE1 TRP 739 HE1 TRP 739 1.516 -10.048 2.411 218 HE3 TRP 739 HE3 TRP 739 0.917 -8.698 7.427 219 HZ2 TRP 739 HZ2 TRP 739 -0.371 -11.630 3.670 220 HZ3 TRP 739 HZ3 TRP 739 -0.776 -10.461 7.699 221 HH2 TRP 739 HH2 TRP 739 -1.392 -11.867 5.890 222 H ASP 740 HN ASP 740 2.435 -7.783 8.367 223 HA ASP 740 HA ASP 740 2.103 -6.761 10.439 224 HB2 ASP 740 HB2 ASP 740 4.228 -8.246 10.714 225 HB3 ASP 740 HB1 ASP 740 5.109 -6.711 10.709 226 H THR 741 HN THR 741 2.214 -5.052 8.274 227 HA THR 741 HA THR 741 4.050 -2.961 8.319 228 HB THR 741 HB THR 741 2.658 -3.506 6.390 229 HG1 THR 741 HG1 THR 741 3.544 -1.479 6.383 230 HG21 THR 741 HG21 THR 741 0.530 -3.943 7.504 231 HG22 THR 741 HG22 THR 741 0.320 -2.712 6.256 232 HG23 THR 741 HG23 THR 741 0.398 -2.241 7.952 233 H ALA 742 HN ALA 742 1.200 -3.373 10.173 234 HA ALA 742 HA ALA 742 0.886 -0.596 10.899 235 HB1 ALA 742 HB1 ALA 742 -1.034 -2.112 10.864 236 HB2 ALA 742 HB2 ALA 742 -0.823 -1.368 12.448 237 HB3 ALA 742 HB3 ALA 742 -0.322 -3.041 12.184 238 H ASN 743 HN ASN 743 3.287 -2.639 11.659 239 HA ASN 743 HA ASN 743 3.600 -1.493 14.312 240 HB2 ASN 743 HB2 ASN 743 4.474 -4.275 13.569 241 HB3 ASN 743 HB1 ASN 743 4.406 -3.562 15.171 242 HD21 ASN 743 HD21 ASN 743 2.633 -4.844 12.588 243 HD22 ASN 743 HD22 ASN 743 1.154 -5.230 13.400 244 H ASN 744 HN ASN 744 5.411 -3.605 12.104 245 HA ASN 744 HA ASN 744 7.491 -1.564 11.911 246 HB2 ASN 744 HB2 ASN 744 9.176 -3.498 11.724 247 HB3 ASN 744 HB1 ASN 744 8.450 -3.314 13.310 248 HD21 ASN 744 HD21 ASN 744 8.570 -5.235 10.414 249 HD22 ASN 744 HD22 ASN 744 7.805 -6.628 11.088 250 HA PRO 745 HA PRO 745 7.312 -1.855 7.518 251 HB2 PRO 745 HB2 PRO 745 9.730 -2.463 6.492 252 HB3 PRO 745 HB1 PRO 745 9.434 -0.942 7.350 253 HG2 PRO 745 HG2 PRO 745 10.666 -3.474 8.364 254 HG3 PRO 745 HG1 PRO 745 11.233 -1.823 8.604 255 HD2 PRO 745 HD2 PRO 745 9.856 -3.183 10.445 256 HD3 PRO 745 HD1 PRO 745 9.712 -1.431 10.282 257 H LEU 746 HN LEU 746 9.217 -4.647 8.467 258 HA LEU 746 HA LEU 746 7.500 -6.376 6.858 259 HB2 LEU 746 HB2 LEU 746 9.643 -7.711 6.372 260 HB3 LEU 746 HB1 LEU 746 9.309 -6.289 5.400 261 HG LEU 746 HG LEU 746 11.018 -5.787 7.772 262 HD11 LEU 746 HD11 LEU 746 11.869 -7.956 7.184 263 HD12 LEU 746 HD12 LEU 746 13.024 -6.708 6.733 264 HD13 LEU 746 HD13 LEU 746 12.022 -7.480 5.492 265 HD21 LEU 746 HD21 LEU 746 10.536 -4.112 6.142 266 HD22 LEU 746 HD22 LEU 746 11.246 -5.099 4.852 267 HD23 LEU 746 HD23 LEU 746 12.261 -4.473 6.170 268 H PTR 747 HN PTR 747 10.468 -7.249 8.507 269 HA PTR 747 HA PTR 747 9.541 -7.771 10.996 270 HB2 PTR 747 HB2 PTR 747 9.327 -10.186 11.047 271 HB3 PTR 747 HB1 PTR 747 8.049 -9.436 10.130 272 HD1 PTR 747 HD1 PTR 747 8.319 -9.481 7.498 273 HD2 PTR 747 HD2 PTR 747 10.512 -12.047 10.090 274 HE1 PTR 747 HE1 PTR 747 8.703 -11.030 5.625 275 HE2 PTR 747 HE2 PTR 747 10.915 -13.598 8.222 276 H LYS 748 HN LYS 748 11.512 -6.924 11.479 277 HA LYS 748 HA LYS 748 13.704 -8.812 11.181 278 HB2 LYS 748 HB2 LYS 748 15.226 -6.761 11.027 279 HB3 LYS 748 HB1 LYS 748 14.291 -7.168 9.601 280 HG2 LYS 748 HG2 LYS 748 14.219 -4.768 9.841 281 HG3 LYS 748 HG1 LYS 748 12.636 -5.408 10.280 282 HD2 LYS 748 HD2 LYS 748 12.951 -5.010 12.535 283 HD3 LYS 748 HD1 LYS 748 14.699 -4.908 12.390 284 HE2 LYS 748 HE2 LYS 748 14.457 -2.781 11.163 285 HE3 LYS 748 HE1 LYS 748 12.705 -2.904 11.303 286 HZ1 LYS 748 HZ1 LYS 748 12.863 -2.679 13.659 287 HZ2 LYS 748 HZ2 LYS 748 13.738 -1.411 12.995 288 HZ3 LYS 748 HZ3 LYS 748 14.541 -2.746 13.647 289 H GLU 749 HN GLU 749 11.692 -7.924 13.286 290 HA GLU 749 HA GLU 749 13.596 -7.708 15.434 291 HB2 GLU 749 HB2 GLU 749 12.366 -5.822 16.459 292 HB3 GLU 749 HB1 GLU 749 13.274 -5.383 15.018 293 HG2 GLU 749 HG2 GLU 749 11.159 -5.471 13.733 294 HG3 GLU 749 HG1 GLU 749 10.300 -5.833 15.228 295 H ALA 750 HN ALA 750 10.091 -7.698 14.648 296 HA ALA 750 HA ALA 750 9.658 -9.935 16.353 297 HB1 ALA 750 HB1 ALA 750 8.141 -8.850 17.928 298 HB2 ALA 750 HB2 ALA 750 8.482 -7.285 17.186 299 HB3 ALA 750 HB3 ALA 750 9.761 -8.156 18.034 300 H THR 751 HN THR 751 8.542 -11.005 14.874 301 HA THR 751 HA THR 751 6.163 -9.710 13.761 302 HB THR 751 HB THR 751 7.541 -10.356 11.923 303 HG1 THR 751 HG1 THR 751 5.640 -10.943 11.220 304 HG21 THR 751 HG21 THR 751 7.806 -13.085 13.197 305 HG22 THR 751 HG22 THR 751 9.050 -11.820 13.053 306 HG23 THR 751 HG23 THR 751 8.431 -12.605 11.605 307 H SER 752 HN SER 752 4.298 -11.347 13.357 308 HA SER 752 HA SER 752 4.067 -12.887 15.848 309 HB2 SER 752 HB2 SER 752 2.001 -11.114 14.571 310 HB3 SER 752 HB1 SER 752 1.707 -12.050 16.005 311 HG SER 752 HG SER 752 3.417 -9.842 15.636 312 H THR 753 HN THR 753 2.257 -14.477 15.849 313 HA THR 753 HA THR 753 0.895 -15.303 13.610 314 HB THR 753 HB THR 753 3.018 -15.948 12.572 315 HG1 THR 753 HG1 THR 753 2.641 -18.302 12.475 316 HG21 THR 753 HG21 THR 753 3.511 -17.633 15.048 317 HG22 THR 753 HG22 THR 753 4.410 -16.187 14.586 318 HG23 THR 753 HG23 THR 753 4.511 -17.642 13.594 319 H PHE 754 HN PHE 754 -0.713 -16.532 14.335 320 HA PHE 754 HA PHE 754 -0.666 -17.385 17.092 321 HB2 PHE 754 HB2 PHE 754 -3.071 -17.998 16.677 322 HB3 PHE 754 HB1 PHE 754 -2.689 -16.304 16.361 323 HD1 PHE 754 HD1 PHE 754 -2.255 -15.700 13.883 324 HD2 PHE 754 HD2 PHE 754 -4.183 -19.261 15.120 325 HE1 PHE 754 HE1 PHE 754 -3.252 -15.930 11.661 326 HE2 PHE 754 HE2 PHE 754 -5.175 -19.494 12.894 327 HZ PHE 754 HZ PHE 754 -4.710 -17.829 11.162 328 H THR 755 HN THR 755 -1.418 -19.035 14.030 329 HA THR 755 HA THR 755 -1.644 -21.076 13.486 330 HB THR 755 HB THR 755 0.380 -22.491 13.739 331 HG1 THR 755 HG1 THR 755 0.803 -20.963 15.781 332 HG21 THR 755 HG21 THR 755 0.636 -19.654 12.941 333 HG22 THR 755 HG22 THR 755 0.027 -20.963 11.940 334 HG23 THR 755 HG23 THR 755 1.763 -20.910 12.390 335 H ASN 756 HN ASN 756 -3.363 -21.827 14.498 336 HA ASN 756 HA ASN 756 -3.051 -24.058 16.205 337 HB2 ASN 756 HB2 ASN 756 -4.675 -23.122 17.934 338 HB3 ASN 756 HB1 ASN 756 -3.009 -22.515 18.062 339 HD21 ASN 756 HD21 ASN 756 -2.676 -20.422 17.276 340 HD22 ASN 756 HD22 ASN 756 -4.028 -19.313 17.246 341 H ILE 757 HN ILE 757 -5.245 -21.716 15.090 342 HA ILE 757 HA ILE 757 -7.180 -23.795 14.206 343 HB ILE 757 HB ILE 757 -8.520 -21.903 13.415 344 HG12 ILE 757 HG12 ILE 757 -6.505 -20.169 14.856 345 HG13 ILE 757 HG11 ILE 757 -6.662 -20.304 13.115 346 HG21 ILE 757 HG21 ILE 757 -8.959 -22.868 15.618 347 HG22 ILE 757 HG22 ILE 757 -9.237 -21.128 15.676 348 HG23 ILE 757 HG23 ILE 757 -7.754 -21.807 16.348 349 HD11 ILE 757 HD11 ILE 757 -8.909 -19.390 13.252 350 HD12 ILE 757 HD12 ILE 757 -7.696 -18.298 13.931 351 HD13 ILE 757 HD13 ILE 757 -8.740 -19.242 15.004 352 H THR 758 HN THR 758 -4.505 -22.606 13.161 353 HA THR 758 HA THR 758 -5.095 -22.191 10.403 354 HB THR 758 HB THR 758 -2.503 -23.016 11.557 355 HG1 THR 758 HG1 THR 758 -3.531 -20.374 11.170 356 HG21 THR 758 HG21 THR 758 -1.548 -21.679 9.665 357 HG22 THR 758 HG22 THR 758 -3.196 -21.356 9.123 358 HG23 THR 758 HG23 THR 758 -2.577 -23.007 9.127 359 H TYR 759 HN TYR 759 -6.338 -24.048 10.341 360 HA TYR 759 HA TYR 759 -5.317 -26.705 10.330 361 HB2 TYR 759 HB2 TYR 759 -7.411 -26.831 8.488 362 HB3 TYR 759 HB1 TYR 759 -7.538 -27.103 10.219 363 HD1 TYR 759 HD1 TYR 759 -7.855 -24.337 7.586 364 HD2 TYR 759 HD2 TYR 759 -8.921 -25.688 11.540 365 HE1 TYR 759 HE1 TYR 759 -9.348 -22.555 7.771 366 HE2 TYR 759 HE2 TYR 759 -10.484 -23.817 11.701 367 HH TYR 759 HH TYR 759 -10.890 -21.688 10.761 368 H ARG 760 HN ARG 760 -6.581 -25.449 7.340 369 HA ARG 760 HA ARG 760 -4.119 -26.264 6.025 370 HB2 ARG 760 HB2 ARG 760 -5.383 -26.340 4.002 371 HB3 ARG 760 HB1 ARG 760 -6.138 -27.214 5.345 372 HG2 ARG 760 HG2 ARG 760 -7.751 -25.532 5.642 373 HG3 ARG 760 HG1 ARG 760 -6.972 -24.502 4.431 374 HD2 ARG 760 HD2 ARG 760 -7.280 -26.183 2.803 375 HD3 ARG 760 HD1 ARG 760 -8.067 -27.207 4.006 376 HE ARG 760 HE ARG 760 -9.760 -25.349 4.197 377 HH11 ARG 760 HH11 ARG 760 -8.019 -25.929 1.151 378 HH12 ARG 760 HH12 ARG 760 -9.230 -25.322 0.138 379 HH21 ARG 760 HH21 ARG 760 -11.495 -24.496 2.804 380 HH22 ARG 760 HH22 ARG 760 -11.282 -24.516 1.109 381 H GLY 761 HN GLY 761 -5.399 -23.700 7.347 382 HA2 GLY 761 HA2 GLY 761 -4.630 -21.511 7.334 383 HA3 GLY 761 HA1 GLY 761 -3.717 -21.853 5.853 384 H THR 762 HN THR 762 -6.890 -21.265 7.164 385 HA THR 762 HA THR 762 -7.716 -20.362 4.517 386 HB THR 762 HB THR 762 -9.504 -21.370 6.742 387 HG1 THR 762 HG1 THR 762 -8.357 -22.659 4.478 388 HG21 THR 762 HG21 THR 762 -11.139 -21.580 4.951 389 HG22 THR 762 HG22 THR 762 -9.977 -20.917 3.792 390 HG23 THR 762 HG23 THR 762 -10.600 -19.906 5.109 Start of MODEL 6 1 H LYS 716 HT1 LYS 716 2.911 1.701 3.669 2 HA LYS 716 HA LYS 716 3.689 1.618 1.456 3 HB2 LYS 716 HB2 LYS 716 6.039 2.102 1.911 4 HB3 LYS 716 HB1 LYS 716 4.957 2.777 3.139 5 HG2 LYS 716 HG2 LYS 716 5.536 1.001 4.669 6 HG3 LYS 716 HG1 LYS 716 6.558 0.249 3.445 7 HD2 LYS 716 HD2 LYS 716 8.020 2.183 3.446 8 HD3 LYS 716 HD1 LYS 716 6.965 3.000 4.604 9 HE2 LYS 716 HE2 LYS 716 7.424 1.295 6.261 10 HE3 LYS 716 HE1 LYS 716 8.411 0.404 5.102 11 HZ1 LYS 716 HZ1 LYS 716 9.974 2.214 5.059 12 HZ2 LYS 716 HZ2 LYS 716 9.707 1.747 6.667 13 HZ3 LYS 716 HZ3 LYS 716 8.976 3.143 6.072 14 H LEU 717 HN LEU 717 3.667 -1.393 2.848 15 HA LEU 717 HA LEU 717 5.826 -2.562 1.417 16 HB2 LEU 717 HB2 LEU 717 3.497 -3.854 2.843 17 HB3 LEU 717 HB1 LEU 717 4.893 -4.700 2.219 18 HG LEU 717 HG LEU 717 5.185 -4.555 4.522 19 HD11 LEU 717 HD11 LEU 717 7.215 -4.119 3.326 20 HD12 LEU 717 HD12 LEU 717 7.197 -3.185 4.826 21 HD13 LEU 717 HD13 LEU 717 6.860 -2.392 3.290 22 HD21 LEU 717 HD21 LEU 717 3.554 -2.842 5.059 23 HD22 LEU 717 HD22 LEU 717 4.619 -1.595 4.403 24 HD23 LEU 717 HD23 LEU 717 5.094 -2.495 5.840 25 H LEU 718 HN LEU 718 2.495 -3.734 1.286 26 HA LEU 718 HA LEU 718 2.647 -3.571 -1.647 27 HB2 LEU 718 HB2 LEU 718 1.334 -5.789 -0.062 28 HB3 LEU 718 HB1 LEU 718 1.333 -5.647 -1.803 29 HG LEU 718 HG LEU 718 3.700 -6.233 -0.032 30 HD11 LEU 718 HD11 LEU 718 2.241 -8.124 -0.342 31 HD12 LEU 718 HD12 LEU 718 3.749 -8.362 -1.226 32 HD13 LEU 718 HD13 LEU 718 2.283 -7.899 -2.090 33 HD21 LEU 718 HD21 LEU 718 3.603 -5.899 -3.036 34 HD22 LEU 718 HD22 LEU 718 5.000 -6.442 -2.106 35 HD23 LEU 718 HD23 LEU 718 4.388 -4.801 -1.900 36 H ILE 719 HN ILE 719 -0.016 -4.548 0.602 37 HA ILE 719 HA ILE 719 -1.654 -2.735 -0.849 38 HB ILE 719 HB ILE 719 -3.378 -3.913 0.880 39 HG12 ILE 719 HG12 ILE 719 -1.344 -5.325 1.735 40 HG13 ILE 719 HG11 ILE 719 -2.882 -6.128 1.441 41 HG21 ILE 719 HG21 ILE 719 -3.660 -3.797 -1.508 42 HG22 ILE 719 HG22 ILE 719 -3.968 -5.440 -0.939 43 HG23 ILE 719 HG23 ILE 719 -2.446 -5.055 -1.738 44 HD11 ILE 719 HD11 ILE 719 -1.002 -7.450 0.608 45 HD12 ILE 719 HD12 ILE 719 -0.507 -6.113 -0.434 46 HD13 ILE 719 HD13 ILE 719 -2.043 -6.933 -0.721 47 H THR 720 HN THR 720 -0.673 -3.370 2.545 48 HA THR 720 HA THR 720 -0.738 -2.106 4.389 49 HB THR 720 HB THR 720 -0.757 0.326 2.550 50 HG1 THR 720 HG1 THR 720 0.999 -0.551 1.746 51 HG21 THR 720 HG21 THR 720 0.524 -0.183 5.255 52 HG22 THR 720 HG22 THR 720 -0.934 0.771 4.978 53 HG23 THR 720 HG23 THR 720 0.614 1.325 4.343 54 H ILE 721 HN ILE 721 -3.141 -3.091 3.766 55 HA ILE 721 HA ILE 721 -5.040 -1.062 4.544 56 HB ILE 721 HB ILE 721 -6.667 -1.891 2.803 57 HG12 ILE 721 HG12 ILE 721 -4.219 -2.684 1.239 58 HG13 ILE 721 HG11 ILE 721 -5.146 -3.909 2.063 59 HG21 ILE 721 HG21 ILE 721 -5.878 -0.346 1.051 60 HG22 ILE 721 HG22 ILE 721 -4.302 -0.286 1.839 61 HG23 ILE 721 HG23 ILE 721 -5.731 0.335 2.673 62 HD11 ILE 721 HD11 ILE 721 -5.732 -3.810 -0.240 63 HD12 ILE 721 HD12 ILE 721 -6.064 -2.076 -0.134 64 HD13 ILE 721 HD13 ILE 721 -7.101 -3.235 0.712 65 H HIS 722 HN HIS 722 -4.492 -4.450 3.567 66 HA HIS 722 HA HIS 722 -6.811 -5.179 5.216 67 HB2 HIS 722 HB2 HIS 722 -6.427 -5.818 2.652 68 HB3 HIS 722 HB1 HIS 722 -5.520 -7.129 3.414 69 HD1 HIS 722 HD1 HIS 722 -8.766 -6.354 2.199 70 HD2 HIS 722 HD2 HIS 722 -7.247 -8.414 5.433 71 HE1 HIS 722 HE1 HIS 722 -10.636 -7.835 2.967 72 HE2 HIS 722 HE2 HIS 722 -9.745 -9.017 4.998 73 H ASP 723 HN ASP 723 -3.461 -5.267 4.985 74 HA ASP 723 HA ASP 723 -2.729 -7.488 6.416 75 HB2 ASP 723 HB2 ASP 723 -0.901 -5.774 7.227 76 HB3 ASP 723 HB1 ASP 723 -0.945 -6.360 5.566 77 H ARG 724 HN ARG 724 -3.755 -4.316 7.457 78 HA ARG 724 HA ARG 724 -3.292 -4.665 10.164 79 HB2 ARG 724 HB2 ARG 724 -4.405 -2.712 8.453 80 HB3 ARG 724 HB1 ARG 724 -5.589 -3.019 9.712 81 HG2 ARG 724 HG2 ARG 724 -2.726 -2.219 10.099 82 HG3 ARG 724 HG1 ARG 724 -4.157 -1.212 10.323 83 HD2 ARG 724 HD2 ARG 724 -4.928 -2.827 12.060 84 HD3 ARG 724 HD1 ARG 724 -3.417 -3.680 11.827 85 HE ARG 724 HE ARG 724 -2.614 -1.127 12.351 86 HH11 ARG 724 HH11 ARG 724 -4.631 -3.453 14.100 87 HH12 ARG 724 HH12 ARG 724 -4.118 -2.951 15.641 88 HH21 ARG 724 HH21 ARG 724 -1.929 -0.425 14.528 89 HH22 ARG 724 HH22 ARG 724 -2.591 -1.201 15.890 90 H LYS 725 HN LYS 725 -5.701 -5.920 8.065 91 HA LYS 725 HA LYS 725 -7.521 -6.268 10.234 92 HB2 LYS 725 HB2 LYS 725 -7.800 -6.750 7.277 93 HB3 LYS 725 HB1 LYS 725 -8.975 -7.418 8.390 94 HG2 LYS 725 HG2 LYS 725 -9.827 -5.348 7.519 95 HG3 LYS 725 HG1 LYS 725 -9.413 -5.114 9.224 96 HD2 LYS 725 HD2 LYS 725 -7.346 -4.023 8.565 97 HD3 LYS 725 HD1 LYS 725 -7.713 -4.319 6.867 98 HE2 LYS 725 HE2 LYS 725 -9.397 -2.658 8.742 99 HE3 LYS 725 HE1 LYS 725 -8.246 -2.012 7.574 100 HZ1 LYS 725 HZ1 LYS 725 -10.694 -3.599 6.910 101 HZ2 LYS 725 HZ2 LYS 725 -9.566 -3.030 5.800 102 HZ3 LYS 725 HZ3 LYS 725 -10.478 -1.938 6.693 103 H GLU 726 HN GLU 726 -5.226 -8.152 8.390 104 HA GLU 726 HA GLU 726 -6.248 -10.594 9.456 105 HB2 GLU 726 HB2 GLU 726 -4.187 -11.608 8.452 106 HB3 GLU 726 HB1 GLU 726 -5.332 -10.758 7.399 107 HG2 GLU 726 HG2 GLU 726 -3.771 -8.788 7.547 108 HG3 GLU 726 HG1 GLU 726 -2.598 -9.906 8.246 109 H PHE 727 HN PHE 727 -4.537 -8.189 10.580 110 HA PHE 727 HA PHE 727 -3.459 -9.784 12.819 111 HB2 PHE 727 HB2 PHE 727 -3.484 -6.783 12.639 112 HB3 PHE 727 HB1 PHE 727 -2.506 -7.828 13.663 113 HD1 PHE 727 HD2 PHE 727 -1.531 -9.789 11.672 114 HD2 PHE 727 HD1 PHE 727 -1.963 -5.571 11.424 115 HE1 PHE 727 HE2 PHE 727 0.219 -9.712 9.952 116 HE2 PHE 727 HE1 PHE 727 -0.246 -5.471 9.729 117 HZ PHE 727 HZ PHE 727 0.867 -7.559 8.969 118 H ALA 728 HN ALA 728 -6.309 -8.768 11.960 119 HA ALA 728 HA ALA 728 -7.215 -8.173 14.711 120 HB1 ALA 728 HB1 ALA 728 -7.660 -6.329 13.162 121 HB2 ALA 728 HB2 ALA 728 -9.164 -7.043 13.748 122 HB3 ALA 728 HB3 ALA 728 -8.583 -7.419 12.127 123 H LYS 729 HN LYS 729 -8.224 -9.754 11.725 124 HA LYS 729 HA LYS 729 -9.915 -11.594 13.288 125 HB2 LYS 729 HB2 LYS 729 -9.756 -11.262 10.271 126 HB3 LYS 729 HB1 LYS 729 -10.855 -12.329 11.116 127 HG2 LYS 729 HG2 LYS 729 -12.172 -10.507 10.549 128 HG3 LYS 729 HG1 LYS 729 -11.751 -10.194 12.232 129 HD2 LYS 729 HD2 LYS 729 -10.023 -8.652 11.547 130 HD3 LYS 729 HD1 LYS 729 -10.311 -9.037 9.849 131 HE2 LYS 729 HE2 LYS 729 -12.257 -7.778 11.747 132 HE3 LYS 729 HE1 LYS 729 -11.319 -6.943 10.498 133 HZ1 LYS 729 HZ1 LYS 729 -12.426 -8.359 8.837 134 HZ2 LYS 729 HZ2 LYS 729 -13.520 -7.372 9.613 135 HZ3 LYS 729 HZ3 LYS 729 -13.428 -9.013 10.023 136 H PHE 730 HN PHE 730 -7.054 -11.369 11.411 137 HA PHE 730 HA PHE 730 -5.348 -12.755 10.930 138 HB2 PHE 730 HB2 PHE 730 -6.387 -14.661 13.039 139 HB3 PHE 730 HB1 PHE 730 -4.742 -14.382 12.440 140 HD1 PHE 730 HD2 PHE 730 -7.450 -13.059 14.481 141 HD2 PHE 730 HD1 PHE 730 -3.397 -12.657 13.343 142 HE1 PHE 730 HE2 PHE 730 -7.172 -11.534 16.238 143 HE2 PHE 730 HE1 PHE 730 -3.046 -11.067 15.165 144 HZ PHE 730 HZ PHE 730 -4.921 -10.476 16.658 145 H GLU 731 HN GLU 731 -8.087 -13.174 9.786 146 HA GLU 731 HA GLU 731 -7.620 -15.843 8.645 147 HB2 GLU 731 HB2 GLU 731 -10.237 -14.466 9.123 148 HB3 GLU 731 HB1 GLU 731 -9.969 -15.979 8.261 149 HG2 GLU 731 HG2 GLU 731 -8.982 -16.883 10.381 150 HG3 GLU 731 HG1 GLU 731 -9.512 -15.412 11.172 151 H GLU 732 HN GLU 732 -7.078 -13.012 7.941 152 HA GLU 732 HA GLU 732 -8.530 -12.718 5.401 153 HB2 GLU 732 HB2 GLU 732 -6.444 -10.770 6.434 154 HB3 GLU 732 HB1 GLU 732 -7.697 -10.510 5.230 155 HG2 GLU 732 HG2 GLU 732 -8.026 -10.927 8.155 156 HG3 GLU 732 HG1 GLU 732 -8.139 -9.425 7.232 157 H GLU 733 HN GLU 733 -5.122 -11.857 6.025 158 HA GLU 733 HA GLU 733 -3.248 -12.266 5.040 159 HB2 GLU 733 HB2 GLU 733 -4.408 -14.830 4.258 160 HB3 GLU 733 HB1 GLU 733 -2.706 -14.332 4.357 161 HG2 GLU 733 HG2 GLU 733 -2.759 -14.161 6.656 162 HG3 GLU 733 HG1 GLU 733 -4.504 -14.415 6.745 163 H ARG 734 HN ARG 734 -3.769 -10.755 3.597 164 HA ARG 734 HA ARG 734 -4.369 -11.473 0.856 165 HB2 ARG 734 HB2 ARG 734 -2.740 -9.086 1.714 166 HB3 ARG 734 HB1 ARG 734 -3.606 -9.295 0.197 167 HG2 ARG 734 HG2 ARG 734 -4.766 -8.959 2.934 168 HG3 ARG 734 HG1 ARG 734 -4.821 -7.817 1.587 169 HD2 ARG 734 HD2 ARG 734 -6.006 -10.569 1.505 170 HD3 ARG 734 HD1 ARG 734 -6.912 -9.137 1.986 171 HE ARG 734 HE ARG 734 -5.658 -8.772 -0.558 172 HH11 ARG 734 HH11 ARG 734 -8.468 -10.346 0.980 173 HH12 ARG 734 HH12 ARG 734 -9.378 -10.375 -0.442 174 HH21 ARG 734 HH21 ARG 734 -6.925 -8.832 -2.502 175 HH22 ARG 734 HH22 ARG 734 -8.488 -9.496 -2.460 176 H ALA 735 HN ALA 735 -1.536 -11.287 2.819 177 HA ALA 735 HA ALA 735 -0.154 -12.940 0.874 178 HB1 ALA 735 HB1 ALA 735 0.595 -10.664 0.388 179 HB2 ALA 735 HB2 ALA 735 1.910 -11.635 1.054 180 HB3 ALA 735 HB3 ALA 735 1.079 -10.461 2.070 181 H ARG 736 HN ARG 736 -1.400 -12.896 3.799 182 HA ARG 736 HA ARG 736 -1.196 -14.118 5.592 183 HB2 ARG 736 HB2 ARG 736 1.141 -15.384 4.141 184 HB3 ARG 736 HB1 ARG 736 0.521 -15.730 5.771 185 HG2 ARG 736 HG2 ARG 736 -0.348 -17.381 4.159 186 HG3 ARG 736 HG1 ARG 736 -1.631 -16.402 4.862 187 HD2 ARG 736 HD2 ARG 736 -1.415 -14.933 2.799 188 HD3 ARG 736 HD1 ARG 736 -0.426 -16.224 2.120 189 HE ARG 736 HE ARG 736 -2.959 -17.070 3.153 190 HH11 ARG 736 HH11 ARG 736 -1.194 -15.936 0.259 191 HH12 ARG 736 HH12 ARG 736 -2.400 -16.479 -0.833 192 HH21 ARG 736 HH21 ARG 736 -4.543 -17.815 1.629 193 HH22 ARG 736 HH22 ARG 736 -4.327 -17.580 -0.062 194 H ALA 737 HN ALA 737 -0.628 -11.825 6.314 195 HA ALA 737 HA ALA 737 0.585 -10.358 7.621 196 HB1 ALA 737 HB1 ALA 737 1.694 -12.910 8.780 197 HB2 ALA 737 HB2 ALA 737 0.178 -12.145 9.245 198 HB3 ALA 737 HB3 ALA 737 1.709 -11.329 9.555 199 H LYS 738 HN LYS 738 1.766 -11.573 5.315 200 HA LYS 738 HA LYS 738 4.499 -11.919 5.081 201 HB2 LYS 738 HB2 LYS 738 2.940 -11.915 3.174 202 HB3 LYS 738 HB1 LYS 738 2.895 -10.164 3.234 203 HG2 LYS 738 HG2 LYS 738 4.340 -10.759 1.484 204 HG3 LYS 738 HG1 LYS 738 5.364 -10.204 2.808 205 HD2 LYS 738 HD2 LYS 738 5.808 -12.501 3.441 206 HD3 LYS 738 HD1 LYS 738 4.742 -13.074 2.155 207 HE2 LYS 738 HE2 LYS 738 6.180 -12.072 0.497 208 HE3 LYS 738 HE1 LYS 738 7.223 -11.426 1.763 209 HZ1 LYS 738 HZ1 LYS 738 8.239 -13.326 1.000 210 HZ2 LYS 738 HZ2 LYS 738 6.832 -14.256 0.994 211 HZ3 LYS 738 HZ3 LYS 738 7.546 -13.764 2.479 212 H TRP 739 HN TRP 739 2.961 -8.779 4.837 213 HA TRP 739 HA TRP 739 5.396 -7.339 4.895 214 HB2 TRP 739 HB2 TRP 739 2.970 -5.902 5.620 215 HB3 TRP 739 HB1 TRP 739 4.131 -5.598 4.337 216 HD1 TRP 739 HD1 TRP 739 3.413 -6.246 1.980 217 HE1 TRP 739 HE1 TRP 739 1.273 -7.297 0.948 218 HE3 TRP 739 HE3 TRP 739 1.156 -7.736 6.183 219 HZ2 TRP 739 HZ2 TRP 739 -1.021 -8.545 1.805 220 HZ3 TRP 739 HZ3 TRP 739 -1.056 -8.870 6.047 221 HH2 TRP 739 HH2 TRP 739 -2.139 -9.258 3.907 222 H ASP 740 HN ASP 740 2.728 -7.907 7.126 223 HA ASP 740 HA ASP 740 2.284 -7.234 9.252 224 HB2 ASP 740 HB2 ASP 740 4.179 -8.911 9.631 225 HB3 ASP 740 HB1 ASP 740 5.202 -7.448 9.757 226 H THR 741 HN THR 741 1.706 -5.223 8.785 227 HA THR 741 HA THR 741 3.663 -3.207 8.311 228 HB THR 741 HB THR 741 0.704 -2.773 8.519 229 HG1 THR 741 HG1 THR 741 0.411 -3.644 6.621 230 HG21 THR 741 HG21 THR 741 1.156 -1.147 6.771 231 HG22 THR 741 HG22 THR 741 2.854 -1.629 6.764 232 HG23 THR 741 HG23 THR 741 2.166 -0.829 8.188 233 H ALA 742 HN ALA 742 1.593 -4.185 10.982 234 HA ALA 742 HA ALA 742 2.240 -1.655 12.338 235 HB1 ALA 742 HB1 ALA 742 -0.064 -1.673 11.537 236 HB2 ALA 742 HB2 ALA 742 0.042 -1.589 13.299 237 HB3 ALA 742 HB3 ALA 742 -0.367 -3.115 12.508 238 H ASN 743 HN ASN 743 3.216 -4.638 12.594 239 HA ASN 743 HA ASN 743 2.880 -4.630 15.503 240 HB2 ASN 743 HB2 ASN 743 3.410 -7.177 14.006 241 HB3 ASN 743 HB1 ASN 743 2.707 -6.958 15.598 242 HD21 ASN 743 HD21 ASN 743 2.242 -6.751 12.323 243 HD22 ASN 743 HD22 ASN 743 0.522 -6.874 12.181 244 H ASN 744 HN ASN 744 4.944 -6.320 13.125 245 HA ASN 744 HA ASN 744 7.243 -5.239 14.547 246 HB2 ASN 744 HB2 ASN 744 8.472 -7.380 14.292 247 HB3 ASN 744 HB1 ASN 744 6.991 -7.667 15.184 248 HD21 ASN 744 HD21 ASN 744 7.531 -7.437 11.682 249 HD22 ASN 744 HD22 ASN 744 6.951 -9.024 11.340 250 HA PRO 745 HA PRO 745 9.105 -3.749 10.851 251 HB2 PRO 745 HB2 PRO 745 11.444 -5.115 10.410 252 HB3 PRO 745 HB1 PRO 745 11.249 -3.905 11.684 253 HG2 PRO 745 HG2 PRO 745 11.013 -6.901 11.902 254 HG3 PRO 745 HG1 PRO 745 11.883 -5.813 12.949 255 HD2 PRO 745 HD2 PRO 745 9.554 -6.716 13.644 256 HD3 PRO 745 HD1 PRO 745 9.957 -5.022 13.954 257 H LEU 746 HN LEU 746 9.791 -7.183 10.633 258 HA LEU 746 HA LEU 746 8.558 -7.236 7.986 259 HB2 LEU 746 HB2 LEU 746 10.218 -9.150 7.543 260 HB3 LEU 746 HB1 LEU 746 10.819 -7.504 7.476 261 HG LEU 746 HG LEU 746 11.165 -8.591 10.139 262 HD11 LEU 746 HD11 LEU 746 11.243 -10.744 9.049 263 HD12 LEU 746 HD12 LEU 746 12.851 -10.276 9.597 264 HD13 LEU 746 HD13 LEU 746 12.427 -10.145 7.885 265 HD21 LEU 746 HD21 LEU 746 12.314 -6.672 9.271 266 HD22 LEU 746 HD22 LEU 746 13.123 -7.674 8.049 267 HD23 LEU 746 HD23 LEU 746 13.436 -7.930 9.776 268 H PTR 747 HN PTR 747 9.887 -9.728 10.100 269 HA PTR 747 HA PTR 747 7.708 -10.404 11.494 270 HB2 PTR 747 HB2 PTR 747 6.875 -12.395 10.487 271 HB3 PTR 747 HB1 PTR 747 6.570 -11.047 9.453 272 HD1 PTR 747 HD1 PTR 747 7.794 -14.375 9.428 273 HD2 PTR 747 HD2 PTR 747 8.372 -10.623 7.525 274 HE1 PTR 747 HE1 PTR 747 8.843 -15.510 7.519 275 HE2 PTR 747 HE2 PTR 747 9.417 -11.741 5.619 276 H LYS 748 HN LYS 748 9.211 -10.572 12.993 277 HA LYS 748 HA LYS 748 10.977 -12.907 12.822 278 HB2 LYS 748 HB2 LYS 748 12.755 -11.473 14.014 279 HB3 LYS 748 HB1 LYS 748 12.498 -11.192 12.301 280 HG2 LYS 748 HG2 LYS 748 12.665 -9.028 13.216 281 HG3 LYS 748 HG1 LYS 748 10.932 -9.284 13.037 282 HD2 LYS 748 HD2 LYS 748 10.897 -8.527 15.174 283 HD3 LYS 748 HD1 LYS 748 11.286 -10.210 15.545 284 HE2 LYS 748 HE2 LYS 748 13.262 -7.964 15.204 285 HE3 LYS 748 HE1 LYS 748 12.732 -8.614 16.753 286 HZ1 LYS 748 HZ1 LYS 748 14.853 -9.538 16.171 287 HZ2 LYS 748 HZ2 LYS 748 14.369 -10.011 14.670 288 HZ3 LYS 748 HZ3 LYS 748 13.763 -10.809 16.038 289 H GLU 749 HN GLU 749 8.446 -12.059 14.324 290 HA GLU 749 HA GLU 749 9.312 -13.236 16.806 291 HB2 GLU 749 HB2 GLU 749 8.034 -11.568 18.143 292 HB3 GLU 749 HB1 GLU 749 9.543 -10.974 17.461 293 HG2 GLU 749 HG2 GLU 749 8.245 -9.854 15.694 294 HG3 GLU 749 HG1 GLU 749 6.759 -10.445 16.435 295 H ALA 750 HN ALA 750 6.534 -11.958 14.996 296 HA ALA 750 HA ALA 750 5.133 -14.405 15.564 297 HB1 ALA 750 HB1 ALA 750 4.024 -11.756 16.467 298 HB2 ALA 750 HB2 ALA 750 4.613 -13.044 17.519 299 HB3 ALA 750 HB3 ALA 750 3.186 -13.306 16.516 300 H THR 751 HN THR 751 4.522 -14.954 13.605 301 HA THR 751 HA THR 751 3.555 -12.913 11.758 302 HB THR 751 HB THR 751 3.636 -15.840 11.077 303 HG1 THR 751 HG1 THR 751 5.809 -14.160 11.664 304 HG21 THR 751 HG21 THR 751 4.332 -14.934 8.888 305 HG22 THR 751 HG22 THR 751 4.355 -13.313 9.593 306 HG23 THR 751 HG23 THR 751 2.828 -14.184 9.442 307 H SER 752 HN SER 752 1.369 -13.241 10.713 308 HA SER 752 HA SER 752 -0.404 -14.702 12.538 309 HB2 SER 752 HB2 SER 752 -1.155 -12.452 10.794 310 HB3 SER 752 HB1 SER 752 -2.085 -13.117 12.114 311 HG SER 752 HG SER 752 0.314 -11.581 12.316 312 H THR 753 HN THR 753 -0.659 -16.515 11.530 313 HA THR 753 HA THR 753 -1.827 -16.452 8.907 314 HB THR 753 HB THR 753 -0.424 -18.442 8.290 315 HG1 THR 753 HG1 THR 753 0.681 -17.860 10.746 316 HG21 THR 753 HG21 THR 753 -0.100 -16.257 7.254 317 HG22 THR 753 HG22 THR 753 1.450 -17.065 7.468 318 HG23 THR 753 HG23 THR 753 0.968 -15.774 8.570 319 H PHE 754 HN PHE 754 -3.284 -17.901 8.655 320 HA PHE 754 HA PHE 754 -3.704 -19.907 10.786 321 HB2 PHE 754 HB2 PHE 754 -6.055 -19.784 10.475 322 HB3 PHE 754 HB1 PHE 754 -5.473 -18.125 10.715 323 HD1 PHE 754 HD1 PHE 754 -5.078 -16.797 8.473 324 HD2 PHE 754 HD2 PHE 754 -7.476 -20.295 8.794 325 HE1 PHE 754 HE1 PHE 754 -6.194 -16.180 6.476 326 HE2 PHE 754 HE2 PHE 754 -8.637 -19.675 6.723 327 HZ PHE 754 HZ PHE 754 -8.009 -17.619 5.539 328 H THR 755 HN THR 755 -3.473 -19.271 7.426 329 HA THR 755 HA THR 755 -4.598 -21.616 6.434 330 HB THR 755 HB THR 755 -4.121 -19.763 4.941 331 HG1 THR 755 HG1 THR 755 -4.038 -21.932 4.073 332 HG21 THR 755 HG21 THR 755 -1.807 -19.204 4.264 333 HG22 THR 755 HG22 THR 755 -1.197 -20.311 5.504 334 HG23 THR 755 HG23 THR 755 -2.132 -18.881 5.964 335 H ASN 756 HN ASN 756 -1.452 -20.945 7.728 336 HA ASN 756 HA ASN 756 -0.319 -23.544 7.125 337 HB2 ASN 756 HB2 ASN 756 1.522 -22.926 8.517 338 HB3 ASN 756 HB1 ASN 756 1.078 -21.534 7.457 339 HD21 ASN 756 HD21 ASN 756 -1.178 -20.960 9.390 340 HD22 ASN 756 HD22 ASN 756 -0.321 -20.260 10.735 341 H ILE 757 HN ILE 757 -2.535 -22.554 9.138 342 HA ILE 757 HA ILE 757 -3.721 -23.408 10.900 343 HB ILE 757 HB ILE 757 -2.255 -25.982 10.217 344 HG12 ILE 757 HG12 ILE 757 -3.371 -24.521 8.476 345 HG13 ILE 757 HG11 ILE 757 -3.797 -26.233 8.381 346 HG21 ILE 757 HG21 ILE 757 -4.292 -27.083 11.076 347 HG22 ILE 757 HG22 ILE 757 -4.984 -25.510 11.477 348 HG23 ILE 757 HG23 ILE 757 -3.563 -26.090 12.340 349 HD11 ILE 757 HD11 ILE 757 -5.306 -23.867 9.464 350 HD12 ILE 757 HD12 ILE 757 -5.887 -25.524 9.666 351 HD13 ILE 757 HD13 ILE 757 -5.728 -24.828 8.046 352 H THR 758 HN THR 758 -1.000 -22.335 11.302 353 HA THR 758 HA THR 758 -0.550 -23.276 14.047 354 HB THR 758 HB THR 758 1.112 -21.434 12.419 355 HG1 THR 758 HG1 THR 758 1.230 -24.272 12.738 356 HG21 THR 758 HG21 THR 758 2.917 -22.106 14.015 357 HG22 THR 758 HG22 THR 758 1.728 -23.085 14.879 358 HG23 THR 758 HG23 THR 758 1.540 -21.331 14.798 359 H TYR 759 HN TYR 759 -2.183 -22.293 14.772 360 HA TYR 759 HA TYR 759 -2.483 -19.376 14.491 361 HB2 TYR 759 HB2 TYR 759 -4.776 -19.967 15.728 362 HB3 TYR 759 HB1 TYR 759 -4.575 -20.152 13.991 363 HD1 TYR 759 HD1 TYR 759 -4.644 -22.046 17.211 364 HD2 TYR 759 HD2 TYR 759 -4.748 -22.310 12.964 365 HE1 TYR 759 HE1 TYR 759 -5.261 -24.386 17.384 366 HE2 TYR 759 HE2 TYR 759 -5.375 -24.676 13.135 367 HH TYR 759 HH TYR 759 -5.113 -26.560 14.836 368 H ARG 760 HN ARG 760 -2.873 -21.775 17.027 369 HA ARG 760 HA ARG 760 -1.920 -19.778 18.977 370 HB2 ARG 760 HB2 ARG 760 -3.575 -22.226 19.533 371 HB3 ARG 760 HB1 ARG 760 -3.183 -20.927 20.640 372 HG2 ARG 760 HG2 ARG 760 -4.806 -20.535 18.164 373 HG3 ARG 760 HG1 ARG 760 -5.490 -20.994 19.728 374 HD2 ARG 760 HD2 ARG 760 -4.354 -18.932 20.654 375 HD3 ARG 760 HD1 ARG 760 -4.003 -18.491 18.980 376 HE ARG 760 HE ARG 760 -6.750 -19.088 19.434 377 HH11 ARG 760 HH11 ARG 760 -4.299 -16.503 19.616 378 HH12 ARG 760 HH12 ARG 760 -5.461 -15.249 19.546 379 HH21 ARG 760 HH21 ARG 760 -8.300 -17.321 19.370 380 HH22 ARG 760 HH22 ARG 760 -7.745 -15.711 19.433 381 H GLY 761 HN GLY 761 -2.272 -23.273 18.685 382 HA2 GLY 761 HA2 GLY 761 -0.667 -24.892 18.818 383 HA3 GLY 761 HA1 GLY 761 0.556 -23.684 19.236 384 H THR 762 HN THR 762 -2.596 -24.454 20.650 385 HA THR 762 HA THR 762 -1.241 -24.767 23.208 386 HB THR 762 HB THR 762 -2.761 -22.934 23.411 387 HG1 THR 762 HG1 THR 762 -3.081 -23.968 25.229 388 HG21 THR 762 HG21 THR 762 -4.109 -23.326 21.407 389 HG22 THR 762 HG22 THR 762 -5.145 -23.051 22.809 390 HG23 THR 762 HG23 THR 762 -4.901 -24.690 22.197 Start of MODEL 7 1 H LYS 716 HT1 LYS 716 0.879 -0.657 1.229 2 HA LYS 716 HA LYS 716 2.439 0.926 -0.687 3 HB2 LYS 716 HB2 LYS 716 4.009 1.400 1.239 4 HB3 LYS 716 HB1 LYS 716 2.456 2.209 1.333 5 HG2 LYS 716 HG2 LYS 716 1.695 0.472 2.917 6 HG3 LYS 716 HG1 LYS 716 3.305 -0.243 2.856 7 HD2 LYS 716 HD2 LYS 716 3.112 1.171 4.824 8 HD3 LYS 716 HD1 LYS 716 4.251 1.892 3.685 9 HE2 LYS 716 HE2 LYS 716 2.527 3.430 2.913 10 HE3 LYS 716 HE1 LYS 716 1.348 2.670 3.977 11 HZ1 LYS 716 HZ1 LYS 716 3.784 4.153 4.852 12 HZ2 LYS 716 HZ2 LYS 716 2.664 3.394 5.879 13 HZ3 LYS 716 HZ3 LYS 716 2.184 4.700 4.929 14 H LEU 717 HN LEU 717 2.269 -2.056 1.292 15 HA LEU 717 HA LEU 717 4.704 -2.919 0.093 16 HB2 LEU 717 HB2 LEU 717 2.772 -4.260 1.964 17 HB3 LEU 717 HB1 LEU 717 4.243 -4.993 1.367 18 HG LEU 717 HG LEU 717 4.709 -4.313 3.481 19 HD11 LEU 717 HD11 LEU 717 6.497 -3.711 1.980 20 HD12 LEU 717 HD12 LEU 717 6.415 -2.519 3.278 21 HD13 LEU 717 HD13 LEU 717 5.762 -2.136 1.684 22 HD21 LEU 717 HD21 LEU 717 4.327 -2.054 4.415 23 HD22 LEU 717 HD22 LEU 717 2.846 -2.904 3.979 24 HD23 LEU 717 HD23 LEU 717 3.474 -1.632 2.929 25 H LEU 718 HN LEU 718 1.700 -4.804 0.444 26 HA LEU 718 HA LEU 718 1.922 -5.410 -2.442 27 HB2 LEU 718 HB2 LEU 718 1.005 -7.334 -0.313 28 HB3 LEU 718 HB1 LEU 718 1.096 -7.674 -2.022 29 HG LEU 718 HG LEU 718 3.402 -7.222 -0.138 30 HD11 LEU 718 HD11 LEU 718 3.989 -9.525 -0.692 31 HD12 LEU 718 HD12 LEU 718 2.522 -9.651 -1.670 32 HD13 LEU 718 HD13 LEU 718 2.405 -9.396 0.073 33 HD21 LEU 718 HD21 LEU 718 4.856 -7.696 -2.052 34 HD22 LEU 718 HD22 LEU 718 3.900 -6.231 -2.309 35 HD23 LEU 718 HD23 LEU 718 3.442 -7.739 -3.104 36 H ILE 719 HN ILE 719 -0.565 -6.023 0.116 37 HA ILE 719 HA ILE 719 -2.528 -5.517 -1.947 38 HB ILE 719 HB ILE 719 -4.161 -6.469 -0.241 39 HG12 ILE 719 HG12 ILE 719 -1.603 -7.257 1.161 40 HG13 ILE 719 HG11 ILE 719 -2.756 -6.066 1.749 41 HG21 ILE 719 HG21 ILE 719 -1.903 -8.208 -1.196 42 HG22 ILE 719 HG22 ILE 719 -3.343 -7.764 -2.112 43 HG23 ILE 719 HG23 ILE 719 -3.488 -8.770 -0.671 44 HD11 ILE 719 HD11 ILE 719 -3.314 -8.987 1.306 45 HD12 ILE 719 HD12 ILE 719 -4.463 -7.790 1.909 46 HD13 ILE 719 HD13 ILE 719 -3.033 -8.198 2.858 47 H THR 720 HN THR 720 -1.590 -4.243 1.227 48 HA THR 720 HA THR 720 -2.109 -2.313 2.302 49 HB THR 720 HB THR 720 -3.309 -1.259 -0.293 50 HG1 THR 720 HG1 THR 720 -1.445 -1.739 -1.132 51 HG21 THR 720 HG21 THR 720 -3.452 0.201 1.697 52 HG22 THR 720 HG22 THR 720 -2.364 0.882 0.488 53 HG23 THR 720 HG23 THR 720 -1.706 0.072 1.912 54 H ILE 721 HN ILE 721 -4.214 -4.486 1.765 55 HA ILE 721 HA ILE 721 -6.579 -2.940 2.621 56 HB ILE 721 HB ILE 721 -7.994 -4.797 1.565 57 HG12 ILE 721 HG12 ILE 721 -5.405 -5.354 0.089 58 HG13 ILE 721 HG11 ILE 721 -6.108 -6.454 1.260 59 HG21 ILE 721 HG21 ILE 721 -7.896 -3.805 -0.680 60 HG22 ILE 721 HG22 ILE 721 -6.379 -3.011 -0.248 61 HG23 ILE 721 HG23 ILE 721 -7.867 -2.587 0.596 62 HD11 ILE 721 HD11 ILE 721 -8.066 -6.709 -0.217 63 HD12 ILE 721 HD12 ILE 721 -6.559 -7.171 -1.015 64 HD13 ILE 721 HD13 ILE 721 -7.309 -5.620 -1.377 65 H HIS 722 HN HIS 722 -5.169 -6.191 2.737 66 HA HIS 722 HA HIS 722 -6.242 -6.355 5.444 67 HB2 HIS 722 HB2 HIS 722 -5.587 -8.437 3.418 68 HB3 HIS 722 HB1 HIS 722 -5.348 -8.810 5.125 69 HD1 HIS 722 HD1 HIS 722 -7.942 -8.650 2.515 70 HD2 HIS 722 HD2 HIS 722 -7.717 -8.563 6.638 71 HE1 HIS 722 HE1 HIS 722 -10.235 -9.153 3.294 72 HE2 HIS 722 HE2 HIS 722 -10.029 -9.399 5.769 73 H ASP 723 HN ASP 723 -3.807 -5.314 3.885 74 HA ASP 723 HA ASP 723 -1.406 -6.421 4.712 75 HB2 ASP 723 HB2 ASP 723 -1.905 -4.521 3.053 76 HB3 ASP 723 HB1 ASP 723 -1.964 -3.491 4.477 77 H ARG 724 HN ARG 724 -3.539 -4.047 6.260 78 HA ARG 724 HA ARG 724 -1.860 -4.005 8.608 79 HB2 ARG 724 HB2 ARG 724 -2.739 -2.034 7.060 80 HB3 ARG 724 HB1 ARG 724 -4.168 -2.229 8.026 81 HG2 ARG 724 HG2 ARG 724 -1.423 -1.686 9.150 82 HG3 ARG 724 HG1 ARG 724 -2.695 -0.519 8.716 83 HD2 ARG 724 HD2 ARG 724 -4.203 -1.524 10.351 84 HD3 ARG 724 HD1 ARG 724 -2.963 -2.729 10.722 85 HE ARG 724 HE ARG 724 -1.916 -0.166 11.119 86 HH11 ARG 724 HH11 ARG 724 -4.277 -2.385 12.575 87 HH12 ARG 724 HH12 ARG 724 -4.067 -1.790 14.161 88 HH21 ARG 724 HH21 ARG 724 -1.631 0.641 13.328 89 HH22 ARG 724 HH22 ARG 724 -2.530 -0.051 14.601 90 H LYS 725 HN LYS 725 -4.657 -5.509 7.310 91 HA LYS 725 HA LYS 725 -6.372 -4.895 9.524 92 HB2 LYS 725 HB2 LYS 725 -7.137 -4.833 7.152 93 HB3 LYS 725 HB1 LYS 725 -6.899 -6.575 7.107 94 HG2 LYS 725 HG2 LYS 725 -8.525 -6.911 8.756 95 HG3 LYS 725 HG1 LYS 725 -8.677 -5.152 8.985 96 HD2 LYS 725 HD2 LYS 725 -9.285 -6.580 6.389 97 HD3 LYS 725 HD1 LYS 725 -10.520 -6.157 7.580 98 HE2 LYS 725 HE2 LYS 725 -8.684 -4.216 6.174 99 HE3 LYS 725 HE1 LYS 725 -10.373 -4.513 5.760 100 HZ1 LYS 725 HZ1 LYS 725 -9.352 -3.376 8.313 101 HZ2 LYS 725 HZ2 LYS 725 -10.963 -3.779 8.013 102 HZ3 LYS 725 HZ3 LYS 725 -10.214 -2.563 7.098 103 H GLU 726 HN GLU 726 -4.413 -7.484 8.431 104 HA GLU 726 HA GLU 726 -5.730 -9.398 10.087 105 HB2 GLU 726 HB2 GLU 726 -3.746 -10.858 9.556 106 HB3 GLU 726 HB1 GLU 726 -4.792 -10.248 8.263 107 HG2 GLU 726 HG2 GLU 726 -2.983 -8.432 7.953 108 HG3 GLU 726 HG1 GLU 726 -1.970 -9.539 8.880 109 H PHE 727 HN PHE 727 -3.803 -6.989 10.674 110 HA PHE 727 HA PHE 727 -2.723 -8.058 13.203 111 HB2 PHE 727 HB2 PHE 727 -2.721 -5.174 12.338 112 HB3 PHE 727 HB1 PHE 727 -1.719 -5.952 13.550 113 HD1 PHE 727 HD2 PHE 727 -0.783 -8.333 12.083 114 HD2 PHE 727 HD1 PHE 727 -1.272 -4.317 10.807 115 HE1 PHE 727 HE2 PHE 727 0.924 -8.675 10.354 116 HE2 PHE 727 HE1 PHE 727 0.406 -4.634 9.091 117 HZ PHE 727 HZ PHE 727 1.527 -6.827 8.851 118 H ALA 728 HN ALA 728 -5.574 -7.319 12.281 119 HA ALA 728 HA ALA 728 -6.353 -5.930 14.752 120 HB1 ALA 728 HB1 ALA 728 -7.015 -4.771 12.703 121 HB2 ALA 728 HB2 ALA 728 -8.418 -5.289 13.642 122 HB3 ALA 728 HB3 ALA 728 -7.937 -6.189 12.202 123 H LYS 729 HN LYS 729 -7.366 -8.568 12.594 124 HA LYS 729 HA LYS 729 -8.825 -9.695 14.871 125 HB2 LYS 729 HB2 LYS 729 -9.088 -10.430 11.927 126 HB3 LYS 729 HB1 LYS 729 -10.049 -11.096 13.229 127 HG2 LYS 729 HG2 LYS 729 -11.424 -9.508 12.134 128 HG3 LYS 729 HG1 LYS 729 -10.907 -8.734 13.629 129 HD2 LYS 729 HD2 LYS 729 -9.192 -7.501 12.407 130 HD3 LYS 729 HD1 LYS 729 -9.652 -8.319 10.915 131 HE2 LYS 729 HE2 LYS 729 -11.466 -6.594 12.562 132 HE3 LYS 729 HE1 LYS 729 -10.530 -6.038 11.166 133 HZ1 LYS 729 HZ1 LYS 729 -12.568 -8.219 11.053 134 HZ2 LYS 729 HZ2 LYS 729 -11.727 -7.587 9.764 135 HZ3 LYS 729 HZ3 LYS 729 -12.865 -6.631 10.580 136 H PHE 730 HN PHE 730 -6.246 -10.265 12.585 137 HA PHE 730 HA PHE 730 -4.586 -11.754 12.454 138 HB2 PHE 730 HB2 PHE 730 -5.327 -12.715 15.230 139 HB3 PHE 730 HB1 PHE 730 -3.784 -12.794 14.358 140 HD1 PHE 730 HD2 PHE 730 -6.160 -10.604 16.050 141 HD2 PHE 730 HD1 PHE 730 -2.263 -11.010 14.466 142 HE1 PHE 730 HE2 PHE 730 -5.598 -8.594 17.104 143 HE2 PHE 730 HE1 PHE 730 -1.599 -8.918 15.553 144 HZ PHE 730 HZ PHE 730 -3.249 -7.663 16.902 145 H GLU 731 HN GLU 731 -7.264 -12.377 11.752 146 HA GLU 731 HA GLU 731 -7.123 -15.327 11.795 147 HB2 GLU 731 HB2 GLU 731 -9.590 -13.626 11.891 148 HB3 GLU 731 HB1 GLU 731 -9.568 -15.378 11.705 149 HG2 GLU 731 HG2 GLU 731 -8.327 -15.490 13.858 150 HG3 GLU 731 HG1 GLU 731 -8.577 -13.775 14.027 151 H GLU 732 HN GLU 732 -7.148 -12.621 9.932 152 HA GLU 732 HA GLU 732 -8.169 -13.992 7.587 153 HB2 GLU 732 HB2 GLU 732 -7.558 -11.732 6.404 154 HB3 GLU 732 HB1 GLU 732 -8.958 -11.808 7.451 155 HG2 GLU 732 HG2 GLU 732 -6.281 -10.807 8.449 156 HG3 GLU 732 HG1 GLU 732 -7.462 -9.758 7.660 157 H GLU 733 HN GLU 733 -5.219 -11.824 7.506 158 HA GLU 733 HA GLU 733 -3.231 -12.114 6.704 159 HB2 GLU 733 HB2 GLU 733 -3.593 -14.913 7.510 160 HB3 GLU 733 HB1 GLU 733 -2.097 -14.080 7.077 161 HG2 GLU 733 HG2 GLU 733 -2.196 -12.649 8.982 162 HG3 GLU 733 HG1 GLU 733 -3.789 -13.259 9.439 163 H ARG 734 HN ARG 734 -3.778 -11.679 4.868 164 HA ARG 734 HA ARG 734 -4.259 -13.670 2.823 165 HB2 ARG 734 HB2 ARG 734 -3.357 -10.836 2.426 166 HB3 ARG 734 HB1 ARG 734 -4.076 -11.900 1.220 167 HG2 ARG 734 HG2 ARG 734 -5.395 -10.811 3.676 168 HG3 ARG 734 HG1 ARG 734 -5.722 -10.370 1.998 169 HD2 ARG 734 HD2 ARG 734 -5.994 -13.140 3.068 170 HD3 ARG 734 HD1 ARG 734 -7.314 -11.970 3.079 171 HE ARG 734 HE ARG 734 -6.427 -11.979 0.500 172 HH11 ARG 734 HH11 ARG 734 -7.569 -14.563 2.656 173 HH12 ARG 734 HH12 ARG 734 -8.169 -15.545 1.426 174 HH21 ARG 734 HH21 ARG 734 -7.254 -13.360 -1.237 175 HH22 ARG 734 HH22 ARG 734 -7.994 -14.846 -0.841 176 H ALA 735 HN ALA 735 -1.490 -11.931 4.050 177 HA ALA 735 HA ALA 735 0.135 -13.853 2.581 178 HB1 ALA 735 HB1 ALA 735 0.405 -11.636 1.608 179 HB2 ALA 735 HB2 ALA 735 1.895 -12.194 2.373 180 HB3 ALA 735 HB3 ALA 735 0.880 -11.002 3.184 181 H ARG 736 HN ARG 736 -1.032 -13.303 5.492 182 HA ARG 736 HA ARG 736 -0.486 -14.182 7.540 183 HB2 ARG 736 HB2 ARG 736 0.505 -16.025 6.070 184 HB3 ARG 736 HB1 ARG 736 1.987 -15.062 6.201 185 HG2 ARG 736 HG2 ARG 736 2.064 -15.452 8.598 186 HG3 ARG 736 HG1 ARG 736 0.581 -16.407 8.501 187 HD2 ARG 736 HD2 ARG 736 2.623 -17.803 8.582 188 HD3 ARG 736 HD1 ARG 736 1.673 -18.052 7.116 189 HE ARG 736 HE ARG 736 3.481 -16.157 6.378 190 HH11 ARG 736 HH11 ARG 736 3.870 -19.325 7.896 191 HH12 ARG 736 HH12 ARG 736 5.372 -19.636 7.129 192 HH21 ARG 736 HH21 ARG 736 5.512 -16.617 5.336 193 HH22 ARG 736 HH22 ARG 736 6.328 -18.067 5.640 194 H ALA 737 HN ALA 737 -0.029 -11.602 7.304 195 HA ALA 737 HA ALA 737 1.054 -9.756 8.207 196 HB1 ALA 737 HB1 ALA 737 2.428 -11.818 9.908 197 HB2 ALA 737 HB2 ALA 737 0.867 -11.072 10.254 198 HB3 ALA 737 HB3 ALA 737 2.334 -10.092 10.242 199 H LYS 738 HN LYS 738 2.189 -11.321 6.175 200 HA LYS 738 HA LYS 738 4.945 -11.552 5.905 201 HB2 LYS 738 HB2 LYS 738 3.443 -12.166 4.094 202 HB3 LYS 738 HB1 LYS 738 3.089 -10.458 3.835 203 HG2 LYS 738 HG2 LYS 738 4.581 -11.119 2.109 204 HG3 LYS 738 HG1 LYS 738 5.512 -10.143 3.243 205 HD2 LYS 738 HD2 LYS 738 6.438 -12.173 4.238 206 HD3 LYS 738 HD1 LYS 738 5.463 -13.163 3.146 207 HE2 LYS 738 HE2 LYS 738 6.619 -12.018 1.234 208 HE3 LYS 738 HE1 LYS 738 7.697 -11.276 2.415 209 HZ1 LYS 738 HZ1 LYS 738 8.447 -13.514 3.063 210 HZ2 LYS 738 HZ2 LYS 738 8.661 -13.245 1.432 211 HZ3 LYS 738 HZ3 LYS 738 7.375 -14.198 1.938 212 H TRP 739 HN TRP 739 3.154 -8.652 5.031 213 HA TRP 739 HA TRP 739 5.477 -7.136 4.468 214 HB2 TRP 739 HB2 TRP 739 3.018 -5.672 5.070 215 HB3 TRP 739 HB1 TRP 739 4.043 -5.630 3.645 216 HD1 TRP 739 HD1 TRP 739 3.215 -6.925 1.599 217 HE1 TRP 739 HE1 TRP 739 1.038 -8.383 1.102 218 HE3 TRP 739 HE3 TRP 739 1.390 -7.371 6.230 219 HZ2 TRP 739 HZ2 TRP 739 -1.023 -9.445 2.447 220 HZ3 TRP 739 HZ3 TRP 739 -0.716 -8.608 6.584 221 HH2 TRP 739 HH2 TRP 739 -1.894 -9.628 4.690 222 H ASP 740 HN ASP 740 2.934 -6.743 6.884 223 HA ASP 740 HA ASP 740 2.824 -5.779 8.937 224 HB2 ASP 740 HB2 ASP 740 4.564 -7.407 9.572 225 HB3 ASP 740 HB1 ASP 740 5.786 -6.270 9.035 226 H THR 741 HN THR 741 2.357 -3.821 9.071 227 HA THR 741 HA THR 741 4.354 -1.802 8.393 228 HB THR 741 HB THR 741 2.556 -2.220 6.718 229 HG1 THR 741 HG1 THR 741 3.773 -0.290 6.816 230 HG21 THR 741 HG21 THR 741 0.848 -0.814 8.779 231 HG22 THR 741 HG22 THR 741 0.636 -2.456 8.166 232 HG23 THR 741 HG23 THR 741 0.362 -1.076 7.101 233 H ALA 742 HN ALA 742 2.829 -3.143 10.766 234 HA ALA 742 HA ALA 742 2.340 -0.641 12.257 235 HB1 ALA 742 HB1 ALA 742 0.353 -2.896 12.215 236 HB2 ALA 742 HB2 ALA 742 0.179 -1.358 11.371 237 HB3 ALA 742 HB3 ALA 742 0.216 -1.399 13.134 238 H ASN 743 HN ASN 743 3.923 -3.522 12.298 239 HA ASN 743 HA ASN 743 3.778 -3.641 15.223 240 HB2 ASN 743 HB2 ASN 743 4.612 -5.953 13.471 241 HB3 ASN 743 HB1 ASN 743 4.157 -5.989 15.165 242 HD21 ASN 743 HD21 ASN 743 3.099 -5.656 12.006 243 HD22 ASN 743 HD22 ASN 743 1.443 -6.110 12.147 244 H ASN 744 HN ASN 744 5.983 -4.832 12.670 245 HA ASN 744 HA ASN 744 8.097 -3.233 13.826 246 HB2 ASN 744 HB2 ASN 744 9.661 -5.181 13.775 247 HB3 ASN 744 HB1 ASN 744 8.355 -5.439 14.917 248 HD21 ASN 744 HD21 ASN 744 8.448 -5.879 11.426 249 HD22 ASN 744 HD22 ASN 744 8.039 -7.548 11.476 250 HA PRO 745 HA PRO 745 9.638 -2.331 9.748 251 HB2 PRO 745 HB2 PRO 745 12.012 -3.613 9.279 252 HB3 PRO 745 HB1 PRO 745 11.858 -2.220 10.359 253 HG2 PRO 745 HG2 PRO 745 11.860 -5.146 11.066 254 HG3 PRO 745 HG1 PRO 745 12.767 -3.856 11.820 255 HD2 PRO 745 HD2 PRO 745 10.595 -4.745 12.921 256 HD3 PRO 745 HD1 PRO 745 10.913 -3.005 12.896 257 H LEU 746 HN LEU 746 10.484 -5.727 10.087 258 HA LEU 746 HA LEU 746 9.128 -6.303 7.549 259 HB2 LEU 746 HB2 LEU 746 10.768 -8.268 7.478 260 HB3 LEU 746 HB1 LEU 746 11.397 -6.678 7.095 261 HG LEU 746 HG LEU 746 11.720 -7.229 9.919 262 HD11 LEU 746 HD11 LEU 746 12.974 -9.215 8.023 263 HD12 LEU 746 HD12 LEU 746 11.771 -9.549 9.280 264 HD13 LEU 746 HD13 LEU 746 13.381 -9.008 9.730 265 HD21 LEU 746 HD21 LEU 746 13.692 -6.755 7.703 266 HD22 LEU 746 HD22 LEU 746 13.995 -6.696 9.455 267 HD23 LEU 746 HD23 LEU 746 12.892 -5.537 8.714 268 H PTR 747 HN PTR 747 10.495 -8.402 10.000 269 HA PTR 747 HA PTR 747 8.351 -8.770 11.558 270 HB2 PTR 747 HB2 PTR 747 7.448 -10.866 10.959 271 HB3 PTR 747 HB1 PTR 747 7.162 -9.727 9.696 272 HD1 PTR 747 HD1 PTR 747 8.471 -12.980 10.435 273 HD2 PTR 747 HD2 PTR 747 8.662 -9.830 7.594 274 HE1 PTR 747 HE1 PTR 747 9.338 -14.547 8.773 275 HE2 PTR 747 HE2 PTR 747 9.538 -11.389 5.925 276 H LYS 748 HN LYS 748 9.749 -8.748 13.103 277 HA LYS 748 HA LYS 748 11.365 -11.125 13.452 278 HB2 LYS 748 HB2 LYS 748 13.347 -9.583 14.060 279 HB3 LYS 748 HB1 LYS 748 13.010 -9.900 12.364 280 HG2 LYS 748 HG2 LYS 748 13.400 -7.612 12.379 281 HG3 LYS 748 HG1 LYS 748 11.643 -7.691 12.478 282 HD2 LYS 748 HD2 LYS 748 12.309 -6.088 14.068 283 HD3 LYS 748 HD1 LYS 748 11.929 -7.542 14.991 284 HE2 LYS 748 HE2 LYS 748 14.275 -8.116 15.116 285 HE3 LYS 748 HE1 LYS 748 14.665 -6.728 14.093 286 HZ1 LYS 748 HZ1 LYS 748 15.098 -6.150 16.378 287 HZ2 LYS 748 HZ2 LYS 748 13.576 -6.646 16.863 288 HZ3 LYS 748 HZ3 LYS 748 13.735 -5.291 15.871 289 H GLU 749 HN GLU 749 9.068 -9.455 14.808 290 HA GLU 749 HA GLU 749 9.927 -10.255 17.422 291 HB2 GLU 749 HB2 GLU 749 9.228 -8.122 18.472 292 HB3 GLU 749 HB1 GLU 749 10.731 -8.007 17.561 293 HG2 GLU 749 HG2 GLU 749 9.441 -6.988 15.712 294 HG3 GLU 749 HG1 GLU 749 7.999 -7.057 16.721 295 H ALA 750 HN ALA 750 7.296 -8.662 15.597 296 HA ALA 750 HA ALA 750 5.446 -10.438 16.993 297 HB1 ALA 750 HB1 ALA 750 4.974 -7.498 16.488 298 HB2 ALA 750 HB2 ALA 750 5.311 -8.234 18.056 299 HB3 ALA 750 HB3 ALA 750 3.823 -8.630 17.196 300 H THR 751 HN THR 751 5.065 -11.762 15.326 301 HA THR 751 HA THR 751 4.045 -10.535 12.867 302 HB THR 751 HB THR 751 5.524 -13.142 13.020 303 HG1 THR 751 HG1 THR 751 6.364 -10.494 12.476 304 HG21 THR 751 HG21 THR 751 5.809 -12.767 10.592 305 HG22 THR 751 HG22 THR 751 4.888 -11.268 10.732 306 HG23 THR 751 HG23 THR 751 4.106 -12.814 11.050 307 H SER 752 HN SER 752 2.299 -11.670 11.842 308 HA SER 752 HA SER 752 0.800 -13.140 13.860 309 HB2 SER 752 HB2 SER 752 -0.182 -11.058 13.017 310 HB3 SER 752 HB1 SER 752 -0.252 -11.734 11.381 311 HG SER 752 HG SER 752 -1.798 -13.148 12.056 312 H THR 753 HN THR 753 0.027 -15.067 13.553 313 HA THR 753 HA THR 753 -0.540 -16.247 11.108 314 HB THR 753 HB THR 753 1.686 -16.594 10.622 315 HG1 THR 753 HG1 THR 753 1.787 -18.820 10.493 316 HG21 THR 753 HG21 THR 753 3.366 -17.584 12.189 317 HG22 THR 753 HG22 THR 753 2.133 -17.616 13.450 318 HG23 THR 753 HG23 THR 753 2.698 -16.072 12.810 319 H PHE 754 HN PHE 754 -2.089 -17.449 11.514 320 HA PHE 754 HA PHE 754 -2.293 -18.851 14.114 321 HB2 PHE 754 HB2 PHE 754 -4.733 -18.897 13.701 322 HB3 PHE 754 HB1 PHE 754 -4.055 -17.258 13.724 323 HD1 PHE 754 HD1 PHE 754 -3.681 -16.075 11.575 324 HD2 PHE 754 HD2 PHE 754 -5.885 -19.696 11.804 325 HE1 PHE 754 HE1 PHE 754 -4.606 -15.602 9.429 326 HE2 PHE 754 HE2 PHE 754 -6.859 -19.237 9.597 327 HZ PHE 754 HZ PHE 754 -6.234 -17.192 8.385 328 H THR 755 HN THR 755 -1.929 -19.185 10.821 329 HA THR 755 HA THR 755 -3.338 -21.545 10.230 330 HB THR 755 HB THR 755 -1.806 -21.654 8.242 331 HG1 THR 755 HG1 THR 755 -0.050 -20.479 8.267 332 HG21 THR 755 HG21 THR 755 -2.618 -19.559 7.290 333 HG22 THR 755 HG22 THR 755 -2.932 -18.982 8.932 334 HG23 THR 755 HG23 THR 755 -3.883 -20.326 8.280 335 H ASN 756 HN ASN 756 -0.479 -21.078 11.902 336 HA ASN 756 HA ASN 756 0.749 -23.603 11.439 337 HB2 ASN 756 HB2 ASN 756 2.154 -22.986 13.463 338 HB3 ASN 756 HB1 ASN 756 2.102 -21.749 12.195 339 HD21 ASN 756 HD21 ASN 756 0.826 -19.929 12.561 340 HD22 ASN 756 HD22 ASN 756 0.436 -19.521 14.200 341 H ILE 757 HN ILE 757 -1.668 -22.467 13.436 342 HA ILE 757 HA ILE 757 -1.888 -25.039 14.887 343 HB ILE 757 HB ILE 757 -3.297 -22.416 15.444 344 HG12 ILE 757 HG12 ILE 757 -0.869 -22.334 15.840 345 HG13 ILE 757 HG11 ILE 757 -1.803 -22.120 17.310 346 HG21 ILE 757 HG21 ILE 757 -4.594 -24.337 16.173 347 HG22 ILE 757 HG22 ILE 757 -3.963 -23.452 17.565 348 HG23 ILE 757 HG23 ILE 757 -3.201 -24.960 17.061 349 HD11 ILE 757 HD11 ILE 757 -0.407 -24.634 16.410 350 HD12 ILE 757 HD12 ILE 757 -1.355 -24.474 17.888 351 HD13 ILE 757 HD13 ILE 757 0.139 -23.545 17.688 352 H THR 758 HN THR 758 -3.708 -22.597 13.135 353 HA THR 758 HA THR 758 -6.027 -24.247 12.941 354 HB THR 758 HB THR 758 -5.506 -21.660 11.604 355 HG1 THR 758 HG1 THR 758 -6.321 -22.270 14.286 356 HG21 THR 758 HG21 THR 758 -7.505 -22.806 10.859 357 HG22 THR 758 HG22 THR 758 -7.979 -21.393 11.803 358 HG23 THR 758 HG23 THR 758 -8.053 -23.000 12.523 359 H TYR 759 HN TYR 759 -5.115 -25.771 11.781 360 HA TYR 759 HA TYR 759 -5.561 -25.484 8.953 361 HB2 TYR 759 HB2 TYR 759 -3.523 -26.578 8.236 362 HB3 TYR 759 HB1 TYR 759 -3.169 -25.030 9.008 363 HD1 TYR 759 HD2 TYR 759 -3.249 -26.065 11.894 364 HD2 TYR 759 HD1 TYR 759 -1.427 -27.655 8.412 365 HE1 TYR 759 HE2 TYR 759 -1.625 -27.187 13.285 366 HE2 TYR 759 HE1 TYR 759 0.237 -28.803 9.797 367 HH TYR 759 HH TYR 759 -0.111 -29.331 12.986 368 H ARG 760 HN ARG 760 -4.583 -27.625 11.481 369 HA ARG 760 HA ARG 760 -6.698 -29.462 10.607 370 HB2 ARG 760 HB2 ARG 760 -5.390 -31.398 11.218 371 HB3 ARG 760 HB1 ARG 760 -4.471 -30.433 10.074 372 HG2 ARG 760 HG2 ARG 760 -2.793 -30.957 11.616 373 HG3 ARG 760 HG1 ARG 760 -3.401 -29.455 12.269 374 HD2 ARG 760 HD2 ARG 760 -3.131 -31.135 14.034 375 HD3 ARG 760 HD1 ARG 760 -4.810 -30.641 13.837 376 HE ARG 760 HE ARG 760 -4.101 -33.011 12.364 377 HH11 ARG 760 HH11 ARG 760 -5.311 -31.779 15.509 378 HH12 ARG 760 HH12 ARG 760 -5.987 -33.261 15.950 379 HH21 ARG 760 HH21 ARG 760 -5.047 -34.991 12.993 380 HH22 ARG 760 HH22 ARG 760 -5.879 -35.135 14.500 381 H GLY 761 HN GLY 761 -4.947 -27.918 13.186 382 HA2 GLY 761 HA2 GLY 761 -6.079 -27.213 15.106 383 HA3 GLY 761 HA1 GLY 761 -7.125 -28.631 14.984 384 H THR 762 HN THR 762 -3.780 -27.639 15.569 385 HA THR 762 HA THR 762 -3.745 -29.537 17.698 386 HB THR 762 HB THR 762 -2.741 -30.881 15.937 387 HG1 THR 762 HG1 THR 762 -1.753 -31.109 17.893 388 HG21 THR 762 HG21 THR 762 -0.712 -30.186 14.718 389 HG22 THR 762 HG22 THR 762 -0.794 -28.606 15.497 390 HG23 THR 762 HG23 THR 762 -2.068 -29.108 14.383 Start of MODEL 8 1 H LYS 716 HT1 LYS 716 5.292 0.945 2.264 2 HA LYS 716 HA LYS 716 3.950 -0.976 1.753 3 HB2 LYS 716 HB2 LYS 716 4.306 -0.999 -0.674 4 HB3 LYS 716 HB1 LYS 716 4.417 0.632 -0.032 5 HG2 LYS 716 HG2 LYS 716 6.858 0.515 -0.150 6 HG3 LYS 716 HG1 LYS 716 6.726 -1.144 -0.749 7 HD2 LYS 716 HD2 LYS 716 5.584 1.285 -2.139 8 HD3 LYS 716 HD1 LYS 716 7.106 0.507 -2.570 9 HE2 LYS 716 HE2 LYS 716 5.930 -1.558 -3.088 10 HE3 LYS 716 HE1 LYS 716 4.404 -0.832 -2.582 11 HZ1 LYS 716 HZ1 LYS 716 4.657 0.786 -4.370 12 HZ2 LYS 716 HZ2 LYS 716 4.555 -0.793 -4.925 13 HZ3 LYS 716 HZ3 LYS 716 6.059 -0.002 -4.923 14 H LEU 717 HN LEU 717 3.781 -3.116 1.097 15 HA LEU 717 HA LEU 717 6.228 -4.635 0.944 16 HB2 LEU 717 HB2 LEU 717 3.954 -5.207 2.871 17 HB3 LEU 717 HB1 LEU 717 5.185 -6.369 2.463 18 HG LEU 717 HG LEU 717 5.798 -3.686 3.703 19 HD11 LEU 717 HD11 LEU 717 5.596 -6.375 4.998 20 HD12 LEU 717 HD12 LEU 717 4.471 -5.034 5.192 21 HD13 LEU 717 HD13 LEU 717 6.135 -4.882 5.772 22 HD21 LEU 717 HD21 LEU 717 7.977 -4.698 4.165 23 HD22 LEU 717 HD22 LEU 717 7.635 -4.633 2.437 24 HD23 LEU 717 HD23 LEU 717 7.474 -6.159 3.309 25 H LEU 718 HN LEU 718 2.698 -5.168 0.987 26 HA LEU 718 HA LEU 718 2.952 -6.057 -1.803 27 HB2 LEU 718 HB2 LEU 718 1.288 -7.488 0.250 28 HB3 LEU 718 HB1 LEU 718 1.298 -7.825 -1.442 29 HG LEU 718 HG LEU 718 3.705 -8.232 0.352 30 HD11 LEU 718 HD11 LEU 718 1.950 -9.841 0.829 31 HD12 LEU 718 HD12 LEU 718 3.300 -10.616 -0.001 32 HD13 LEU 718 HD13 LEU 718 1.824 -10.231 -0.886 33 HD21 LEU 718 HD21 LEU 718 4.683 -9.341 -1.593 34 HD22 LEU 718 HD22 LEU 718 4.288 -7.650 -1.932 35 HD23 LEU 718 HD23 LEU 718 3.242 -8.934 -2.538 36 H ILE 719 HN ILE 719 0.556 -5.189 0.789 37 HA ILE 719 HA ILE 719 -0.995 -3.969 -1.336 38 HB ILE 719 HB ILE 719 -2.986 -4.456 0.190 39 HG12 ILE 719 HG12 ILE 719 -1.054 -6.447 1.392 40 HG13 ILE 719 HG11 ILE 719 -1.628 -4.993 2.197 41 HG21 ILE 719 HG21 ILE 719 -2.630 -5.624 -1.892 42 HG22 ILE 719 HG22 ILE 719 -3.254 -6.719 -0.662 43 HG23 ILE 719 HG23 ILE 719 -1.539 -6.753 -1.089 44 HD11 ILE 719 HD11 ILE 719 -3.334 -7.286 1.276 45 HD12 ILE 719 HD12 ILE 719 -3.897 -5.838 2.118 46 HD13 ILE 719 HD13 ILE 719 -2.819 -6.971 2.934 47 H THR 720 HN THR 720 -0.016 -3.805 2.080 48 HA THR 720 HA THR 720 -0.070 -2.128 3.650 49 HB THR 720 HB THR 720 0.026 -0.120 1.366 50 HG1 THR 720 HG1 THR 720 2.176 -1.642 2.427 51 HG21 THR 720 HG21 THR 720 1.408 -0.229 4.066 52 HG22 THR 720 HG22 THR 720 -0.011 0.750 3.684 53 HG23 THR 720 HG23 THR 720 1.529 1.083 2.891 54 H ILE 721 HN ILE 721 -2.637 -3.061 2.782 55 HA ILE 721 HA ILE 721 -4.287 -0.692 3.190 56 HB ILE 721 HB ILE 721 -5.963 -1.646 1.536 57 HG12 ILE 721 HG12 ILE 721 -3.523 -3.003 0.422 58 HG13 ILE 721 HG11 ILE 721 -4.747 -3.931 1.255 59 HG21 ILE 721 HG21 ILE 721 -3.374 -0.529 0.469 60 HG22 ILE 721 HG22 ILE 721 -4.732 0.397 1.102 61 HG23 ILE 721 HG23 ILE 721 -4.916 -0.530 -0.387 62 HD11 ILE 721 HD11 ILE 721 -5.033 -4.123 -1.121 63 HD12 ILE 721 HD12 ILE 721 -5.020 -2.372 -1.320 64 HD13 ILE 721 HD13 ILE 721 -6.368 -3.158 -0.494 65 H HIS 722 HN HIS 722 -4.282 -4.247 2.936 66 HA HIS 722 HA HIS 722 -6.436 -4.212 4.914 67 HB2 HIS 722 HB2 HIS 722 -6.308 -5.490 2.446 68 HB3 HIS 722 HB1 HIS 722 -5.916 -6.717 3.667 69 HD1 HIS 722 HD1 HIS 722 -8.719 -5.164 2.020 70 HD2 HIS 722 HD2 HIS 722 -7.924 -6.773 5.729 71 HE1 HIS 722 HE1 HIS 722 -10.969 -5.614 3.013 72 HE2 HIS 722 HE2 HIS 722 -10.489 -6.882 5.089 73 H ASP 723 HN ASP 723 -3.232 -4.544 4.555 74 HA ASP 723 HA ASP 723 -2.612 -6.958 5.794 75 HB2 ASP 723 HB2 ASP 723 -0.365 -6.054 6.035 76 HB3 ASP 723 HB1 ASP 723 -1.007 -5.643 4.453 77 H ARG 724 HN ARG 724 -3.146 -3.745 7.037 78 HA ARG 724 HA ARG 724 -2.524 -4.505 9.701 79 HB2 ARG 724 HB2 ARG 724 -2.616 -2.169 8.316 80 HB3 ARG 724 HB1 ARG 724 -4.122 -2.105 9.210 81 HG2 ARG 724 HG2 ARG 724 -1.377 -2.463 10.370 82 HG3 ARG 724 HG1 ARG 724 -2.377 -0.997 10.311 83 HD2 ARG 724 HD2 ARG 724 -3.224 -3.552 11.635 84 HD3 ARG 724 HD1 ARG 724 -2.426 -2.260 12.544 85 HE ARG 724 HE ARG 724 -4.620 -1.137 11.231 86 HH11 ARG 724 HH11 ARG 724 -4.060 -3.570 13.741 87 HH12 ARG 724 HH12 ARG 724 -5.534 -3.345 14.537 88 HH21 ARG 724 HH21 ARG 724 -6.709 -0.803 12.332 89 HH22 ARG 724 HH22 ARG 724 -7.063 -1.729 13.721 90 H LYS 725 HN LYS 725 -5.230 -4.724 7.617 91 HA LYS 725 HA LYS 725 -7.105 -4.267 9.736 92 HB2 LYS 725 HB2 LYS 725 -7.525 -4.915 6.826 93 HB3 LYS 725 HB1 LYS 725 -8.838 -4.649 7.968 94 HG2 LYS 725 HG2 LYS 725 -6.715 -2.652 7.220 95 HG3 LYS 725 HG1 LYS 725 -8.388 -2.658 6.653 96 HD2 LYS 725 HD2 LYS 725 -9.165 -2.379 8.965 97 HD3 LYS 725 HD1 LYS 725 -7.494 -2.363 9.525 98 HE2 LYS 725 HE2 LYS 725 -8.394 -0.098 9.350 99 HE3 LYS 725 HE1 LYS 725 -7.067 -0.348 8.215 100 HZ1 LYS 725 HZ1 LYS 725 -9.010 0.835 7.276 101 HZ2 LYS 725 HZ2 LYS 725 -9.928 -0.591 7.441 102 HZ3 LYS 725 HZ3 LYS 725 -8.594 -0.554 6.434 103 H GLU 726 HN GLU 726 -5.637 -6.922 8.206 104 HA GLU 726 HA GLU 726 -7.547 -8.780 9.174 105 HB2 GLU 726 HB2 GLU 726 -5.810 -10.492 8.505 106 HB3 GLU 726 HB1 GLU 726 -6.481 -9.401 7.300 107 HG2 GLU 726 HG2 GLU 726 -4.362 -8.001 7.611 108 HG3 GLU 726 HG1 GLU 726 -3.734 -9.420 8.444 109 H PHE 727 HN PHE 727 -5.044 -7.117 10.450 110 HA PHE 727 HA PHE 727 -4.807 -8.860 12.801 111 HB2 PHE 727 HB2 PHE 727 -3.796 -6.034 12.577 112 HB3 PHE 727 HB1 PHE 727 -3.328 -7.295 13.710 113 HD1 PHE 727 HD2 PHE 727 -2.956 -9.568 11.824 114 HD2 PHE 727 HD1 PHE 727 -1.830 -5.485 11.550 115 HE1 PHE 727 HE2 PHE 727 -1.128 -10.178 10.308 116 HE2 PHE 727 HE1 PHE 727 -0.028 -6.053 10.059 117 HZ PHE 727 HZ PHE 727 0.347 -8.431 9.415 118 H ALA 728 HN ALA 728 -7.082 -6.975 11.730 119 HA ALA 728 HA ALA 728 -7.750 -5.754 14.289 120 HB1 ALA 728 HB1 ALA 728 -7.956 -4.334 12.304 121 HB2 ALA 728 HB2 ALA 728 -9.509 -4.547 13.114 122 HB3 ALA 728 HB3 ALA 728 -9.151 -5.446 11.636 123 H LYS 729 HN LYS 729 -9.384 -7.737 11.819 124 HA LYS 729 HA LYS 729 -10.982 -8.805 14.033 125 HB2 LYS 729 HB2 LYS 729 -11.720 -8.577 11.124 126 HB3 LYS 729 HB1 LYS 729 -12.660 -9.498 12.290 127 HG2 LYS 729 HG2 LYS 729 -13.808 -7.554 12.438 128 HG3 LYS 729 HG1 LYS 729 -12.530 -7.149 13.581 129 HD2 LYS 729 HD2 LYS 729 -12.347 -5.303 12.251 130 HD3 LYS 729 HD1 LYS 729 -11.340 -6.399 11.328 131 HE2 LYS 729 HE2 LYS 729 -13.214 -7.007 9.894 132 HE3 LYS 729 HE1 LYS 729 -14.278 -5.947 10.814 133 HZ1 LYS 729 HZ1 LYS 729 -12.806 -4.061 10.109 134 HZ2 LYS 729 HZ2 LYS 729 -13.600 -4.832 8.838 135 HZ3 LYS 729 HZ3 LYS 729 -11.969 -5.160 9.136 136 H PHE 730 HN PHE 730 -8.668 -9.709 11.650 137 HA PHE 730 HA PHE 730 -7.679 -11.611 11.104 138 HB2 PHE 730 HB2 PHE 730 -8.823 -12.750 13.666 139 HB3 PHE 730 HB1 PHE 730 -7.407 -13.271 12.726 140 HD1 PHE 730 HD2 PHE 730 -8.791 -10.601 14.752 141 HD2 PHE 730 HD1 PHE 730 -5.327 -12.338 13.105 142 HE1 PHE 730 HE2 PHE 730 -7.521 -9.142 16.072 143 HE2 PHE 730 HE1 PHE 730 -3.920 -10.847 14.460 144 HZ PHE 730 HZ PHE 730 -4.980 -9.226 15.979 145 H GLU 731 HN GLU 731 -9.767 -11.227 9.894 146 HA GLU 731 HA GLU 731 -11.049 -13.900 9.609 147 HB2 GLU 731 HB2 GLU 731 -12.388 -11.283 8.994 148 HB3 GLU 731 HB1 GLU 731 -13.112 -12.882 8.981 149 HG2 GLU 731 HG2 GLU 731 -12.776 -13.033 11.403 150 HG3 GLU 731 HG1 GLU 731 -12.057 -11.435 11.397 151 H GLU 732 HN GLU 732 -9.530 -11.236 8.156 152 HA GLU 732 HA GLU 732 -10.328 -12.029 5.513 153 HB2 GLU 732 HB2 GLU 732 -9.009 -9.865 4.876 154 HB3 GLU 732 HB1 GLU 732 -10.596 -9.741 5.609 155 HG2 GLU 732 HG2 GLU 732 -8.010 -9.484 7.171 156 HG3 GLU 732 HG1 GLU 732 -8.880 -8.118 6.485 157 H GLU 733 HN GLU 733 -6.987 -10.650 6.268 158 HA GLU 733 HA GLU 733 -5.030 -11.313 5.706 159 HB2 GLU 733 HB2 GLU 733 -6.199 -14.001 6.009 160 HB3 GLU 733 HB1 GLU 733 -4.498 -13.617 5.771 161 HG2 GLU 733 HG2 GLU 733 -4.540 -12.298 7.884 162 HG3 GLU 733 HG1 GLU 733 -6.158 -12.946 8.215 163 H ARG 734 HN ARG 734 -4.900 -10.560 3.970 164 HA ARG 734 HA ARG 734 -5.755 -11.779 1.467 165 HB2 ARG 734 HB2 ARG 734 -3.601 -9.687 1.731 166 HB3 ARG 734 HB1 ARG 734 -4.590 -10.035 0.318 167 HG2 ARG 734 HG2 ARG 734 -5.506 -8.835 2.912 168 HG3 ARG 734 HG1 ARG 734 -5.345 -8.018 1.357 169 HD2 ARG 734 HD2 ARG 734 -7.140 -10.360 1.861 170 HD3 ARG 734 HD1 ARG 734 -7.661 -8.682 1.992 171 HE ARG 734 HE ARG 734 -6.631 -8.752 -0.486 172 HH11 ARG 734 HH11 ARG 734 -8.889 -10.938 1.125 173 HH12 ARG 734 HH12 ARG 734 -9.736 -11.366 -0.282 174 HH21 ARG 734 HH21 ARG 734 -7.785 -9.323 -2.437 175 HH22 ARG 734 HH22 ARG 734 -9.100 -10.410 -2.366 176 H ALA 735 HN ALA 735 -2.519 -11.094 2.691 177 HA ALA 735 HA ALA 735 -1.503 -13.450 1.298 178 HB1 ALA 735 HB1 ALA 735 0.712 -12.576 1.869 179 HB2 ALA 735 HB2 ALA 735 -0.036 -11.265 2.781 180 HB3 ALA 735 HB3 ALA 735 -0.254 -11.360 1.032 181 H ARG 736 HN ARG 736 -3.136 -13.019 3.928 182 HA ARG 736 HA ARG 736 -3.431 -13.957 5.846 183 HB2 ARG 736 HB2 ARG 736 -1.588 -16.104 4.764 184 HB3 ARG 736 HB1 ARG 736 -2.495 -16.093 6.286 185 HG2 ARG 736 HG2 ARG 736 -3.748 -17.417 4.665 186 HG3 ARG 736 HG1 ARG 736 -4.620 -15.928 5.017 187 HD2 ARG 736 HD2 ARG 736 -3.648 -14.953 2.934 188 HD3 ARG 736 HD1 ARG 736 -2.929 -16.521 2.582 189 HE ARG 736 HE ARG 736 -5.778 -16.558 3.016 190 HH11 ARG 736 HH11 ARG 736 -3.186 -16.248 0.584 191 HH12 ARG 736 HH12 ARG 736 -4.174 -16.681 -0.733 192 HH21 ARG 736 HH21 ARG 736 -7.136 -17.164 1.167 193 HH22 ARG 736 HH22 ARG 736 -6.476 -17.210 -0.399 194 H ALA 737 HN ALA 737 -2.418 -12.043 6.723 195 HA ALA 737 HA ALA 737 -1.246 -11.073 8.340 196 HB1 ALA 737 HB1 ALA 737 -0.087 -13.782 8.956 197 HB2 ALA 737 HB2 ALA 737 -1.603 -13.150 9.595 198 HB3 ALA 737 HB3 ALA 737 -0.076 -12.371 10.013 199 H LYS 738 HN LYS 738 0.593 -13.241 6.446 200 HA LYS 738 HA LYS 738 3.006 -13.348 6.295 201 HB2 LYS 738 HB2 LYS 738 1.751 -13.191 4.194 202 HB3 LYS 738 HB1 LYS 738 2.002 -11.446 4.215 203 HG2 LYS 738 HG2 LYS 738 4.358 -11.719 3.998 204 HG3 LYS 738 HG1 LYS 738 4.224 -13.464 4.194 205 HD2 LYS 738 HD2 LYS 738 2.927 -13.595 2.158 206 HD3 LYS 738 HD1 LYS 738 3.049 -11.840 1.978 207 HE2 LYS 738 HE2 LYS 738 4.705 -12.923 0.556 208 HE3 LYS 738 HE1 LYS 738 5.510 -12.066 1.872 209 HZ1 LYS 738 HZ1 LYS 738 5.660 -14.276 3.055 210 HZ2 LYS 738 HZ2 LYS 738 6.529 -14.209 1.621 211 HZ3 LYS 738 HZ3 LYS 738 5.044 -14.992 1.651 212 H TRP 739 HN TRP 739 2.270 -9.976 5.684 213 HA TRP 739 HA TRP 739 4.947 -9.132 6.054 214 HB2 TRP 739 HB2 TRP 739 2.906 -7.094 6.444 215 HB3 TRP 739 HB1 TRP 739 4.223 -7.182 5.285 216 HD1 TRP 739 HD1 TRP 739 3.597 -7.782 2.885 217 HE1 TRP 739 HE1 TRP 739 1.333 -8.359 1.675 218 HE3 TRP 739 HE3 TRP 739 0.703 -8.407 6.857 219 HZ2 TRP 739 HZ2 TRP 739 -1.348 -8.940 2.381 220 HZ3 TRP 739 HZ3 TRP 739 -1.720 -8.935 6.567 221 HH2 TRP 739 HH2 TRP 739 -2.680 -9.179 4.314 222 H ASP 740 HN ASP 740 2.122 -9.208 8.026 223 HA ASP 740 HA ASP 740 1.633 -8.716 10.212 224 HB2 ASP 740 HB2 ASP 740 3.871 -10.422 10.018 225 HB3 ASP 740 HB1 ASP 740 4.022 -9.392 11.463 226 H THR 741 HN THR 741 2.547 -6.488 8.818 227 HA THR 741 HA THR 741 4.745 -5.098 9.657 228 HB THR 741 HB THR 741 2.524 -3.322 9.140 229 HG1 THR 741 HG1 THR 741 1.572 -4.340 7.493 230 HG21 THR 741 HG21 THR 741 4.923 -4.169 7.504 231 HG22 THR 741 HG22 THR 741 4.894 -2.848 8.673 232 HG23 THR 741 HG23 THR 741 3.922 -2.747 7.203 233 H ALA 742 HN ALA 742 1.559 -5.125 11.105 234 HA ALA 742 HA ALA 742 2.198 -2.938 12.885 235 HB1 ALA 742 HB1 ALA 742 -0.269 -4.656 12.786 236 HB2 ALA 742 HB2 ALA 742 -0.040 -3.125 11.939 237 HB3 ALA 742 HB3 ALA 742 -0.074 -3.164 13.702 238 H ASN 743 HN ASN 743 3.163 -6.003 12.974 239 HA ASN 743 HA ASN 743 2.903 -6.142 15.889 240 HB2 ASN 743 HB2 ASN 743 3.153 -8.513 14.031 241 HB3 ASN 743 HB1 ASN 743 2.872 -8.550 15.764 242 HD21 ASN 743 HD21 ASN 743 1.604 -7.972 12.753 243 HD22 ASN 743 HD22 ASN 743 -0.099 -7.973 13.097 244 H ASN 744 HN ASN 744 4.827 -7.235 13.122 245 HA ASN 744 HA ASN 744 7.250 -6.668 14.597 246 HB2 ASN 744 HB2 ASN 744 8.174 -8.874 13.915 247 HB3 ASN 744 HB1 ASN 744 6.861 -9.101 15.037 248 HD21 ASN 744 HD21 ASN 744 8.079 -9.653 11.985 249 HD22 ASN 744 HD22 ASN 744 6.775 -10.529 11.330 250 HA PRO 745 HA PRO 745 8.740 -5.269 10.679 251 HB2 PRO 745 HB2 PRO 745 11.125 -6.493 10.214 252 HB3 PRO 745 HB1 PRO 745 10.907 -5.220 11.424 253 HG2 PRO 745 HG2 PRO 745 11.002 -8.180 11.777 254 HG3 PRO 745 HG1 PRO 745 11.736 -6.916 12.774 255 HD2 PRO 745 HD2 PRO 745 9.454 -8.181 13.441 256 HD3 PRO 745 HD1 PRO 745 9.756 -6.504 13.902 257 H LEU 746 HN LEU 746 9.336 -8.794 10.733 258 HA LEU 746 HA LEU 746 8.394 -8.915 7.915 259 HB2 LEU 746 HB2 LEU 746 10.284 -10.960 9.030 260 HB3 LEU 746 HB1 LEU 746 9.979 -10.480 7.382 261 HG LEU 746 HG LEU 746 11.265 -8.745 9.366 262 HD11 LEU 746 HD11 LEU 746 13.423 -9.478 8.300 263 HD12 LEU 746 HD12 LEU 746 12.486 -10.654 7.355 264 HD13 LEU 746 HD13 LEU 746 12.552 -10.779 9.114 265 HD21 LEU 746 HD21 LEU 746 12.137 -7.596 7.352 266 HD22 LEU 746 HD22 LEU 746 10.367 -7.612 7.461 267 HD23 LEU 746 HD23 LEU 746 11.194 -8.721 6.365 268 H PTR 747 HN PTR 747 9.185 -11.370 10.316 269 HA PTR 747 HA PTR 747 6.848 -12.216 11.267 270 HB2 PTR 747 HB2 PTR 747 5.889 -13.766 9.892 271 HB3 PTR 747 HB1 PTR 747 5.975 -12.254 9.010 272 HD1 PTR 747 HD1 PTR 747 6.805 -15.771 8.849 273 HD2 PTR 747 HD2 PTR 747 7.854 -11.977 7.261 274 HE1 PTR 747 HE1 PTR 747 7.932 -16.867 6.966 275 HE2 PTR 747 HE2 PTR 747 8.977 -13.063 5.386 276 H LYS 748 HN LYS 748 10.042 -12.672 10.945 277 HA LYS 748 HA LYS 748 10.022 -15.540 11.149 278 HB2 LYS 748 HB2 LYS 748 12.327 -15.511 10.807 279 HB3 LYS 748 HB1 LYS 748 11.833 -14.091 9.911 280 HG2 LYS 748 HG2 LYS 748 12.676 -13.878 12.740 281 HG3 LYS 748 HG1 LYS 748 13.925 -13.966 11.472 282 HD2 LYS 748 HD2 LYS 748 12.813 -11.955 10.473 283 HD3 LYS 748 HD1 LYS 748 11.745 -11.913 11.882 284 HE2 LYS 748 HE2 LYS 748 13.752 -11.737 13.340 285 HE3 LYS 748 HE1 LYS 748 14.758 -11.646 11.899 286 HZ1 LYS 748 HZ1 LYS 748 13.613 -9.578 11.293 287 HZ2 LYS 748 HZ2 LYS 748 14.276 -9.466 12.833 288 HZ3 LYS 748 HZ3 LYS 748 12.622 -9.753 12.665 289 H GLU 749 HN GLU 749 9.783 -12.878 13.108 290 HA GLU 749 HA GLU 749 10.700 -14.286 15.464 291 HB2 GLU 749 HB2 GLU 749 10.055 -12.123 16.638 292 HB3 GLU 749 HB1 GLU 749 11.356 -12.062 15.457 293 HG2 GLU 749 HG2 GLU 749 8.574 -11.335 14.638 294 HG3 GLU 749 HG1 GLU 749 9.579 -10.172 15.497 295 H ALA 750 HN ALA 750 7.720 -13.175 13.940 296 HA ALA 750 HA ALA 750 6.180 -15.050 15.368 297 HB1 ALA 750 HB1 ALA 750 4.701 -13.433 16.461 298 HB2 ALA 750 HB2 ALA 750 5.758 -12.118 15.948 299 HB3 ALA 750 HB3 ALA 750 6.343 -13.324 17.095 300 H THR 751 HN THR 751 4.117 -15.116 14.520 301 HA THR 751 HA THR 751 3.472 -13.320 12.266 302 HB THR 751 HB THR 751 3.062 -16.295 11.999 303 HG1 THR 751 HG1 THR 751 5.335 -14.751 11.642 304 HG21 THR 751 HG21 THR 751 1.744 -14.866 10.515 305 HG22 THR 751 HG22 THR 751 2.945 -15.766 9.588 306 HG23 THR 751 HG23 THR 751 3.213 -14.063 9.957 307 H SER 752 HN SER 752 1.250 -13.059 11.898 308 HA SER 752 HA SER 752 -0.487 -13.880 14.089 309 HB2 SER 752 HB2 SER 752 -1.082 -12.151 11.674 310 HB3 SER 752 HB1 SER 752 -2.125 -12.362 13.082 311 HG SER 752 HG SER 752 0.396 -11.064 12.903 312 H THR 753 HN THR 753 -2.750 -14.825 13.596 313 HA THR 753 HA THR 753 -3.341 -16.043 11.140 314 HB THR 753 HB THR 753 -3.354 -18.322 12.475 315 HG1 THR 753 HG1 THR 753 -1.303 -16.752 13.452 316 HG21 THR 753 HG21 THR 753 -1.345 -19.022 11.182 317 HG22 THR 753 HG22 THR 753 -1.035 -17.324 10.816 318 HG23 THR 753 HG23 THR 753 -2.501 -18.103 10.220 319 H PHE 754 HN PHE 754 -5.180 -17.414 11.464 320 HA PHE 754 HA PHE 754 -6.470 -17.369 14.061 321 HB2 PHE 754 HB2 PHE 754 -8.564 -16.545 13.263 322 HB3 PHE 754 HB1 PHE 754 -7.286 -15.371 12.931 323 HD1 PHE 754 HD1 PHE 754 -6.466 -15.126 10.545 324 HD2 PHE 754 HD2 PHE 754 -9.912 -17.418 11.552 325 HE1 PHE 754 HE1 PHE 754 -7.186 -15.021 8.266 326 HE2 PHE 754 HE2 PHE 754 -10.649 -17.318 9.221 327 HZ PHE 754 HZ PHE 754 -9.298 -16.119 7.557 328 H THR 755 HN THR 755 -6.227 -18.688 10.835 329 HA THR 755 HA THR 755 -8.244 -20.624 11.182 330 HB THR 755 HB THR 755 -6.970 -21.588 9.113 331 HG1 THR 755 HG1 THR 755 -5.802 -19.827 8.076 332 HG21 THR 755 HG21 THR 755 -8.339 -18.893 9.056 333 HG22 THR 755 HG22 THR 755 -9.150 -20.461 9.040 334 HG23 THR 755 HG23 THR 755 -8.137 -19.979 7.680 335 H ASN 756 HN ASN 756 -4.723 -20.548 11.631 336 HA ASN 756 HA ASN 756 -4.880 -23.173 12.809 337 HB2 ASN 756 HB2 ASN 756 -2.888 -23.934 11.554 338 HB3 ASN 756 HB1 ASN 756 -4.265 -23.612 10.486 339 HD21 ASN 756 HD21 ASN 756 -4.126 -21.906 9.190 340 HD22 ASN 756 HD22 ASN 756 -2.608 -21.112 8.849 341 H ILE 757 HN ILE 757 -2.837 -23.695 14.053 342 HA ILE 757 HA ILE 757 -1.411 -21.279 14.862 343 HB ILE 757 HB ILE 757 -1.625 -23.796 16.523 344 HG12 ILE 757 HG12 ILE 757 -3.454 -22.306 17.738 345 HG13 ILE 757 HG11 ILE 757 -3.657 -21.676 16.095 346 HG21 ILE 757 HG21 ILE 757 -1.236 -22.241 18.388 347 HG22 ILE 757 HG22 ILE 757 -1.178 -20.896 17.245 348 HG23 ILE 757 HG23 ILE 757 0.053 -22.159 17.187 349 HD11 ILE 757 HD11 ILE 757 -4.138 -23.901 15.309 350 HD12 ILE 757 HD12 ILE 757 -5.251 -23.452 16.609 351 HD13 ILE 757 HD13 ILE 757 -3.906 -24.558 16.929 352 H THR 758 HN THR 758 -1.126 -23.897 12.997 353 HA THR 758 HA THR 758 1.570 -24.710 13.792 354 HB THR 758 HB THR 758 1.272 -26.260 11.779 355 HG1 THR 758 HG1 THR 758 -0.464 -25.276 10.789 356 HG21 THR 758 HG21 THR 758 1.113 -27.048 14.098 357 HG22 THR 758 HG22 THR 758 -0.111 -27.848 13.106 358 HG23 THR 758 HG23 THR 758 -0.567 -26.518 14.168 359 H TYR 759 HN TYR 759 0.361 -22.307 12.067 360 HA TYR 759 HA TYR 759 1.563 -22.043 9.645 361 HB2 TYR 759 HB2 TYR 759 1.770 -19.540 10.124 362 HB3 TYR 759 HB1 TYR 759 0.184 -20.225 10.431 363 HD1 TYR 759 HD2 TYR 759 -0.292 -20.888 12.942 364 HD2 TYR 759 HD1 TYR 759 2.798 -18.198 11.797 365 HE1 TYR 759 HE2 TYR 759 -0.248 -19.974 15.211 366 HE2 TYR 759 HE1 TYR 759 2.844 -17.288 14.056 367 HH TYR 759 HH TYR 759 1.401 -17.101 15.986 368 H ARG 760 HN ARG 760 3.178 -20.870 12.551 369 HA ARG 760 HA ARG 760 5.748 -21.732 11.406 370 HB2 ARG 760 HB2 ARG 760 5.407 -19.287 13.117 371 HB3 ARG 760 HB1 ARG 760 6.788 -19.750 12.138 372 HG2 ARG 760 HG2 ARG 760 4.128 -19.105 10.992 373 HG3 ARG 760 HG1 ARG 760 5.342 -17.867 11.331 374 HD2 ARG 760 HD2 ARG 760 5.698 -20.289 9.539 375 HD3 ARG 760 HD1 ARG 760 5.325 -18.673 8.945 376 HE ARG 760 HE ARG 760 7.661 -18.741 10.568 377 HH11 ARG 760 HH11 ARG 760 6.435 -19.281 7.301 378 HH12 ARG 760 HH12 ARG 760 7.931 -19.061 6.507 379 HH21 ARG 760 HH21 ARG 760 9.751 -18.422 9.512 380 HH22 ARG 760 HH22 ARG 760 9.877 -18.572 7.821 381 H GLY 761 HN GLY 761 4.143 -20.506 14.242 382 HA2 GLY 761 HA2 GLY 761 3.917 -21.984 16.204 383 HA3 GLY 761 HA1 GLY 761 5.553 -22.527 15.865 384 H THR 762 HN THR 762 4.304 -19.186 15.821 385 HA THR 762 HA THR 762 5.389 -18.538 18.282 386 HB THR 762 HB THR 762 7.542 -18.748 17.122 387 HG1 THR 762 HG1 THR 762 7.784 -16.118 17.121 388 HG21 THR 762 HG21 THR 762 8.117 -17.305 15.183 389 HG22 THR 762 HG22 THR 762 6.453 -16.716 15.148 390 HG23 THR 762 HG23 THR 762 6.791 -18.406 14.799 Start of MODEL 9 1 H LYS 716 HT1 LYS 716 2.612 -0.112 0.259 2 HA LYS 716 HA LYS 716 3.748 -0.308 2.942 3 HB2 LYS 716 HB2 LYS 716 1.102 -1.369 1.891 4 HB3 LYS 716 HB1 LYS 716 1.853 -1.970 3.358 5 HG2 LYS 716 HG2 LYS 716 0.982 0.850 2.876 6 HG3 LYS 716 HG1 LYS 716 0.141 -0.376 3.829 7 HD2 LYS 716 HD2 LYS 716 2.069 -0.524 5.338 8 HD3 LYS 716 HD1 LYS 716 2.903 0.709 4.390 9 HE2 LYS 716 HE2 LYS 716 1.154 2.316 4.935 10 HE3 LYS 716 HE1 LYS 716 0.288 1.078 5.844 11 HZ1 LYS 716 HZ1 LYS 716 2.983 2.162 6.510 12 HZ2 LYS 716 HZ2 LYS 716 2.222 0.917 7.321 13 HZ3 LYS 716 HZ3 LYS 716 1.526 2.469 7.331 14 H LEU 717 HN LEU 717 2.871 -3.241 2.729 15 HA LEU 717 HA LEU 717 5.352 -4.045 1.669 16 HB2 LEU 717 HB2 LEU 717 3.064 -5.603 2.852 17 HB3 LEU 717 HB1 LEU 717 4.615 -6.279 2.420 18 HG LEU 717 HG LEU 717 4.616 -6.012 4.745 19 HD11 LEU 717 HD11 LEU 717 6.432 -4.419 5.158 20 HD12 LEU 717 HD12 LEU 717 6.177 -3.742 3.547 21 HD13 LEU 717 HD13 LEU 717 6.703 -5.415 3.728 22 HD21 LEU 717 HD21 LEU 717 4.168 -3.879 5.906 23 HD22 LEU 717 HD22 LEU 717 2.759 -4.456 5.009 24 HD23 LEU 717 HD23 LEU 717 3.743 -3.147 4.358 25 H LEU 718 HN LEU 718 2.002 -5.122 1.034 26 HA LEU 718 HA LEU 718 2.901 -5.654 -1.716 27 HB2 LEU 718 HB2 LEU 718 1.117 -7.382 -0.012 28 HB3 LEU 718 HB1 LEU 718 1.335 -7.601 -1.732 29 HG LEU 718 HG LEU 718 3.449 -7.907 0.395 30 HD11 LEU 718 HD11 LEU 718 3.429 -10.262 -0.287 31 HD12 LEU 718 HD12 LEU 718 2.098 -9.925 -1.394 32 HD13 LEU 718 HD13 LEU 718 1.862 -9.759 0.341 33 HD21 LEU 718 HD21 LEU 718 3.650 -8.271 -2.596 34 HD22 LEU 718 HD22 LEU 718 4.909 -8.669 -1.424 35 HD23 LEU 718 HD23 LEU 718 4.415 -6.991 -1.653 36 H ILE 719 HN ILE 719 -0.015 -5.179 0.295 37 HA ILE 719 HA ILE 719 -1.362 -4.404 -2.203 38 HB ILE 719 HB ILE 719 -2.893 -5.294 0.224 39 HG12 ILE 719 HG12 ILE 719 -1.740 -7.177 -1.854 40 HG13 ILE 719 HG11 ILE 719 -1.069 -6.977 -0.243 41 HG21 ILE 719 HG21 ILE 719 -4.462 -6.057 -1.500 42 HG22 ILE 719 HG22 ILE 719 -3.330 -5.551 -2.756 43 HG23 ILE 719 HG23 ILE 719 -4.079 -4.348 -1.706 44 HD11 ILE 719 HD11 ILE 719 -2.455 -8.956 -0.381 45 HD12 ILE 719 HD12 ILE 719 -3.824 -7.975 -0.913 46 HD13 ILE 719 HD13 ILE 719 -3.174 -7.772 0.711 47 H THR 720 HN THR 720 -0.873 -3.519 1.154 48 HA THR 720 HA THR 720 -0.928 -1.484 2.199 49 HB THR 720 HB THR 720 -1.917 -0.249 -0.435 50 HG1 THR 720 HG1 THR 720 0.044 -1.178 -0.861 51 HG21 THR 720 HG21 THR 720 -0.466 1.003 1.923 52 HG22 THR 720 HG22 THR 720 -2.178 1.214 1.554 53 HG23 THR 720 HG23 THR 720 -0.957 1.844 0.451 54 H ILE 721 HN ILE 721 -3.277 -3.356 1.780 55 HA ILE 721 HA ILE 721 -5.302 -1.544 2.893 56 HB ILE 721 HB ILE 721 -7.099 -2.850 1.779 57 HG12 ILE 721 HG12 ILE 721 -4.873 -3.849 0.021 58 HG13 ILE 721 HG11 ILE 721 -5.696 -4.872 1.186 59 HG21 ILE 721 HG21 ILE 721 -6.904 -1.699 -0.402 60 HG22 ILE 721 HG22 ILE 721 -5.213 -1.354 -0.048 61 HG23 ILE 721 HG23 ILE 721 -6.482 -0.647 0.951 62 HD11 ILE 721 HD11 ILE 721 -6.551 -5.248 -1.053 63 HD12 ILE 721 HD12 ILE 721 -6.910 -3.533 -1.243 64 HD13 ILE 721 HD13 ILE 721 -7.806 -4.497 -0.068 65 H HIS 722 HN HIS 722 -4.244 -4.882 2.547 66 HA HIS 722 HA HIS 722 -5.720 -5.482 5.004 67 HB2 HIS 722 HB2 HIS 722 -4.937 -7.238 2.701 68 HB3 HIS 722 HB1 HIS 722 -5.383 -7.894 4.272 69 HD1 HIS 722 HD1 HIS 722 -6.810 -6.832 1.075 70 HD2 HIS 722 HD2 HIS 722 -8.044 -7.123 5.018 71 HE1 HIS 722 HE1 HIS 722 -9.288 -6.730 0.977 72 HE2 HIS 722 HE2 HIS 722 -10.044 -7.184 3.308 73 H ASP 723 HN ASP 723 -2.773 -4.842 3.831 74 HA ASP 723 HA ASP 723 -0.988 -6.652 5.007 75 HB2 ASP 723 HB2 ASP 723 -0.557 -3.678 4.578 76 HB3 ASP 723 HB1 ASP 723 0.691 -4.906 4.734 77 H ARG 724 HN ARG 724 -2.964 -4.354 6.366 78 HA ARG 724 HA ARG 724 -1.683 -4.673 9.002 79 HB2 ARG 724 HB2 ARG 724 -1.274 -2.492 8.177 80 HB3 ARG 724 HB1 ARG 724 -2.937 -2.256 7.751 81 HG2 ARG 724 HG2 ARG 724 -2.381 -1.044 9.852 82 HG3 ARG 724 HG1 ARG 724 -3.629 -2.302 10.006 83 HD2 ARG 724 HD2 ARG 724 -2.218 -3.779 10.918 84 HD3 ARG 724 HD1 ARG 724 -0.751 -2.809 10.654 85 HE ARG 724 HE ARG 724 -2.943 -2.263 12.553 86 HH11 ARG 724 HH11 ARG 724 0.421 -1.812 11.524 87 HH12 ARG 724 HH12 ARG 724 0.959 -1.031 12.924 88 HH21 ARG 724 HH21 ARG 724 -2.250 -1.151 14.552 89 HH22 ARG 724 HH22 ARG 724 -0.632 -0.627 14.709 90 H LYS 725 HN LYS 725 -4.542 -4.832 7.078 91 HA LYS 725 HA LYS 725 -6.296 -3.979 9.081 92 HB2 LYS 725 HB2 LYS 725 -6.805 -3.572 6.739 93 HB3 LYS 725 HB1 LYS 725 -6.801 -5.297 6.421 94 HG2 LYS 725 HG2 LYS 725 -8.987 -4.943 6.487 95 HG3 LYS 725 HG1 LYS 725 -8.668 -5.299 8.200 96 HD2 LYS 725 HD2 LYS 725 -8.812 -2.483 7.059 97 HD3 LYS 725 HD1 LYS 725 -10.191 -3.289 7.799 98 HE2 LYS 725 HE2 LYS 725 -8.924 -3.487 9.897 99 HE3 LYS 725 HE1 LYS 725 -7.559 -2.668 9.139 100 HZ1 LYS 725 HZ1 LYS 725 -8.901 -1.142 10.474 101 HZ2 LYS 725 HZ2 LYS 725 -10.259 -1.534 9.580 102 HZ3 LYS 725 HZ3 LYS 725 -8.978 -0.711 8.832 103 H GLU 726 HN GLU 726 -5.212 -7.038 7.939 104 HA GLU 726 HA GLU 726 -7.174 -8.528 9.374 105 HB2 GLU 726 HB2 GLU 726 -5.647 -10.499 8.906 106 HB3 GLU 726 HB1 GLU 726 -6.354 -9.550 7.591 107 HG2 GLU 726 HG2 GLU 726 -4.025 -8.310 7.659 108 HG3 GLU 726 HG1 GLU 726 -3.518 -9.820 8.392 109 H PHE 727 HN PHE 727 -4.650 -6.865 10.298 110 HA PHE 727 HA PHE 727 -4.304 -8.320 12.840 111 HB2 PHE 727 HB2 PHE 727 -3.064 -5.726 12.019 112 HB3 PHE 727 HB1 PHE 727 -2.608 -6.763 13.363 113 HD1 PHE 727 HD2 PHE 727 -1.627 -9.003 12.845 114 HD2 PHE 727 HD1 PHE 727 -2.264 -6.027 9.942 115 HE1 PHE 727 HE2 PHE 727 -0.071 -10.146 11.348 116 HE2 PHE 727 HE1 PHE 727 -0.717 -7.142 8.426 117 HZ PHE 727 HZ PHE 727 0.382 -9.206 9.117 118 H ALA 728 HN ALA 728 -6.490 -6.400 11.670 119 HA ALA 728 HA ALA 728 -6.881 -4.901 14.162 120 HB1 ALA 728 HB1 ALA 728 -8.454 -3.508 12.932 121 HB2 ALA 728 HB2 ALA 728 -8.214 -4.494 11.490 122 HB3 ALA 728 HB3 ALA 728 -6.880 -3.538 12.136 123 H LYS 729 HN LYS 729 -8.765 -6.701 11.740 124 HA LYS 729 HA LYS 729 -10.667 -7.334 13.859 125 HB2 LYS 729 HB2 LYS 729 -10.918 -7.778 10.910 126 HB3 LYS 729 HB1 LYS 729 -12.199 -7.857 12.113 127 HG2 LYS 729 HG2 LYS 729 -12.532 -5.659 12.060 128 HG3 LYS 729 HG1 LYS 729 -10.798 -5.320 12.111 129 HD2 LYS 729 HD2 LYS 729 -11.532 -4.498 10.061 130 HD3 LYS 729 HD1 LYS 729 -10.704 -5.994 9.735 131 HE2 LYS 729 HE2 LYS 729 -12.883 -7.205 9.744 132 HE3 LYS 729 HE1 LYS 729 -13.694 -5.643 9.849 133 HZ1 LYS 729 HZ1 LYS 729 -13.583 -6.447 7.586 134 HZ2 LYS 729 HZ2 LYS 729 -11.894 -6.542 7.699 135 HZ3 LYS 729 HZ3 LYS 729 -12.661 -5.026 7.741 136 H PHE 730 HN PHE 730 -8.287 -8.767 11.734 137 HA PHE 730 HA PHE 730 -7.462 -10.829 11.472 138 HB2 PHE 730 HB2 PHE 730 -8.774 -11.580 14.097 139 HB3 PHE 730 HB1 PHE 730 -7.332 -12.240 13.303 140 HD1 PHE 730 HD2 PHE 730 -8.716 -9.368 15.027 141 HD2 PHE 730 HD1 PHE 730 -5.234 -11.307 13.678 142 HE1 PHE 730 HE2 PHE 730 -7.461 -7.836 16.299 143 HE2 PHE 730 HE1 PHE 730 -3.849 -9.757 14.982 144 HZ PHE 730 HZ PHE 730 -4.930 -7.990 16.330 145 H GLU 731 HN GLU 731 -9.723 -10.302 10.291 146 HA GLU 731 HA GLU 731 -11.175 -12.888 10.346 147 HB2 GLU 731 HB2 GLU 731 -12.299 -10.201 9.579 148 HB3 GLU 731 HB1 GLU 731 -13.176 -11.724 9.573 149 HG2 GLU 731 HG2 GLU 731 -12.831 -11.905 11.987 150 HG3 GLU 731 HG1 GLU 731 -11.979 -10.382 11.966 151 H GLU 732 HN GLU 732 -9.459 -10.654 8.488 152 HA GLU 732 HA GLU 732 -10.500 -11.657 5.977 153 HB2 GLU 732 HB2 GLU 732 -8.832 -9.834 5.041 154 HB3 GLU 732 HB1 GLU 732 -10.396 -9.380 5.696 155 HG2 GLU 732 HG2 GLU 732 -7.874 -9.335 7.356 156 HG3 GLU 732 HG1 GLU 732 -8.391 -7.956 6.385 157 H GLU 733 HN GLU 733 -7.030 -10.671 6.369 158 HA GLU 733 HA GLU 733 -5.162 -11.625 5.799 159 HB2 GLU 733 HB2 GLU 733 -6.521 -14.239 6.142 160 HB3 GLU 733 HB1 GLU 733 -4.807 -13.867 5.958 161 HG2 GLU 733 HG2 GLU 733 -4.784 -12.701 8.042 162 HG3 GLU 733 HG1 GLU 733 -6.503 -13.036 8.276 163 H ARG 734 HN ARG 734 -4.832 -11.069 4.017 164 HA ARG 734 HA ARG 734 -5.742 -12.579 1.682 165 HB2 ARG 734 HB2 ARG 734 -3.688 -10.398 1.730 166 HB3 ARG 734 HB1 ARG 734 -4.539 -11.030 0.327 167 HG2 ARG 734 HG2 ARG 734 -5.646 -9.444 2.589 168 HG3 ARG 734 HG1 ARG 734 -5.520 -8.988 0.889 169 HD2 ARG 734 HD2 ARG 734 -7.090 -11.314 1.888 170 HD3 ARG 734 HD1 ARG 734 -7.782 -9.706 1.703 171 HE ARG 734 HE ARG 734 -6.510 -10.591 -0.699 172 HH11 ARG 734 HH11 ARG 734 -9.502 -11.086 1.171 173 HH12 ARG 734 HH12 ARG 734 -10.395 -11.606 -0.159 174 HH21 ARG 734 HH21 ARG 734 -7.769 -11.308 -2.545 175 HH22 ARG 734 HH22 ARG 734 -9.405 -11.748 -2.314 176 H ALA 735 HN ALA 735 -2.691 -11.865 3.279 177 HA ALA 735 HA ALA 735 -1.584 -14.241 1.984 178 HB1 ALA 735 HB1 ALA 735 0.606 -13.228 2.342 179 HB2 ALA 735 HB2 ALA 735 -0.157 -11.839 3.116 180 HB3 ALA 735 HB3 ALA 735 -0.441 -12.163 1.406 181 H ARG 736 HN ARG 736 -3.229 -13.895 4.501 182 HA ARG 736 HA ARG 736 -3.393 -14.823 6.575 183 HB2 ARG 736 HB2 ARG 736 -2.305 -16.781 5.217 184 HB3 ARG 736 HB1 ARG 736 -0.850 -16.204 6.051 185 HG2 ARG 736 HG2 ARG 736 -1.795 -16.703 8.205 186 HG3 ARG 736 HG1 ARG 736 -3.335 -17.152 7.469 187 HD2 ARG 736 HD2 ARG 736 -2.204 -19.170 8.001 188 HD3 ARG 736 HD1 ARG 736 -2.101 -18.975 6.254 189 HE ARG 736 HE ARG 736 0.161 -17.851 7.527 190 HH11 ARG 736 HH11 ARG 736 -1.244 -21.008 6.647 191 HH12 ARG 736 HH12 ARG 736 0.262 -21.812 6.588 192 HH21 ARG 736 HH21 ARG 736 2.240 -18.993 7.442 193 HH22 ARG 736 HH22 ARG 736 2.282 -20.645 7.037 194 H ALA 737 HN ALA 737 -2.349 -12.376 6.545 195 HA ALA 737 HA ALA 737 -1.196 -10.829 7.697 196 HB1 ALA 737 HB1 ALA 737 -0.683 -11.319 10.014 197 HB2 ALA 737 HB2 ALA 737 -0.887 -13.046 9.703 198 HB3 ALA 737 HB3 ALA 737 -2.265 -11.957 9.573 199 H LYS 738 HN LYS 738 0.169 -12.675 5.966 200 HA LYS 738 HA LYS 738 2.673 -13.629 6.400 201 HB2 LYS 738 HB2 LYS 738 1.632 -13.514 4.196 202 HB3 LYS 738 HB1 LYS 738 1.979 -11.772 4.183 203 HG2 LYS 738 HG2 LYS 738 3.597 -13.103 2.815 204 HG3 LYS 738 HG1 LYS 738 4.366 -12.213 4.133 205 HD2 LYS 738 HD2 LYS 738 4.280 -14.279 5.501 206 HD3 LYS 738 HD1 LYS 738 3.654 -15.140 4.095 207 HE2 LYS 738 HE2 LYS 738 5.681 -14.686 2.872 208 HE3 LYS 738 HE1 LYS 738 6.289 -13.682 4.191 209 HZ1 LYS 738 HZ1 LYS 738 7.290 -15.880 4.323 210 HZ2 LYS 738 HZ2 LYS 738 5.737 -16.594 4.331 211 HZ3 LYS 738 HZ3 LYS 738 6.222 -15.643 5.612 212 H TRP 739 HN TRP 739 2.165 -10.246 5.614 213 HA TRP 739 HA TRP 739 4.844 -9.459 5.831 214 HB2 TRP 739 HB2 TRP 739 2.772 -7.441 6.434 215 HB3 TRP 739 HB1 TRP 739 4.073 -7.410 5.241 216 HD1 TRP 739 HD1 TRP 739 3.454 -8.119 2.808 217 HE1 TRP 739 HE1 TRP 739 1.181 -8.728 1.637 218 HE3 TRP 739 HE3 TRP 739 0.601 -8.637 6.842 219 HZ2 TRP 739 HZ2 TRP 739 -1.495 -9.335 2.408 220 HZ3 TRP 739 HZ3 TRP 739 -1.791 -9.208 6.590 221 HH2 TRP 739 HH2 TRP 739 -2.766 -9.539 4.391 222 H ASP 740 HN ASP 740 2.133 -9.192 8.024 223 HA ASP 740 HA ASP 740 1.961 -9.104 10.366 224 HB2 ASP 740 HB2 ASP 740 3.369 -11.175 9.983 225 HB3 ASP 740 HB1 ASP 740 4.777 -10.184 10.426 226 H THR 741 HN THR 741 3.217 -6.855 8.862 227 HA THR 741 HA THR 741 5.389 -5.766 10.250 228 HB THR 741 HB THR 741 4.468 -3.632 9.068 229 HG1 THR 741 HG1 THR 741 2.732 -4.004 7.817 230 HG21 THR 741 HG21 THR 741 5.499 -4.425 6.990 231 HG22 THR 741 HG22 THR 741 5.385 -6.084 7.587 232 HG23 THR 741 HG23 THR 741 6.438 -4.926 8.402 233 H ALA 742 HN ALA 742 2.086 -5.739 10.857 234 HA ALA 742 HA ALA 742 1.920 -3.437 12.532 235 HB1 ALA 742 HB1 ALA 742 0.238 -5.930 12.563 236 HB2 ALA 742 HB2 ALA 742 -0.053 -4.490 11.583 237 HB3 ALA 742 HB3 ALA 742 -0.161 -4.397 13.340 238 H ASN 743 HN ASN 743 3.365 -6.468 12.920 239 HA ASN 743 HA ASN 743 3.165 -6.330 15.823 240 HB2 ASN 743 HB2 ASN 743 3.865 -8.719 14.129 241 HB3 ASN 743 HB1 ASN 743 3.477 -8.696 15.843 242 HD21 ASN 743 HD21 ASN 743 2.191 -8.243 12.631 243 HD22 ASN 743 HD22 ASN 743 0.556 -8.619 13.035 244 H ASN 744 HN ASN 744 5.346 -7.628 13.302 245 HA ASN 744 HA ASN 744 7.510 -6.178 14.549 246 HB2 ASN 744 HB2 ASN 744 9.014 -8.141 14.415 247 HB3 ASN 744 HB1 ASN 744 7.652 -8.508 15.455 248 HD21 ASN 744 HD21 ASN 744 7.860 -8.617 11.883 249 HD22 ASN 744 HD22 ASN 744 7.510 -10.285 11.763 250 HA PRO 745 HA PRO 745 8.999 -4.969 10.569 251 HB2 PRO 745 HB2 PRO 745 11.369 -6.270 10.045 252 HB3 PRO 745 HB1 PRO 745 11.221 -4.877 11.126 253 HG2 PRO 745 HG2 PRO 745 11.212 -7.794 11.797 254 HG3 PRO 745 HG1 PRO 745 12.110 -6.518 12.598 255 HD2 PRO 745 HD2 PRO 745 9.929 -7.431 13.666 256 HD3 PRO 745 HD1 PRO 745 10.209 -5.684 13.627 257 H LEU 746 HN LEU 746 10.018 -8.376 10.587 258 HA LEU 746 HA LEU 746 8.360 -8.759 8.176 259 HB2 LEU 746 HB2 LEU 746 10.032 -10.423 7.365 260 HB3 LEU 746 HB1 LEU 746 10.603 -8.765 7.370 261 HG LEU 746 HG LEU 746 11.425 -9.817 9.814 262 HD11 LEU 746 HD11 LEU 746 12.702 -11.816 9.195 263 HD12 LEU 746 HD12 LEU 746 11.891 -11.838 7.624 264 HD13 LEU 746 HD13 LEU 746 10.962 -12.051 9.114 265 HD21 LEU 746 HD21 LEU 746 13.642 -9.631 8.877 266 HD22 LEU 746 HD22 LEU 746 12.612 -8.244 8.526 267 HD23 LEU 746 HD23 LEU 746 12.946 -9.441 7.254 268 H PTR 747 HN PTR 747 10.155 -10.834 10.480 269 HA PTR 747 HA PTR 747 8.099 -11.554 11.977 270 HB2 PTR 747 HB2 PTR 747 7.434 -13.721 11.365 271 HB3 PTR 747 HB1 PTR 747 6.946 -12.591 10.151 272 HD1 PTR 747 HD1 PTR 747 8.488 -12.392 8.022 273 HD2 PTR 747 HD2 PTR 747 8.552 -15.755 10.614 274 HE1 PTR 747 HE1 PTR 747 9.474 -13.739 6.236 275 HE2 PTR 747 HE2 PTR 747 9.551 -17.112 8.829 276 H LYS 748 HN LYS 748 9.848 -11.117 13.185 277 HA LYS 748 HA LYS 748 12.039 -12.973 13.394 278 HB2 LYS 748 HB2 LYS 748 12.657 -11.552 15.356 279 HB3 LYS 748 HB1 LYS 748 12.465 -10.659 13.853 280 HG2 LYS 748 HG2 LYS 748 9.996 -10.344 14.788 281 HG3 LYS 748 HG1 LYS 748 10.822 -10.607 16.319 282 HD2 LYS 748 HD2 LYS 748 11.709 -8.591 14.273 283 HD3 LYS 748 HD1 LYS 748 10.589 -8.225 15.583 284 HE2 LYS 748 HE2 LYS 748 13.382 -9.271 15.870 285 HE3 LYS 748 HE1 LYS 748 12.887 -7.592 16.073 286 HZ1 LYS 748 HZ1 LYS 748 11.342 -8.418 17.875 287 HZ2 LYS 748 HZ2 LYS 748 12.990 -8.491 18.218 288 HZ3 LYS 748 HZ3 LYS 748 12.169 -9.908 17.809 289 H GLU 749 HN GLU 749 8.990 -12.476 14.866 290 HA GLU 749 HA GLU 749 9.590 -14.484 16.914 291 HB2 GLU 749 HB2 GLU 749 7.268 -12.573 16.714 292 HB3 GLU 749 HB1 GLU 749 7.508 -13.743 18.000 293 HG2 GLU 749 HG2 GLU 749 9.621 -12.605 18.577 294 HG3 GLU 749 HG1 GLU 749 9.262 -11.395 17.347 295 H ALA 750 HN ALA 750 6.762 -13.584 14.886 296 HA ALA 750 HA ALA 750 6.544 -16.203 13.900 297 HB1 ALA 750 HB1 ALA 750 5.588 -16.510 16.118 298 HB2 ALA 750 HB2 ALA 750 4.341 -16.600 14.872 299 HB3 ALA 750 HB3 ALA 750 4.505 -15.142 15.854 300 H THR 751 HN THR 751 4.032 -16.055 13.102 301 HA THR 751 HA THR 751 3.614 -13.428 11.931 302 HB THR 751 HB THR 751 3.107 -15.979 10.378 303 HG1 THR 751 HG1 THR 751 5.437 -14.495 10.788 304 HG21 THR 751 HG21 THR 751 3.594 -13.117 9.577 305 HG22 THR 751 HG22 THR 751 2.010 -13.891 9.646 306 HG23 THR 751 HG23 THR 751 3.217 -14.437 8.471 307 H SER 752 HN SER 752 1.295 -13.065 11.437 308 HA SER 752 HA SER 752 -0.180 -14.241 13.635 309 HB2 SER 752 HB2 SER 752 -0.999 -11.971 11.816 310 HB3 SER 752 HB1 SER 752 -1.749 -12.437 13.334 311 HG SER 752 HG SER 752 0.930 -11.500 13.017 312 H THR 753 HN THR 753 -2.246 -15.225 13.506 313 HA THR 753 HA THR 753 -3.677 -15.279 11.086 314 HB THR 753 HB THR 753 -3.153 -17.974 12.270 315 HG1 THR 753 HG1 THR 753 -1.496 -16.444 10.677 316 HG21 THR 753 HG21 THR 753 -3.726 -18.744 9.993 317 HG22 THR 753 HG22 THR 753 -3.888 -17.060 9.496 318 HG23 THR 753 HG23 THR 753 -4.976 -17.729 10.711 319 H PHE 754 HN PHE 754 -5.619 -16.767 11.685 320 HA PHE 754 HA PHE 754 -6.254 -16.486 14.535 321 HB2 PHE 754 HB2 PHE 754 -8.473 -15.594 14.049 322 HB3 PHE 754 HB1 PHE 754 -7.205 -14.501 13.501 323 HD1 PHE 754 HD1 PHE 754 -6.635 -14.595 10.928 324 HD2 PHE 754 HD2 PHE 754 -10.186 -16.252 12.643 325 HE1 PHE 754 HE1 PHE 754 -7.639 -14.552 8.834 326 HE2 PHE 754 HE2 PHE 754 -11.236 -16.209 10.439 327 HZ PHE 754 HZ PHE 754 -9.990 -15.360 8.505 328 H THR 755 HN THR 755 -7.515 -17.814 11.481 329 HA THR 755 HA THR 755 -9.234 -19.644 12.802 330 HB THR 755 HB THR 755 -9.778 -18.782 10.580 331 HG1 THR 755 HG1 THR 755 -10.767 -20.658 10.843 332 HG21 THR 755 HG21 THR 755 -7.539 -18.606 9.638 333 HG22 THR 755 HG22 THR 755 -8.569 -19.563 8.572 334 HG23 THR 755 HG23 THR 755 -7.393 -20.363 9.611 335 H ASN 756 HN ASN 756 -5.992 -19.772 11.608 336 HA ASN 756 HA ASN 756 -5.699 -22.454 12.749 337 HB2 ASN 756 HB2 ASN 756 -4.070 -22.993 10.984 338 HB3 ASN 756 HB1 ASN 756 -5.638 -22.672 10.281 339 HD21 ASN 756 HD21 ASN 756 -2.481 -21.626 10.681 340 HD22 ASN 756 HD22 ASN 756 -2.547 -20.386 9.439 341 H ILE 757 HN ILE 757 -4.000 -22.756 13.961 342 HA ILE 757 HA ILE 757 -2.422 -20.337 14.548 343 HB ILE 757 HB ILE 757 -2.717 -22.771 16.298 344 HG12 ILE 757 HG12 ILE 757 -4.931 -21.755 15.890 345 HG13 ILE 757 HG11 ILE 757 -4.446 -21.556 17.572 346 HG21 ILE 757 HG21 ILE 757 -1.987 -21.243 18.108 347 HG22 ILE 757 HG22 ILE 757 -1.826 -19.947 16.922 348 HG23 ILE 757 HG23 ILE 757 -0.786 -21.365 16.820 349 HD11 ILE 757 HD11 ILE 757 -5.496 -19.549 16.704 350 HD12 ILE 757 HD12 ILE 757 -4.320 -19.490 15.389 351 HD13 ILE 757 HD13 ILE 757 -3.792 -19.239 17.056 352 H THR 758 HN THR 758 -2.256 -23.373 13.154 353 HA THR 758 HA THR 758 0.518 -23.744 13.714 354 HB THR 758 HB THR 758 0.244 -25.624 12.053 355 HG1 THR 758 HG1 THR 758 -1.597 -25.617 11.050 356 HG21 THR 758 HG21 THR 758 0.293 -25.985 14.471 357 HG22 THR 758 HG22 THR 758 -0.877 -27.073 13.723 358 HG23 THR 758 HG23 THR 758 -1.432 -25.633 14.574 359 H TYR 759 HN TYR 759 1.007 -21.709 12.838 360 HA TYR 759 HA TYR 759 0.942 -21.436 9.958 361 HB2 TYR 759 HB2 TYR 759 2.409 -19.285 10.489 362 HB3 TYR 759 HB1 TYR 759 0.684 -19.289 10.814 363 HD1 TYR 759 HD2 TYR 759 -0.145 -19.320 13.182 364 HD2 TYR 759 HD1 TYR 759 4.034 -19.244 12.301 365 HE1 TYR 759 HE2 TYR 759 0.331 -18.689 15.482 366 HE2 TYR 759 HE1 TYR 759 4.500 -18.622 14.610 367 HH TYR 759 HH TYR 759 2.135 -18.812 17.050 368 H ARG 760 HN ARG 760 3.821 -20.982 12.025 369 HA ARG 760 HA ARG 760 5.187 -22.830 10.222 370 HB2 ARG 760 HB2 ARG 760 7.207 -21.637 10.497 371 HB3 ARG 760 HB1 ARG 760 5.909 -20.543 10.043 372 HG2 ARG 760 HG2 ARG 760 5.737 -19.811 12.364 373 HG3 ARG 760 HG1 ARG 760 7.093 -20.873 12.767 374 HD2 ARG 760 HD2 ARG 760 8.356 -19.790 11.023 375 HD3 ARG 760 HD1 ARG 760 7.006 -18.658 10.851 376 HE ARG 760 HE ARG 760 7.469 -18.311 13.420 377 HH11 ARG 760 HH11 ARG 760 9.952 -18.472 10.845 378 HH12 ARG 760 HH12 ARG 760 11.082 -17.560 11.716 379 HH21 ARG 760 HH21 ARG 760 9.125 -17.018 14.596 380 HH22 ARG 760 HH22 ARG 760 10.629 -16.745 13.841 381 H GLY 761 HN GLY 761 4.287 -22.115 13.418 382 HA2 GLY 761 HA2 GLY 761 4.312 -23.580 15.167 383 HA3 GLY 761 HA1 GLY 761 5.495 -24.589 14.327 384 H THR 762 HN THR 762 5.059 -21.568 16.104 385 HA THR 762 HA THR 762 7.771 -21.893 17.104 386 HB THR 762 HB THR 762 7.743 -19.299 17.239 387 HG1 THR 762 HG1 THR 762 5.617 -19.023 16.618 388 HG21 THR 762 HG21 THR 762 9.252 -20.587 15.801 389 HG22 THR 762 HG22 THR 762 8.686 -19.125 14.989 390 HG23 THR 762 HG23 THR 762 7.990 -20.692 14.574 Start of MODEL 10 1 H LYS 716 HT1 LYS 716 0.774 -1.406 -1.329 2 HA LYS 716 HA LYS 716 3.214 0.261 -1.406 3 HB2 LYS 716 HB2 LYS 716 1.274 1.124 -0.037 4 HB3 LYS 716 HB1 LYS 716 1.390 -0.335 0.932 5 HG2 LYS 716 HG2 LYS 716 2.481 1.501 2.062 6 HG3 LYS 716 HG1 LYS 716 3.682 0.300 1.579 7 HD2 LYS 716 HD2 LYS 716 4.335 1.651 -0.316 8 HD3 LYS 716 HD1 LYS 716 3.042 2.804 0.016 9 HE2 LYS 716 HE2 LYS 716 5.228 3.634 0.786 10 HE3 LYS 716 HE1 LYS 716 4.101 3.420 2.121 11 HZ1 LYS 716 HZ1 LYS 716 6.416 2.594 2.523 12 HZ2 LYS 716 HZ2 LYS 716 6.139 1.358 1.409 13 HZ3 LYS 716 HZ3 LYS 716 5.213 1.467 2.797 14 H LEU 717 HN LEU 717 1.737 -2.366 0.507 15 HA LEU 717 HA LEU 717 4.367 -3.465 0.837 16 HB2 LEU 717 HB2 LEU 717 1.726 -4.185 2.070 17 HB3 LEU 717 HB1 LEU 717 3.293 -4.821 2.534 18 HG LEU 717 HG LEU 717 2.571 -1.904 2.752 19 HD11 LEU 717 HD11 LEU 717 2.474 -4.044 4.852 20 HD12 LEU 717 HD12 LEU 717 1.095 -3.188 4.158 21 HD13 LEU 717 HD13 LEU 717 2.284 -2.314 5.129 22 HD21 LEU 717 HD21 LEU 717 4.957 -2.371 2.632 23 HD22 LEU 717 HD22 LEU 717 4.808 -3.539 3.943 24 HD23 LEU 717 HD23 LEU 717 4.508 -1.828 4.249 25 H LEU 718 HN LEU 718 1.169 -5.044 0.487 26 HA LEU 718 HA LEU 718 2.163 -6.241 -2.001 27 HB2 LEU 718 HB2 LEU 718 0.703 -7.668 0.216 28 HB3 LEU 718 HB1 LEU 718 0.761 -8.275 -1.411 29 HG LEU 718 HG LEU 718 3.174 -7.873 0.370 30 HD11 LEU 718 HD11 LEU 718 1.785 -9.755 1.062 31 HD12 LEU 718 HD12 LEU 718 3.302 -10.313 0.355 32 HD13 LEU 718 HD13 LEU 718 1.814 -10.388 -0.583 33 HD21 LEU 718 HD21 LEU 718 3.697 -7.494 -1.987 34 HD22 LEU 718 HD22 LEU 718 2.949 -9.038 -2.405 35 HD23 LEU 718 HD23 LEU 718 4.407 -9.004 -1.416 36 H ILE 719 HN ILE 719 -0.828 -6.052 -0.090 37 HA ILE 719 HA ILE 719 -2.227 -5.468 -2.627 38 HB ILE 719 HB ILE 719 -3.595 -6.603 -0.190 39 HG12 ILE 719 HG12 ILE 719 -1.763 -8.166 -0.807 40 HG13 ILE 719 HG11 ILE 719 -3.346 -8.860 -1.124 41 HG21 ILE 719 HG21 ILE 719 -4.228 -6.660 -3.152 42 HG22 ILE 719 HG22 ILE 719 -4.991 -5.612 -1.953 43 HG23 ILE 719 HG23 ILE 719 -5.229 -7.358 -1.876 44 HD11 ILE 719 HD11 ILE 719 -1.490 -7.648 -3.173 45 HD12 ILE 719 HD12 ILE 719 -3.078 -8.335 -3.512 46 HD13 ILE 719 HD13 ILE 719 -1.779 -9.370 -2.917 47 H THR 720 HN THR 720 -1.627 -4.428 0.574 48 HA THR 720 HA THR 720 -2.023 -2.535 1.674 49 HB THR 720 HB THR 720 -3.012 -1.302 -0.935 50 HG1 THR 720 HG1 THR 720 -1.075 -2.050 -1.513 51 HG21 THR 720 HG21 THR 720 -1.560 -0.125 1.463 52 HG22 THR 720 HG22 THR 720 -3.275 0.089 1.103 53 HG23 THR 720 HG23 THR 720 -2.056 0.768 0.023 54 H ILE 721 HN ILE 721 -4.068 -4.574 1.531 55 HA ILE 721 HA ILE 721 -6.371 -2.921 2.261 56 HB ILE 721 HB ILE 721 -7.926 -4.621 1.416 57 HG12 ILE 721 HG12 ILE 721 -5.610 -5.782 -0.092 58 HG13 ILE 721 HG11 ILE 721 -6.175 -6.534 1.388 59 HG21 ILE 721 HG21 ILE 721 -7.500 -2.662 0.050 60 HG22 ILE 721 HG22 ILE 721 -7.733 -4.068 -0.991 61 HG23 ILE 721 HG23 ILE 721 -6.107 -3.452 -0.693 62 HD11 ILE 721 HD11 ILE 721 -8.400 -6.824 0.291 63 HD12 ILE 721 HD12 ILE 721 -7.092 -7.664 -0.543 64 HD13 ILE 721 HD13 ILE 721 -7.716 -6.143 -1.186 65 H HIS 722 HN HIS 722 -4.783 -6.045 2.533 66 HA HIS 722 HA HIS 722 -6.082 -6.356 5.185 67 HB2 HIS 722 HB2 HIS 722 -4.737 -8.395 3.400 68 HB3 HIS 722 HB1 HIS 722 -5.190 -8.717 5.065 69 HD1 HIS 722 HD1 HIS 722 -6.475 -8.753 1.623 70 HD2 HIS 722 HD2 HIS 722 -7.992 -8.652 5.467 71 HE1 HIS 722 HE1 HIS 722 -8.858 -9.420 1.392 72 HE2 HIS 722 HE2 HIS 722 -9.837 -9.082 3.656 73 H ASP 723 HN ASP 723 -3.359 -5.421 3.658 74 HA ASP 723 HA ASP 723 -1.192 -6.466 5.019 75 HB2 ASP 723 HB2 ASP 723 -1.447 -3.677 3.877 76 HB3 ASP 723 HB1 ASP 723 0.043 -4.569 4.156 77 H ARG 724 HN ARG 724 -3.480 -4.239 6.075 78 HA ARG 724 HA ARG 724 -1.923 -3.729 8.538 79 HB2 ARG 724 HB2 ARG 724 -2.034 -1.788 7.184 80 HB3 ARG 724 HB1 ARG 724 -3.743 -1.945 6.964 81 HG2 ARG 724 HG2 ARG 724 -3.207 -0.159 8.638 82 HG3 ARG 724 HG1 ARG 724 -4.196 -1.506 9.242 83 HD2 ARG 724 HD2 ARG 724 -2.398 -2.493 10.288 84 HD3 ARG 724 HD1 ARG 724 -1.220 -1.331 9.632 85 HE ARG 724 HE ARG 724 -1.884 0.180 11.239 86 HH11 ARG 724 HH11 ARG 724 -4.148 -2.579 11.259 87 HH12 ARG 724 HH12 ARG 724 -4.888 -2.112 12.731 88 HH21 ARG 724 HH21 ARG 724 -2.920 0.767 13.248 89 HH22 ARG 724 HH22 ARG 724 -4.200 -0.174 13.861 90 H LYS 725 HN LYS 725 -4.747 -4.986 7.163 91 HA LYS 725 HA LYS 725 -6.394 -4.116 9.366 92 HB2 LYS 725 HB2 LYS 725 -7.128 -5.552 6.832 93 HB3 LYS 725 HB1 LYS 725 -8.292 -5.229 8.110 94 HG2 LYS 725 HG2 LYS 725 -6.731 -3.162 6.569 95 HG3 LYS 725 HG1 LYS 725 -8.438 -3.559 6.361 96 HD2 LYS 725 HD2 LYS 725 -8.851 -2.867 8.696 97 HD3 LYS 725 HD1 LYS 725 -7.155 -2.405 8.841 98 HE2 LYS 725 HE2 LYS 725 -7.445 -0.775 7.046 99 HE3 LYS 725 HE1 LYS 725 -9.132 -1.248 6.877 100 HZ1 LYS 725 HZ1 LYS 725 -7.866 0.114 9.204 101 HZ2 LYS 725 HZ2 LYS 725 -9.407 -0.559 9.257 102 HZ3 LYS 725 HZ3 LYS 725 -9.089 0.701 8.192 103 H GLU 726 HN GLU 726 -4.807 -6.947 8.361 104 HA GLU 726 HA GLU 726 -6.344 -8.712 9.950 105 HB2 GLU 726 HB2 GLU 726 -4.486 -10.308 9.543 106 HB3 GLU 726 HB1 GLU 726 -5.265 -9.563 8.143 107 HG2 GLU 726 HG2 GLU 726 -3.361 -7.972 8.031 108 HG3 GLU 726 HG1 GLU 726 -2.558 -8.957 9.256 109 H PHE 727 HN PHE 727 -4.182 -6.454 10.658 110 HA PHE 727 HA PHE 727 -3.348 -7.604 13.230 111 HB2 PHE 727 HB2 PHE 727 -3.012 -4.761 12.277 112 HB3 PHE 727 HB1 PHE 727 -2.198 -5.539 13.629 113 HD1 PHE 727 HD2 PHE 727 -0.918 -7.746 12.937 114 HD2 PHE 727 HD1 PHE 727 -1.874 -4.534 10.339 115 HE1 PHE 727 HE2 PHE 727 0.876 -8.433 11.426 116 HE2 PHE 727 HE1 PHE 727 -0.086 -5.219 8.830 117 HZ PHE 727 HZ PHE 727 1.287 -7.165 9.365 118 H ALA 728 HN ALA 728 -6.086 -6.529 12.205 119 HA ALA 728 HA ALA 728 -6.818 -5.097 14.675 120 HB1 ALA 728 HB1 ALA 728 -8.860 -4.398 13.527 121 HB2 ALA 728 HB2 ALA 728 -8.397 -5.349 12.114 122 HB3 ALA 728 HB3 ALA 728 -7.427 -3.955 12.597 123 H LYS 729 HN LYS 729 -7.807 -7.736 12.632 124 HA LYS 729 HA LYS 729 -9.424 -8.783 14.887 125 HB2 LYS 729 HB2 LYS 729 -10.735 -10.071 13.263 126 HB3 LYS 729 HB1 LYS 729 -10.786 -8.320 13.021 127 HG2 LYS 729 HG2 LYS 729 -8.828 -9.904 11.439 128 HG3 LYS 729 HG1 LYS 729 -10.529 -9.970 10.978 129 HD2 LYS 729 HD2 LYS 729 -9.058 -7.373 11.394 130 HD3 LYS 729 HD1 LYS 729 -9.105 -8.202 9.839 131 HE2 LYS 729 HE2 LYS 729 -11.525 -7.321 11.407 132 HE3 LYS 729 HE1 LYS 729 -10.817 -6.435 10.058 133 HZ1 LYS 729 HZ1 LYS 729 -12.004 -9.173 9.914 134 HZ2 LYS 729 HZ2 LYS 729 -11.211 -8.398 8.670 135 HZ3 LYS 729 HZ3 LYS 729 -12.650 -7.739 9.282 136 H PHE 730 HN PHE 730 -6.864 -9.475 12.685 137 HA PHE 730 HA PHE 730 -5.359 -11.141 12.502 138 HB2 PHE 730 HB2 PHE 730 -6.202 -12.136 15.228 139 HB3 PHE 730 HB1 PHE 730 -4.617 -12.156 14.426 140 HD1 PHE 730 HD1 PHE 730 -3.262 -10.168 14.392 141 HD2 PHE 730 HD2 PHE 730 -6.999 -10.229 16.357 142 HE1 PHE 730 HE1 PHE 730 -2.693 -8.095 15.533 143 HE2 PHE 730 HE2 PHE 730 -6.466 -8.189 17.499 144 HZ PHE 730 HZ PHE 730 -4.288 -7.084 17.115 145 H GLU 731 HN GLU 731 -8.144 -11.513 11.804 146 HA GLU 731 HA GLU 731 -8.392 -14.453 11.955 147 HB2 GLU 731 HB2 GLU 731 -10.527 -12.394 11.538 148 HB3 GLU 731 HB1 GLU 731 -10.737 -14.142 11.544 149 HG2 GLU 731 HG2 GLU 731 -9.932 -14.193 13.871 150 HG3 GLU 731 HG1 GLU 731 -9.807 -12.440 13.836 151 H GLU 732 HN GLU 732 -7.452 -12.207 9.957 152 HA GLU 732 HA GLU 732 -8.491 -13.614 7.610 153 HB2 GLU 732 HB2 GLU 732 -7.738 -11.388 6.386 154 HB3 GLU 732 HB1 GLU 732 -9.309 -11.539 7.159 155 HG2 GLU 732 HG2 GLU 732 -8.232 -10.502 9.204 156 HG3 GLU 732 HG1 GLU 732 -6.866 -10.122 8.156 157 H GLU 733 HN GLU 733 -5.599 -11.355 7.555 158 HA GLU 733 HA GLU 733 -3.527 -11.699 7.068 159 HB2 GLU 733 HB2 GLU 733 -3.972 -14.368 8.209 160 HB3 GLU 733 HB1 GLU 733 -2.422 -13.593 7.859 161 HG2 GLU 733 HG2 GLU 733 -2.730 -11.913 9.451 162 HG3 GLU 733 HG1 GLU 733 -4.397 -12.394 9.806 163 H ARG 734 HN ARG 734 -3.667 -11.530 5.137 164 HA ARG 734 HA ARG 734 -3.978 -13.726 3.258 165 HB2 ARG 734 HB2 ARG 734 -2.746 -11.054 2.673 166 HB3 ARG 734 HB1 ARG 734 -3.386 -12.211 1.512 167 HG2 ARG 734 HG2 ARG 734 -4.899 -10.609 3.529 168 HG3 ARG 734 HG1 ARG 734 -4.958 -10.482 1.770 169 HD2 ARG 734 HD2 ARG 734 -5.710 -12.934 3.305 170 HD3 ARG 734 HD1 ARG 734 -6.864 -11.685 2.848 171 HE ARG 734 HE ARG 734 -5.603 -12.377 0.512 172 HH11 ARG 734 HH11 ARG 734 -7.466 -14.166 2.949 173 HH12 ARG 734 HH12 ARG 734 -8.000 -15.386 1.883 174 HH21 ARG 734 HH21 ARG 734 -6.368 -14.047 -0.991 175 HH22 ARG 734 HH22 ARG 734 -7.355 -15.310 -0.409 176 H ALA 735 HN ALA 735 -1.269 -11.788 4.335 177 HA ALA 735 HA ALA 735 0.467 -13.942 3.418 178 HB1 ALA 735 HB1 ALA 735 0.897 -11.787 2.376 179 HB2 ALA 735 HB2 ALA 735 2.249 -12.290 3.393 180 HB3 ALA 735 HB3 ALA 735 1.124 -11.061 3.968 181 H ARG 736 HN ARG 736 -1.115 -13.053 6.062 182 HA ARG 736 HA ARG 736 -0.987 -13.426 8.244 183 HB2 ARG 736 HB2 ARG 736 1.420 -15.164 7.782 184 HB3 ARG 736 HB1 ARG 736 0.160 -15.176 9.028 185 HG2 ARG 736 HG2 ARG 736 -1.463 -16.001 7.505 186 HG3 ARG 736 HG1 ARG 736 -0.365 -15.791 6.138 187 HD2 ARG 736 HD2 ARG 736 -0.104 -17.741 8.418 188 HD3 ARG 736 HD1 ARG 736 -0.406 -18.117 6.723 189 HE ARG 736 HE ARG 736 2.083 -16.704 7.286 190 HH11 ARG 736 HH11 ARG 736 0.527 -19.821 6.680 191 HH12 ARG 736 HH12 ARG 736 1.967 -20.650 6.331 192 HH21 ARG 736 HH21 ARG 736 4.059 -17.817 6.812 193 HH22 ARG 736 HH22 ARG 736 4.054 -19.473 6.394 194 H ALA 737 HN ALA 737 -0.324 -11.189 8.288 195 HA ALA 737 HA ALA 737 0.951 -9.447 9.125 196 HB1 ALA 737 HB1 ALA 737 2.094 -11.635 10.858 197 HB2 ALA 737 HB2 ALA 737 0.593 -10.762 11.165 198 HB3 ALA 737 HB3 ALA 737 2.135 -9.905 11.199 199 H LYS 738 HN LYS 738 1.985 -10.843 6.916 200 HA LYS 738 HA LYS 738 4.774 -11.363 6.977 201 HB2 LYS 738 HB2 LYS 738 3.297 -11.957 5.096 202 HB3 LYS 738 HB1 LYS 738 3.230 -10.247 4.670 203 HG2 LYS 738 HG2 LYS 738 5.679 -10.287 4.307 204 HG3 LYS 738 HG1 LYS 738 5.665 -12.024 4.620 205 HD2 LYS 738 HD2 LYS 738 4.041 -12.279 2.753 206 HD3 LYS 738 HD1 LYS 738 4.245 -10.564 2.401 207 HE2 LYS 738 HE2 LYS 738 6.389 -12.664 2.372 208 HE3 LYS 738 HE1 LYS 738 5.613 -11.942 0.949 209 HZ1 LYS 738 HZ1 LYS 738 6.531 -9.768 1.750 210 HZ2 LYS 738 HZ2 LYS 738 7.727 -10.881 1.317 211 HZ3 LYS 738 HZ3 LYS 738 7.410 -10.611 2.924 212 H TRP 739 HN TRP 739 3.177 -8.545 5.739 213 HA TRP 739 HA TRP 739 5.466 -6.928 5.477 214 HB2 TRP 739 HB2 TRP 739 2.929 -5.553 6.022 215 HB3 TRP 739 HB1 TRP 739 4.046 -5.378 4.674 216 HD1 TRP 739 HD1 TRP 739 3.469 -6.667 2.481 217 HE1 TRP 739 HE1 TRP 739 1.437 -8.110 1.748 218 HE3 TRP 739 HE3 TRP 739 1.225 -7.232 6.915 219 HZ2 TRP 739 HZ2 TRP 739 -0.867 -9.315 2.936 220 HZ3 TRP 739 HZ3 TRP 739 -0.874 -8.499 7.046 221 HH2 TRP 739 HH2 TRP 739 -1.869 -9.497 5.048 222 H ASP 740 HN ASP 740 2.915 -7.058 7.922 223 HA ASP 740 HA ASP 740 2.800 -6.446 10.190 224 HB2 ASP 740 HB2 ASP 740 4.754 -8.205 10.018 225 HB3 ASP 740 HB1 ASP 740 5.760 -6.781 10.377 226 H THR 741 HN THR 741 3.378 -4.351 8.262 227 HA THR 741 HA THR 741 5.379 -2.537 9.000 228 HB THR 741 HB THR 741 4.182 -2.467 6.841 229 HG1 THR 741 HG1 THR 741 5.312 -0.628 7.593 230 HG21 THR 741 HG21 THR 741 1.917 -1.246 8.437 231 HG22 THR 741 HG22 THR 741 1.899 -2.824 7.652 232 HG23 THR 741 HG23 THR 741 1.989 -1.359 6.678 233 H ALA 742 HN ALA 742 2.279 -3.027 10.378 234 HA ALA 742 HA ALA 742 2.132 -0.459 11.731 235 HB1 ALA 742 HB1 ALA 742 0.444 -2.920 12.117 236 HB2 ALA 742 HB2 ALA 742 0.100 -1.598 11.002 237 HB3 ALA 742 HB3 ALA 742 0.098 -1.309 12.744 238 H ASN 743 HN ASN 743 4.110 -2.888 12.241 239 HA ASN 743 HA ASN 743 3.952 -2.654 15.152 240 HB2 ASN 743 HB2 ASN 743 4.901 -5.034 13.566 241 HB3 ASN 743 HB1 ASN 743 4.758 -4.925 15.313 242 HD21 ASN 743 HD21 ASN 743 3.015 -5.060 12.309 243 HD22 ASN 743 HD22 ASN 743 1.533 -5.632 12.972 244 H ASN 744 HN ASN 744 6.089 -3.613 12.493 245 HA ASN 744 HA ASN 744 8.144 -1.839 13.445 246 HB2 ASN 744 HB2 ASN 744 9.831 -3.827 13.189 247 HB3 ASN 744 HB1 ASN 744 8.875 -3.751 14.661 248 HD21 ASN 744 HD21 ASN 744 9.185 -5.290 11.528 249 HD22 ASN 744 HD22 ASN 744 8.290 -6.696 11.959 250 HA PRO 745 HA PRO 745 9.286 -1.240 9.190 251 HB2 PRO 745 HB2 PRO 745 11.698 -2.358 8.548 252 HB3 PRO 745 HB1 PRO 745 11.546 -0.906 9.545 253 HG2 PRO 745 HG2 PRO 745 11.927 -3.750 10.392 254 HG3 PRO 745 HG1 PRO 745 12.740 -2.309 11.005 255 HD2 PRO 745 HD2 PRO 745 10.741 -3.470 12.302 256 HD3 PRO 745 HD1 PRO 745 10.923 -1.724 12.332 257 H LEU 746 HN LEU 746 10.435 -4.498 9.721 258 HA LEU 746 HA LEU 746 8.667 -5.373 7.559 259 HB2 LEU 746 HB2 LEU 746 10.374 -7.273 7.293 260 HB3 LEU 746 HB1 LEU 746 10.742 -5.710 6.574 261 HG LEU 746 HG LEU 746 11.835 -6.107 9.301 262 HD11 LEU 746 HD11 LEU 746 13.661 -7.528 8.536 263 HD12 LEU 746 HD12 LEU 746 12.836 -7.761 6.986 264 HD13 LEU 746 HD13 LEU 746 12.104 -8.343 8.490 265 HD21 LEU 746 HD21 LEU 746 13.019 -5.195 6.690 266 HD22 LEU 746 HD22 LEU 746 13.795 -5.113 8.280 267 HD23 LEU 746 HD23 LEU 746 12.337 -4.172 7.957 268 H PTR 747 HN PTR 747 10.661 -7.285 9.660 269 HA PTR 747 HA PTR 747 8.801 -7.854 11.579 270 HB2 PTR 747 HB2 PTR 747 8.364 -10.255 11.045 271 HB3 PTR 747 HB1 PTR 747 7.443 -9.099 10.123 272 HD1 PTR 747 HD1 PTR 747 9.175 -12.101 9.854 273 HD2 PTR 747 HD2 PTR 747 8.692 -8.428 7.811 274 HE1 PTR 747 HE1 PTR 747 9.835 -13.182 7.746 275 HE2 PTR 747 HE2 PTR 747 9.348 -9.477 5.731 276 H LYS 748 HN LYS 748 10.508 -7.348 12.621 277 HA LYS 748 HA LYS 748 12.834 -9.105 12.568 278 HB2 LYS 748 HB2 LYS 748 13.771 -7.288 14.014 279 HB3 LYS 748 HB1 LYS 748 13.363 -6.818 12.368 280 HG2 LYS 748 HG2 LYS 748 11.149 -5.928 13.308 281 HG3 LYS 748 HG1 LYS 748 11.877 -6.179 14.897 282 HD2 LYS 748 HD2 LYS 748 13.119 -4.605 12.715 283 HD3 LYS 748 HD1 LYS 748 11.944 -3.964 13.879 284 HE2 LYS 748 HE2 LYS 748 14.527 -5.309 14.588 285 HE3 LYS 748 HE1 LYS 748 14.293 -3.556 14.496 286 HZ1 LYS 748 HZ1 LYS 748 12.567 -3.756 16.197 287 HZ2 LYS 748 HZ2 LYS 748 14.053 -4.255 16.793 288 HZ3 LYS 748 HZ3 LYS 748 12.875 -5.401 16.394 289 H GLU 749 HN GLU 749 9.985 -8.578 14.200 290 HA GLU 749 HA GLU 749 11.044 -9.464 16.760 291 HB2 GLU 749 HB2 GLU 749 8.284 -8.466 16.063 292 HB3 GLU 749 HB1 GLU 749 8.912 -8.779 17.674 293 HG2 GLU 749 HG2 GLU 749 9.923 -6.683 15.769 294 HG3 GLU 749 HG1 GLU 749 8.867 -6.393 17.148 295 H ALA 750 HN ALA 750 7.969 -10.057 15.050 296 HA ALA 750 HA ALA 750 8.363 -12.827 14.808 297 HB1 ALA 750 HB1 ALA 750 8.015 -12.755 17.242 298 HB2 ALA 750 HB2 ALA 750 6.669 -13.550 16.423 299 HB3 ALA 750 HB3 ALA 750 6.494 -11.893 16.997 300 H THR 751 HN THR 751 6.840 -13.629 13.431 301 HA THR 751 HA THR 751 4.967 -11.714 12.404 302 HB THR 751 HB THR 751 4.759 -13.967 10.895 303 HG1 THR 751 HG1 THR 751 7.509 -13.663 11.561 304 HG21 THR 751 HG21 THR 751 5.039 -11.675 10.068 305 HG22 THR 751 HG22 THR 751 6.187 -12.755 9.278 306 HG23 THR 751 HG23 THR 751 6.723 -11.689 10.579 307 H SER 752 HN SER 752 2.763 -12.243 12.163 308 HA SER 752 HA SER 752 1.847 -14.047 14.264 309 HB2 SER 752 HB2 SER 752 0.398 -11.784 12.912 310 HB3 SER 752 HB1 SER 752 -0.162 -12.730 14.289 311 HG SER 752 HG SER 752 2.013 -10.951 14.137 312 H THR 753 HN THR 753 0.096 -15.396 13.926 313 HA THR 753 HA THR 753 -1.359 -15.604 11.596 314 HB THR 753 HB THR 753 0.555 -16.414 10.420 315 HG1 THR 753 HG1 THR 753 -1.382 -17.604 10.138 316 HG21 THR 753 HG21 THR 753 0.973 -18.389 12.685 317 HG22 THR 753 HG22 THR 753 1.990 -16.990 12.334 318 HG23 THR 753 HG23 THR 753 1.916 -18.332 11.193 319 H PHE 754 HN PHE 754 -3.045 -16.851 11.946 320 HA PHE 754 HA PHE 754 -3.133 -18.280 14.503 321 HB2 PHE 754 HB2 PHE 754 -5.599 -18.182 14.290 322 HB3 PHE 754 HB1 PHE 754 -4.824 -16.602 14.193 323 HD1 PHE 754 HD1 PHE 754 -4.510 -15.559 11.918 324 HD2 PHE 754 HD2 PHE 754 -7.034 -18.904 12.583 325 HE1 PHE 754 HE1 PHE 754 -5.664 -15.076 9.842 326 HE2 PHE 754 HE2 PHE 754 -8.214 -18.435 10.484 327 HZ PHE 754 HZ PHE 754 -7.537 -16.521 9.101 328 H THR 755 HN THR 755 -3.257 -18.782 11.131 329 HA THR 755 HA THR 755 -4.500 -21.353 11.209 330 HB THR 755 HB THR 755 -3.702 -21.564 8.857 331 HG1 THR 755 HG1 THR 755 -2.907 -18.874 8.942 332 HG21 THR 755 HG21 THR 755 -5.820 -20.559 9.372 333 HG22 THR 755 HG22 THR 755 -5.058 -19.625 8.051 334 HG23 THR 755 HG23 THR 755 -5.000 -19.053 9.739 335 H ASN 756 HN ASN 756 -1.457 -20.298 11.952 336 HA ASN 756 HA ASN 756 0.265 -22.363 11.264 337 HB2 ASN 756 HB2 ASN 756 1.648 -21.765 13.250 338 HB3 ASN 756 HB1 ASN 756 1.128 -20.310 12.377 339 HD21 ASN 756 HD21 ASN 756 -1.605 -20.452 13.623 340 HD22 ASN 756 HD22 ASN 756 -1.259 -20.018 15.269 341 H ILE 757 HN ILE 757 -1.767 -22.248 13.986 342 HA ILE 757 HA ILE 757 -0.991 -24.945 14.744 343 HB ILE 757 HB ILE 757 -2.671 -24.651 16.614 344 HG12 ILE 757 HG12 ILE 757 -2.974 -22.135 17.237 345 HG13 ILE 757 HG11 ILE 757 -2.638 -21.831 15.540 346 HG21 ILE 757 HG21 ILE 757 -0.270 -24.526 16.978 347 HG22 ILE 757 HG22 ILE 757 -1.069 -23.299 17.967 348 HG23 ILE 757 HG23 ILE 757 -0.256 -22.836 16.472 349 HD11 ILE 757 HD11 ILE 757 -5.026 -21.870 15.985 350 HD12 ILE 757 HD12 ILE 757 -4.883 -23.507 16.630 351 HD13 ILE 757 HD13 ILE 757 -4.560 -23.201 14.925 352 H THR 758 HN THR 758 -3.073 -23.755 12.650 353 HA THR 758 HA THR 758 -5.173 -25.753 13.024 354 HB THR 758 HB THR 758 -4.961 -23.879 10.700 355 HG1 THR 758 HG1 THR 758 -6.037 -23.252 13.289 356 HG21 THR 758 HG21 THR 758 -7.302 -24.970 12.283 357 HG22 THR 758 HG22 THR 758 -6.764 -25.543 10.702 358 HG23 THR 758 HG23 THR 758 -7.430 -23.919 10.872 359 H TYR 759 HN TYR 759 -2.534 -26.621 12.448 360 HA TYR 759 HA TYR 759 -1.858 -27.283 9.846 361 HB2 TYR 759 HB2 TYR 759 -1.136 -29.607 11.169 362 HB3 TYR 759 HB1 TYR 759 -0.167 -28.143 11.092 363 HD1 TYR 759 HD1 TYR 759 -2.586 -30.061 13.245 364 HD2 TYR 759 HD2 TYR 759 0.230 -26.847 13.050 365 HE1 TYR 759 HE1 TYR 759 -2.684 -29.847 15.635 366 HE2 TYR 759 HE2 TYR 759 0.137 -26.640 15.494 367 HH TYR 759 HH TYR 759 -1.309 -28.974 17.503 368 H ARG 760 HN ARG 760 -3.645 -29.474 11.973 369 HA ARG 760 HA ARG 760 -5.067 -30.497 9.602 370 HB2 ARG 760 HB2 ARG 760 -4.532 -32.071 12.103 371 HB3 ARG 760 HB1 ARG 760 -5.045 -32.661 10.533 372 HG2 ARG 760 HG2 ARG 760 -2.389 -31.458 11.152 373 HG3 ARG 760 HG1 ARG 760 -2.727 -33.181 11.113 374 HD2 ARG 760 HD2 ARG 760 -2.991 -31.226 8.827 375 HD3 ARG 760 HD1 ARG 760 -1.699 -32.405 9.014 376 HE ARG 760 HE ARG 760 -4.331 -33.572 8.945 377 HH11 ARG 760 HH11 ARG 760 -1.586 -32.453 7.032 378 HH12 ARG 760 HH12 ARG 760 -1.949 -33.346 5.639 379 HH21 ARG 760 HH21 ARG 760 -4.904 -34.865 6.998 380 HH22 ARG 760 HH22 ARG 760 -3.906 -34.740 5.641 381 H GLY 761 HN GLY 761 -5.172 -30.633 13.094 382 HA2 GLY 761 HA2 GLY 761 -7.163 -29.132 13.845 383 HA3 GLY 761 HA1 GLY 761 -8.057 -30.511 13.153 384 H THR 762 HN THR 762 -5.200 -29.947 15.119 385 HA THR 762 HA THR 762 -5.901 -32.337 16.635 386 HB THR 762 HB THR 762 -3.191 -31.025 16.487 387 HG1 THR 762 HG1 THR 762 -4.431 -32.894 14.725 388 HG21 THR 762 HG21 THR 762 -2.422 -33.274 17.032 389 HG22 THR 762 HG22 THR 762 -4.091 -33.861 17.039 390 HG23 THR 762 HG23 THR 762 -3.551 -32.695 18.258 Start of MODEL 11 1 H LYS 716 HT1 LYS 716 1.385 0.264 3.651 2 HA LYS 716 HA LYS 716 0.433 1.689 1.233 3 HB2 LYS 716 HB2 LYS 716 2.424 3.124 1.453 4 HB3 LYS 716 HB1 LYS 716 1.323 3.227 2.823 5 HG2 LYS 716 HG2 LYS 716 2.774 1.907 4.188 6 HG3 LYS 716 HG1 LYS 716 3.840 1.585 2.817 7 HD2 LYS 716 HD2 LYS 716 4.446 3.921 2.686 8 HD3 LYS 716 HD1 LYS 716 3.277 4.325 3.944 9 HE2 LYS 716 HE2 LYS 716 4.528 3.043 5.563 10 HE3 LYS 716 HE1 LYS 716 5.643 2.495 4.315 11 HZ1 LYS 716 HZ1 LYS 716 6.472 4.681 4.052 12 HZ2 LYS 716 HZ2 LYS 716 6.468 4.357 5.717 13 HZ3 LYS 716 HZ3 LYS 716 5.263 5.344 5.037 14 H LEU 717 HN LEU 717 2.084 -1.055 2.378 15 HA LEU 717 HA LEU 717 4.132 -1.116 0.425 16 HB2 LEU 717 HB2 LEU 717 2.987 -3.152 2.321 17 HB3 LEU 717 HB1 LEU 717 4.206 -3.575 1.147 18 HG LEU 717 HG LEU 717 5.163 -3.261 3.310 19 HD11 LEU 717 HD11 LEU 717 6.918 -1.611 2.771 20 HD12 LEU 717 HD12 LEU 717 5.918 -1.018 1.445 21 HD13 LEU 717 HD13 LEU 717 6.542 -2.668 1.411 22 HD21 LEU 717 HD21 LEU 717 5.220 -1.068 4.436 23 HD22 LEU 717 HD22 LEU 717 3.589 -1.730 4.302 24 HD23 LEU 717 HD23 LEU 717 4.109 -0.445 3.214 25 H LEU 718 HN LEU 718 1.569 -3.525 0.854 26 HA LEU 718 HA LEU 718 1.405 -3.586 -2.070 27 HB2 LEU 718 HB2 LEU 718 1.043 -5.901 -0.176 28 HB3 LEU 718 HB1 LEU 718 0.784 -5.976 -1.907 29 HG LEU 718 HG LEU 718 3.389 -5.575 -0.453 30 HD11 LEU 718 HD11 LEU 718 2.659 -7.874 -0.567 31 HD12 LEU 718 HD12 LEU 718 4.044 -7.617 -1.621 32 HD13 LEU 718 HD13 LEU 718 2.426 -7.729 -2.308 33 HD21 LEU 718 HD21 LEU 718 3.331 -4.100 -2.400 34 HD22 LEU 718 HD22 LEU 718 2.876 -5.460 -3.427 35 HD23 LEU 718 HD23 LEU 718 4.463 -5.429 -2.651 36 H ILE 719 HN ILE 719 -0.722 -4.893 0.559 37 HA ILE 719 HA ILE 719 -2.867 -4.098 -1.181 38 HB ILE 719 HB ILE 719 -4.254 -5.589 0.261 39 HG12 ILE 719 HG12 ILE 719 -1.563 -6.389 1.398 40 HG13 ILE 719 HG11 ILE 719 -2.834 -5.542 2.271 41 HG21 ILE 719 HG21 ILE 719 -1.870 -6.816 -1.115 42 HG22 ILE 719 HG22 ILE 719 -3.393 -6.340 -1.873 43 HG23 ILE 719 HG23 ILE 719 -3.363 -7.662 -0.711 44 HD11 ILE 719 HD11 ILE 719 -4.286 -7.473 2.034 45 HD12 ILE 719 HD12 ILE 719 -2.772 -7.901 2.825 46 HD13 ILE 719 HD13 ILE 719 -3.029 -8.310 1.127 47 H THR 720 HN THR 720 -1.844 -3.744 2.254 48 HA THR 720 HA THR 720 -2.570 -2.411 3.900 49 HB THR 720 HB THR 720 -3.550 -0.461 1.780 50 HG1 THR 720 HG1 THR 720 -1.638 -0.738 0.988 51 HG21 THR 720 HG21 THR 720 -2.698 1.220 3.370 52 HG22 THR 720 HG22 THR 720 -2.137 -0.064 4.439 53 HG23 THR 720 HG23 THR 720 -3.866 0.159 4.160 54 H ILE 721 HN ILE 721 -4.478 -4.316 2.666 55 HA ILE 721 HA ILE 721 -7.006 -3.155 3.636 56 HB ILE 721 HB ILE 721 -8.207 -4.701 2.007 57 HG12 ILE 721 HG12 ILE 721 -5.524 -4.744 0.624 58 HG13 ILE 721 HG11 ILE 721 -6.140 -6.146 1.470 59 HG21 ILE 721 HG21 ILE 721 -8.105 -2.304 1.634 60 HG22 ILE 721 HG22 ILE 721 -7.981 -3.162 0.098 61 HG23 ILE 721 HG23 ILE 721 -6.538 -2.471 0.842 62 HD11 ILE 721 HD11 ILE 721 -6.492 -6.358 -0.904 63 HD12 ILE 721 HD12 ILE 721 -7.326 -4.804 -0.965 64 HD13 ILE 721 HD13 ILE 721 -8.058 -6.165 -0.117 65 H HIS 722 HN HIS 722 -5.282 -6.175 3.020 66 HA HIS 722 HA HIS 722 -6.623 -7.274 5.387 67 HB2 HIS 722 HB2 HIS 722 -5.170 -8.540 3.089 68 HB3 HIS 722 HB1 HIS 722 -5.258 -9.292 4.690 69 HD1 HIS 722 HD1 HIS 722 -7.150 -8.904 1.552 70 HD2 HIS 722 HD2 HIS 722 -7.887 -9.854 5.504 71 HE1 HIS 722 HE1 HIS 722 -9.402 -9.949 1.548 72 HE2 HIS 722 HE2 HIS 722 -9.600 -10.895 3.834 73 H ASP 723 HN ASP 723 -4.158 -5.511 4.499 74 HA ASP 723 HA ASP 723 -1.755 -6.501 5.353 75 HB2 ASP 723 HB2 ASP 723 -2.714 -4.115 4.457 76 HB3 ASP 723 HB1 ASP 723 -2.328 -3.722 6.125 77 H ARG 724 HN ARG 724 -4.177 -4.719 7.173 78 HA ARG 724 HA ARG 724 -2.734 -5.162 9.628 79 HB2 ARG 724 HB2 ARG 724 -4.228 -3.104 8.510 80 HB3 ARG 724 HB1 ARG 724 -5.197 -3.734 9.816 81 HG2 ARG 724 HG2 ARG 724 -2.348 -2.822 10.059 82 HG3 ARG 724 HG1 ARG 724 -3.818 -1.931 10.489 83 HD2 ARG 724 HD2 ARG 724 -4.388 -3.666 12.134 84 HD3 ARG 724 HD1 ARG 724 -2.935 -4.557 11.702 85 HE ARG 724 HE ARG 724 -2.743 -1.826 12.757 86 HH11 ARG 724 HH11 ARG 724 -2.033 -5.281 13.083 87 HH12 ARG 724 HH12 ARG 724 -0.968 -5.102 14.414 88 HH21 ARG 724 HH21 ARG 724 -1.271 -1.586 14.631 89 HH22 ARG 724 HH22 ARG 724 -0.519 -2.947 15.319 90 H LYS 725 HN LYS 725 -5.350 -6.471 7.841 91 HA LYS 725 HA LYS 725 -6.930 -6.984 10.166 92 HB2 LYS 725 HB2 LYS 725 -7.352 -7.830 7.305 93 HB3 LYS 725 HB1 LYS 725 -8.491 -8.127 8.612 94 HG2 LYS 725 HG2 LYS 725 -8.577 -5.635 8.958 95 HG3 LYS 725 HG1 LYS 725 -7.656 -5.483 7.459 96 HD2 LYS 725 HD2 LYS 725 -10.018 -5.224 6.984 97 HD3 LYS 725 HD1 LYS 725 -9.442 -6.742 6.287 98 HE2 LYS 725 HE2 LYS 725 -11.571 -7.142 7.352 99 HE3 LYS 725 HE1 LYS 725 -10.287 -7.922 8.277 100 HZ1 LYS 725 HZ1 LYS 725 -11.569 -5.323 8.951 101 HZ2 LYS 725 HZ2 LYS 725 -10.364 -6.050 9.872 102 HZ3 LYS 725 HZ3 LYS 725 -11.877 -6.782 9.723 103 H GLU 726 HN GLU 726 -4.580 -8.674 8.304 104 HA GLU 726 HA GLU 726 -5.309 -11.174 9.419 105 HB2 GLU 726 HB2 GLU 726 -3.088 -11.952 8.500 106 HB3 GLU 726 HB1 GLU 726 -4.292 -11.259 7.413 107 HG2 GLU 726 HG2 GLU 726 -3.010 -9.114 7.518 108 HG3 GLU 726 HG1 GLU 726 -1.728 -10.023 8.329 109 H PHE 727 HN PHE 727 -3.759 -8.555 10.526 110 HA PHE 727 HA PHE 727 -2.624 -10.013 12.835 111 HB2 PHE 727 HB2 PHE 727 -2.802 -7.022 12.565 112 HB3 PHE 727 HB1 PHE 727 -1.794 -8.011 13.618 113 HD1 PHE 727 HD2 PHE 727 -0.633 -9.913 11.780 114 HD2 PHE 727 HD1 PHE 727 -1.405 -5.779 11.279 115 HE1 PHE 727 HE2 PHE 727 1.150 -9.778 10.126 116 HE2 PHE 727 HE1 PHE 727 0.380 -5.640 9.618 117 HZ PHE 727 HZ PHE 727 1.655 -7.637 9.042 118 H ALA 728 HN ALA 728 -5.530 -9.187 11.950 119 HA ALA 728 HA ALA 728 -6.371 -8.335 14.628 120 HB1 ALA 728 HB1 ALA 728 -8.439 -7.558 13.605 121 HB2 ALA 728 HB2 ALA 728 -7.887 -8.146 12.035 122 HB3 ALA 728 HB3 ALA 728 -7.036 -6.825 12.829 123 H LYS 729 HN LYS 729 -7.645 -10.340 11.935 124 HA LYS 729 HA LYS 729 -8.951 -11.991 13.907 125 HB2 LYS 729 HB2 LYS 729 -9.025 -12.240 10.938 126 HB3 LYS 729 HB1 LYS 729 -10.222 -12.763 12.119 127 HG2 LYS 729 HG2 LYS 729 -11.011 -10.627 12.459 128 HG3 LYS 729 HG1 LYS 729 -9.546 -9.883 11.814 129 HD2 LYS 729 HD2 LYS 729 -11.125 -9.594 10.211 130 HD3 LYS 729 HD1 LYS 729 -10.095 -10.909 9.673 131 HE2 LYS 729 HE2 LYS 729 -11.666 -12.567 10.509 132 HE3 LYS 729 HE1 LYS 729 -12.790 -11.294 10.990 133 HZ1 LYS 729 HZ1 LYS 729 -13.422 -12.277 8.846 134 HZ2 LYS 729 HZ2 LYS 729 -11.919 -11.949 8.227 135 HZ3 LYS 729 HZ3 LYS 729 -12.964 -10.667 8.592 136 H PHE 730 HN PHE 730 -6.317 -11.998 11.593 137 HA PHE 730 HA PHE 730 -4.732 -13.461 11.005 138 HB2 PHE 730 HB2 PHE 730 -5.321 -15.028 13.535 139 HB3 PHE 730 HB1 PHE 730 -3.824 -14.882 12.591 140 HD1 PHE 730 HD2 PHE 730 -6.165 -13.145 14.721 141 HD2 PHE 730 HD1 PHE 730 -2.268 -13.272 13.164 142 HE1 PHE 730 HE2 PHE 730 -5.612 -11.463 16.211 143 HE2 PHE 730 HE1 PHE 730 -1.575 -11.493 14.711 144 HZ PHE 730 HZ PHE 730 -3.227 -10.549 16.285 145 H GLU 731 HN GLU 731 -6.921 -13.793 9.865 146 HA GLU 731 HA GLU 731 -7.124 -16.732 9.531 147 HB2 GLU 731 HB2 GLU 731 -9.406 -14.793 9.312 148 HB3 GLU 731 HB1 GLU 731 -9.476 -16.512 8.958 149 HG2 GLU 731 HG2 GLU 731 -8.702 -16.866 11.352 150 HG3 GLU 731 HG1 GLU 731 -9.046 -15.170 11.604 151 H GLU 732 HN GLU 732 -6.568 -13.804 8.118 152 HA GLU 732 HA GLU 732 -7.200 -14.768 5.450 153 HB2 GLU 732 HB2 GLU 732 -6.565 -12.333 4.792 154 HB3 GLU 732 HB1 GLU 732 -8.101 -12.653 5.579 155 HG2 GLU 732 HG2 GLU 732 -5.685 -11.750 7.183 156 HG3 GLU 732 HG1 GLU 732 -6.752 -10.614 6.365 157 H GLU 733 HN GLU 733 -4.495 -12.485 6.162 158 HA GLU 733 HA GLU 733 -2.415 -12.422 5.534 159 HB2 GLU 733 HB2 GLU 733 -2.487 -15.337 5.813 160 HB3 GLU 733 HB1 GLU 733 -1.089 -14.252 5.722 161 HG2 GLU 733 HG2 GLU 733 -1.514 -13.250 7.773 162 HG3 GLU 733 HG1 GLU 733 -3.113 -13.981 7.914 163 H ARG 734 HN ARG 734 -2.839 -11.746 3.688 164 HA ARG 734 HA ARG 734 -2.858 -13.406 1.326 165 HB2 ARG 734 HB2 ARG 734 -2.159 -10.485 1.499 166 HB3 ARG 734 HB1 ARG 734 -2.605 -11.371 0.045 167 HG2 ARG 734 HG2 ARG 734 -4.329 -10.720 2.401 168 HG3 ARG 734 HG1 ARG 734 -4.482 -10.131 0.741 169 HD2 ARG 734 HD2 ARG 734 -4.702 -12.977 1.608 170 HD3 ARG 734 HD1 ARG 734 -6.073 -11.906 1.348 171 HE ARG 734 HE ARG 734 -4.460 -11.916 -0.975 172 HH11 ARG 734 HH11 ARG 734 -6.631 -14.151 0.735 173 HH12 ARG 734 HH12 ARG 734 -6.957 -15.067 -0.658 174 HH21 ARG 734 HH21 ARG 734 -4.915 -13.165 -2.815 175 HH22 ARG 734 HH22 ARG 734 -5.966 -14.521 -2.738 176 H ALA 735 HN ALA 735 -0.446 -11.561 3.048 177 HA ALA 735 HA ALA 735 1.577 -13.059 1.552 178 HB1 ALA 735 HB1 ALA 735 1.631 -10.692 0.964 179 HB2 ALA 735 HB2 ALA 735 3.097 -11.178 1.819 180 HB3 ALA 735 HB3 ALA 735 1.844 -10.274 2.663 181 H ARG 736 HN ARG 736 0.055 -12.865 4.410 182 HA ARG 736 HA ARG 736 0.399 -13.880 6.381 183 HB2 ARG 736 HB2 ARG 736 1.514 -15.629 4.912 184 HB3 ARG 736 HB1 ARG 736 2.966 -14.669 5.256 185 HG2 ARG 736 HG2 ARG 736 2.931 -15.228 7.546 186 HG3 ARG 736 HG1 ARG 736 1.355 -16.015 7.388 187 HD2 ARG 736 HD2 ARG 736 3.881 -16.922 6.022 188 HD3 ARG 736 HD1 ARG 736 3.238 -17.609 7.514 189 HE ARG 736 HE ARG 736 1.259 -17.644 5.512 190 HH11 ARG 736 HH11 ARG 736 4.266 -19.264 6.442 191 HH12 ARG 736 HH12 ARG 736 3.903 -20.729 5.654 192 HH21 ARG 736 HH21 ARG 736 0.734 -19.675 4.396 193 HH22 ARG 736 HH22 ARG 736 1.829 -20.968 4.459 194 H ALA 737 HN ALA 737 0.658 -11.545 6.800 195 HA ALA 737 HA ALA 737 1.513 -9.880 8.208 196 HB1 ALA 737 HB1 ALA 737 3.287 -12.097 9.232 197 HB2 ALA 737 HB2 ALA 737 1.657 -11.738 9.802 198 HB3 ALA 737 HB3 ALA 737 2.954 -10.569 10.046 199 H LYS 738 HN LYS 738 2.834 -10.721 5.771 200 HA LYS 738 HA LYS 738 5.614 -10.414 5.681 201 HB2 LYS 738 HB2 LYS 738 4.377 -11.090 3.705 202 HB3 LYS 738 HB1 LYS 738 3.667 -9.484 3.592 203 HG2 LYS 738 HG2 LYS 738 5.419 -9.730 1.941 204 HG3 LYS 738 HG1 LYS 738 5.897 -8.543 3.154 205 HD2 LYS 738 HD2 LYS 738 7.278 -10.222 4.262 206 HD3 LYS 738 HD1 LYS 738 6.768 -11.431 3.081 207 HE2 LYS 738 HE2 LYS 738 7.758 -10.051 1.290 208 HE3 LYS 738 HE1 LYS 738 8.326 -8.914 2.510 209 HZ1 LYS 738 HZ1 LYS 738 10.059 -10.453 1.846 210 HZ2 LYS 738 HZ2 LYS 738 9.116 -11.773 2.332 211 HZ3 LYS 738 HZ3 LYS 738 9.683 -10.687 3.467 212 H TRP 739 HN TRP 739 3.405 -7.776 4.873 213 HA TRP 739 HA TRP 739 5.489 -5.871 4.754 214 HB2 TRP 739 HB2 TRP 739 2.795 -4.830 5.172 215 HB3 TRP 739 HB1 TRP 739 3.935 -4.529 3.870 216 HD1 TRP 739 HD1 TRP 739 3.470 -5.709 1.650 217 HE1 TRP 739 HE1 TRP 739 1.630 -7.376 0.817 218 HE3 TRP 739 HE3 TRP 739 1.391 -6.898 6.048 219 HZ2 TRP 739 HZ2 TRP 739 -0.384 -8.920 1.883 220 HZ3 TRP 739 HZ3 TRP 739 -0.522 -8.480 6.103 221 HH2 TRP 739 HH2 TRP 739 -1.382 -9.468 4.033 222 H ASP 740 HN ASP 740 2.844 -6.466 7.028 223 HA ASP 740 HA ASP 740 2.452 -5.860 9.197 224 HB2 ASP 740 HB2 ASP 740 4.825 -6.555 9.597 225 HB3 ASP 740 HB1 ASP 740 5.288 -4.864 9.292 226 H THR 741 HN THR 741 1.124 -4.274 9.463 227 HA THR 741 HA THR 741 1.512 -1.896 7.937 228 HB THR 741 HB THR 741 -0.815 -2.201 9.713 229 HG1 THR 741 HG1 THR 741 -0.359 -3.844 7.405 230 HG21 THR 741 HG21 THR 741 -0.426 -1.566 6.785 231 HG22 THR 741 HG22 THR 741 -0.624 -0.391 8.090 232 HG23 THR 741 HG23 THR 741 -1.954 -1.472 7.670 233 H ALA 742 HN ALA 742 1.602 -2.788 11.355 234 HA ALA 742 HA ALA 742 2.342 -0.096 12.102 235 HB1 ALA 742 HB1 ALA 742 -0.241 -1.225 12.980 236 HB2 ALA 742 HB2 ALA 742 -0.058 0.114 11.823 237 HB3 ALA 742 HB3 ALA 742 0.418 0.318 13.532 238 H ASN 743 HN ASN 743 3.293 -2.936 12.526 239 HA ASN 743 HA ASN 743 3.218 -2.897 15.456 240 HB2 ASN 743 HB2 ASN 743 4.081 -5.260 13.776 241 HB3 ASN 743 HB1 ASN 743 3.558 -5.256 15.448 242 HD21 ASN 743 HD21 ASN 743 2.640 -4.986 12.272 243 HD22 ASN 743 HD22 ASN 743 0.968 -5.434 12.315 244 H ASN 744 HN ASN 744 5.238 -3.606 12.622 245 HA ASN 744 HA ASN 744 7.422 -2.128 13.635 246 HB2 ASN 744 HB2 ASN 744 8.976 -4.094 13.532 247 HB3 ASN 744 HB1 ASN 744 7.862 -4.172 14.898 248 HD21 ASN 744 HD21 ASN 744 8.906 -5.558 11.965 249 HD22 ASN 744 HD22 ASN 744 7.846 -6.933 12.026 250 HA PRO 745 HA PRO 745 8.236 -1.675 9.340 251 HB2 PRO 745 HB2 PRO 745 10.844 -2.193 8.840 252 HB3 PRO 745 HB1 PRO 745 10.323 -0.802 9.802 253 HG2 PRO 745 HG2 PRO 745 11.309 -3.470 10.719 254 HG3 PRO 745 HG1 PRO 745 11.764 -1.883 11.328 255 HD2 PRO 745 HD2 PRO 745 10.004 -3.462 12.565 256 HD3 PRO 745 HD1 PRO 745 9.849 -1.710 12.618 257 H LEU 746 HN LEU 746 9.757 -4.700 10.299 258 HA LEU 746 HA LEU 746 8.500 -5.982 8.017 259 HB2 LEU 746 HB2 LEU 746 10.656 -7.339 7.723 260 HB3 LEU 746 HB1 LEU 746 10.605 -5.717 7.067 261 HG LEU 746 HG LEU 746 11.714 -5.818 9.782 262 HD11 LEU 746 HD11 LEU 746 13.839 -6.784 9.083 263 HD12 LEU 746 HD12 LEU 746 13.114 -7.270 7.542 264 HD13 LEU 746 HD13 LEU 746 12.522 -7.946 9.067 265 HD21 LEU 746 HD21 LEU 746 13.408 -4.449 8.759 266 HD22 LEU 746 HD22 LEU 746 11.778 -3.872 8.410 267 HD23 LEU 746 HD23 LEU 746 12.700 -4.727 7.157 268 H PTR 747 HN PTR 747 10.927 -7.250 10.256 269 HA PTR 747 HA PTR 747 9.370 -8.140 12.228 270 HB2 PTR 747 HB2 PTR 747 9.227 -10.585 11.791 271 HB3 PTR 747 HB1 PTR 747 8.085 -9.628 10.889 272 HD1 PTR 747 HD1 PTR 747 11.062 -11.801 10.616 273 HD2 PTR 747 HD2 PTR 747 8.225 -9.525 8.410 274 HE1 PTR 747 HE1 PTR 747 11.750 -12.947 8.563 275 HE2 PTR 747 HE2 PTR 747 8.916 -10.663 6.341 276 H LYS 748 HN LYS 748 11.115 -7.504 13.312 277 HA LYS 748 HA LYS 748 13.601 -9.002 13.029 278 HB2 LYS 748 HB2 LYS 748 14.622 -7.497 14.585 279 HB3 LYS 748 HB1 LYS 748 13.612 -6.518 13.540 280 HG2 LYS 748 HG2 LYS 748 12.655 -7.464 16.231 281 HG3 LYS 748 HG1 LYS 748 13.613 -5.989 16.055 282 HD2 LYS 748 HD2 LYS 748 11.855 -5.149 14.479 283 HD3 LYS 748 HD1 LYS 748 10.925 -6.604 14.829 284 HE2 LYS 748 HE2 LYS 748 10.228 -4.631 16.100 285 HE3 LYS 748 HE1 LYS 748 10.677 -6.007 17.111 286 HZ1 LYS 748 HZ1 LYS 748 11.530 -3.790 17.858 287 HZ2 LYS 748 HZ2 LYS 748 12.569 -3.747 16.532 288 HZ3 LYS 748 HZ3 LYS 748 12.707 -4.969 17.693 289 H GLU 749 HN GLU 749 10.734 -9.255 14.727 290 HA GLU 749 HA GLU 749 12.005 -10.920 16.771 291 HB2 GLU 749 HB2 GLU 749 9.281 -9.607 16.808 292 HB3 GLU 749 HB1 GLU 749 9.928 -10.634 18.078 293 HG2 GLU 749 HG2 GLU 749 11.769 -9.007 18.394 294 HG3 GLU 749 HG1 GLU 749 11.010 -7.972 17.192 295 H ALA 750 HN ALA 750 8.735 -10.874 15.326 296 HA ALA 750 HA ALA 750 9.087 -13.515 14.287 297 HB1 ALA 750 HB1 ALA 750 7.357 -14.553 15.638 298 HB2 ALA 750 HB2 ALA 750 7.184 -13.074 16.582 299 HB3 ALA 750 HB3 ALA 750 8.688 -13.994 16.652 300 H THR 751 HN THR 751 7.913 -13.678 12.553 301 HA THR 751 HA THR 751 5.964 -11.709 11.827 302 HB THR 751 HB THR 751 5.996 -14.263 10.333 303 HG1 THR 751 HG1 THR 751 8.340 -12.819 10.941 304 HG21 THR 751 HG21 THR 751 6.255 -12.728 8.436 305 HG22 THR 751 HG22 THR 751 6.508 -11.388 9.553 306 HG23 THR 751 HG23 THR 751 4.943 -12.202 9.492 307 H SER 752 HN SER 752 3.666 -12.583 11.008 308 HA SER 752 HA SER 752 2.650 -14.334 13.138 309 HB2 SER 752 HB2 SER 752 1.009 -12.363 11.535 310 HB3 SER 752 HB1 SER 752 0.580 -13.206 13.001 311 HG SER 752 HG SER 752 2.740 -11.961 13.684 312 H THR 753 HN THR 753 1.136 -15.912 12.608 313 HA THR 753 HA THR 753 -0.152 -16.059 10.204 314 HB THR 753 HB THR 753 2.013 -16.657 9.206 315 HG1 THR 753 HG1 THR 753 0.116 -17.454 8.411 316 HG21 THR 753 HG21 THR 753 3.062 -18.836 9.736 317 HG22 THR 753 HG22 THR 753 1.891 -19.075 11.031 318 HG23 THR 753 HG23 THR 753 3.066 -17.760 11.135 319 H PHE 754 HN PHE 754 -1.782 -17.251 10.377 320 HA PHE 754 HA PHE 754 -2.248 -18.718 12.837 321 HB2 PHE 754 HB2 PHE 754 -4.504 -18.969 12.085 322 HB3 PHE 754 HB1 PHE 754 -3.959 -17.284 11.893 323 HD1 PHE 754 HD1 PHE 754 -3.319 -16.533 9.567 324 HD2 PHE 754 HD2 PHE 754 -5.383 -20.168 10.294 325 HE1 PHE 754 HE1 PHE 754 -4.028 -16.576 7.236 326 HE2 PHE 754 HE2 PHE 754 -6.104 -20.234 7.943 327 HZ PHE 754 HZ PHE 754 -5.427 -18.440 6.402 328 H THR 755 HN THR 755 -1.207 -19.419 9.796 329 HA THR 755 HA THR 755 -2.390 -21.806 9.062 330 HB THR 755 HB THR 755 -0.205 -22.393 7.900 331 HG1 THR 755 HG1 THR 755 0.746 -19.839 8.578 332 HG21 THR 755 HG21 THR 755 -0.322 -20.492 6.367 333 HG22 THR 755 HG22 THR 755 -1.208 -19.573 7.584 334 HG23 THR 755 HG23 THR 755 -1.951 -20.997 6.844 335 H ASN 756 HN ASN 756 0.432 -21.484 11.103 336 HA ASN 756 HA ASN 756 0.669 -24.302 11.686 337 HB2 ASN 756 HB2 ASN 756 2.491 -23.647 13.192 338 HB3 ASN 756 HB1 ASN 756 2.620 -22.685 11.707 339 HD21 ASN 756 HD21 ASN 756 1.758 -20.604 11.805 340 HD22 ASN 756 HD22 ASN 756 1.713 -19.806 13.349 341 H ILE 757 HN ILE 757 -0.870 -21.639 13.006 342 HA ILE 757 HA ILE 757 -1.453 -22.734 15.630 343 HB ILE 757 HB ILE 757 -2.716 -20.382 14.205 344 HG12 ILE 757 HG12 ILE 757 -0.314 -20.043 14.534 345 HG13 ILE 757 HG11 ILE 757 -1.232 -18.948 15.560 346 HG21 ILE 757 HG21 ILE 757 -2.797 -21.105 17.142 347 HG22 ILE 757 HG22 ILE 757 -4.154 -21.168 16.015 348 HG23 ILE 757 HG23 ILE 757 -3.445 -19.617 16.452 349 HD11 ILE 757 HD11 ILE 757 0.084 -21.512 16.441 350 HD12 ILE 757 HD12 ILE 757 -0.824 -20.415 17.480 351 HD13 ILE 757 HD13 ILE 757 0.685 -19.880 16.743 352 H THR 758 HN THR 758 -2.543 -23.115 12.612 353 HA THR 758 HA THR 758 -5.287 -23.914 13.236 354 HB THR 758 HB THR 758 -3.823 -24.684 10.700 355 HG1 THR 758 HG1 THR 758 -4.137 -22.223 11.569 356 HG21 THR 758 HG21 THR 758 -6.736 -24.043 11.256 357 HG22 THR 758 HG22 THR 758 -6.064 -25.657 11.031 358 HG23 THR 758 HG23 THR 758 -6.075 -24.512 9.688 359 H TYR 759 HN TYR 759 -3.068 -25.168 14.642 360 HA TYR 759 HA TYR 759 -2.522 -27.806 14.034 361 HB2 TYR 759 HB2 TYR 759 -2.672 -28.068 16.693 362 HB3 TYR 759 HB1 TYR 759 -1.381 -27.172 15.907 363 HD1 TYR 759 HD1 TYR 759 -4.748 -26.629 17.546 364 HD2 TYR 759 HD2 TYR 759 -0.943 -24.931 16.568 365 HE1 TYR 759 HE1 TYR 759 -5.274 -24.683 18.857 366 HE2 TYR 759 HE2 TYR 759 -1.489 -22.980 17.906 367 HH TYR 759 HH TYR 759 -4.227 -22.908 19.981 368 H ARG 760 HN ARG 760 -5.218 -26.606 15.857 369 HA ARG 760 HA ARG 760 -6.745 -29.016 15.126 370 HB2 ARG 760 HB2 ARG 760 -7.320 -27.153 17.423 371 HB3 ARG 760 HB1 ARG 760 -8.048 -28.714 17.102 372 HG2 ARG 760 HG2 ARG 760 -5.140 -28.365 17.707 373 HG3 ARG 760 HG1 ARG 760 -6.370 -28.600 18.951 374 HD2 ARG 760 HD2 ARG 760 -6.971 -30.741 17.865 375 HD3 ARG 760 HD1 ARG 760 -5.700 -30.462 16.669 376 HE ARG 760 HE ARG 760 -4.445 -30.287 19.081 377 HH11 ARG 760 HH11 ARG 760 -6.337 -32.796 17.446 378 HH12 ARG 760 HH12 ARG 760 -5.579 -34.094 18.229 379 HH21 ARG 760 HH21 ARG 760 -3.372 -32.073 20.150 380 HH22 ARG 760 HH22 ARG 760 -3.835 -33.684 19.782 381 H GLY 761 HN GLY 761 -7.364 -25.718 16.270 382 HA2 GLY 761 HA2 GLY 761 -8.190 -23.993 15.032 383 HA3 GLY 761 HA1 GLY 761 -8.801 -25.118 13.805 384 H THR 762 HN THR 762 -9.128 -25.072 17.307 385 HA THR 762 HA THR 762 -11.981 -24.803 16.932 386 HB THR 762 HB THR 762 -11.674 -27.190 17.143 387 HG1 THR 762 HG1 THR 762 -13.172 -27.466 18.569 388 HG21 THR 762 HG21 THR 762 -10.538 -28.252 19.069 389 HG22 THR 762 HG22 THR 762 -10.105 -26.660 19.687 390 HG23 THR 762 HG23 THR 762 -9.419 -27.224 18.169 Start of MODEL 12 1 H LYS 716 HT1 LYS 716 1.397 -0.101 0.295 2 HA LYS 716 HA LYS 716 4.083 1.004 0.895 3 HB2 LYS 716 HB2 LYS 716 2.041 -0.242 2.740 4 HB3 LYS 716 HB1 LYS 716 3.641 0.306 3.204 5 HG2 LYS 716 HG2 LYS 716 2.924 2.602 2.430 6 HG3 LYS 716 HG1 LYS 716 1.287 1.940 2.351 7 HD2 LYS 716 HD2 LYS 716 3.055 1.980 4.802 8 HD3 LYS 716 HD1 LYS 716 1.706 3.074 4.494 9 HE2 LYS 716 HE2 LYS 716 0.149 1.217 4.548 10 HE3 LYS 716 HE1 LYS 716 1.479 0.071 4.719 11 HZ1 LYS 716 HZ1 LYS 716 0.393 0.602 6.902 12 HZ2 LYS 716 HZ2 LYS 716 0.855 2.210 6.686 13 HZ3 LYS 716 HZ3 LYS 716 2.021 1.033 6.827 14 H LEU 717 HN LEU 717 2.490 -1.949 2.088 15 HA LEU 717 HA LEU 717 4.880 -3.341 1.553 16 HB2 LEU 717 HB2 LEU 717 2.246 -4.274 2.702 17 HB3 LEU 717 HB1 LEU 717 3.743 -5.179 2.638 18 HG LEU 717 HG LEU 717 3.488 -4.447 4.848 19 HD11 LEU 717 HD11 LEU 717 5.744 -4.314 4.076 20 HD12 LEU 717 HD12 LEU 717 5.439 -3.019 5.233 21 HD13 LEU 717 HD13 LEU 717 5.493 -2.664 3.505 22 HD21 LEU 717 HD21 LEU 717 3.209 -2.091 5.519 23 HD22 LEU 717 HD22 LEU 717 1.854 -2.682 4.561 24 HD23 LEU 717 HD23 LEU 717 3.069 -1.641 3.818 25 H LEU 718 HN LEU 718 1.520 -4.438 0.937 26 HA LEU 718 HA LEU 718 2.351 -4.975 -1.816 27 HB2 LEU 718 HB2 LEU 718 0.788 -6.798 0.002 28 HB3 LEU 718 HB1 LEU 718 0.851 -7.002 -1.731 29 HG LEU 718 HG LEU 718 3.195 -7.203 0.168 30 HD11 LEU 718 HD11 LEU 718 1.694 -9.114 0.289 31 HD12 LEU 718 HD12 LEU 718 3.212 -9.554 -0.490 32 HD13 LEU 718 HD13 LEU 718 1.767 -9.290 -1.465 33 HD21 LEU 718 HD21 LEU 718 3.082 -7.575 -2.826 34 HD22 LEU 718 HD22 LEU 718 4.477 -7.907 -1.800 35 HD23 LEU 718 HD23 LEU 718 3.879 -6.255 -1.973 36 H ILE 719 HN ILE 719 -0.555 -4.881 0.254 37 HA ILE 719 HA ILE 719 -1.964 -3.767 -2.094 38 HB ILE 719 HB ILE 719 -3.492 -5.040 0.139 39 HG12 ILE 719 HG12 ILE 719 -2.165 -6.604 -2.099 40 HG13 ILE 719 HG11 ILE 719 -1.660 -6.650 -0.414 41 HG21 ILE 719 HG21 ILE 719 -4.642 -3.887 -1.701 42 HG22 ILE 719 HG22 ILE 719 -4.980 -5.615 -1.733 43 HG23 ILE 719 HG23 ILE 719 -3.821 -4.923 -2.868 44 HD11 ILE 719 HD11 ILE 719 -3.000 -8.591 -1.007 45 HD12 ILE 719 HD12 ILE 719 -4.330 -7.533 -1.487 46 HD13 ILE 719 HD13 ILE 719 -3.821 -7.600 0.201 47 H THR 720 HN THR 720 -1.187 -3.316 1.199 48 HA THR 720 HA THR 720 -1.394 -1.558 2.605 49 HB THR 720 HB THR 720 -2.281 0.133 0.238 50 HG1 THR 720 HG1 THR 720 -0.496 -0.687 -0.556 51 HG21 THR 720 HG21 THR 720 -2.310 1.207 2.477 52 HG22 THR 720 HG22 THR 720 -1.073 1.915 1.440 53 HG23 THR 720 HG23 THR 720 -0.615 0.768 2.699 54 H ILE 721 HN ILE 721 -3.633 -3.311 2.180 55 HA ILE 721 HA ILE 721 -5.749 -1.547 3.178 56 HB ILE 721 HB ILE 721 -7.478 -2.907 2.043 57 HG12 ILE 721 HG12 ILE 721 -5.227 -3.931 0.330 58 HG13 ILE 721 HG11 ILE 721 -5.982 -4.918 1.570 59 HG21 ILE 721 HG21 ILE 721 -5.565 -1.458 0.216 60 HG22 ILE 721 HG22 ILE 721 -6.878 -0.738 1.143 61 HG23 ILE 721 HG23 ILE 721 -7.238 -1.852 -0.179 62 HD11 ILE 721 HD11 ILE 721 -8.137 -4.671 0.351 63 HD12 ILE 721 HD12 ILE 721 -6.872 -5.455 -0.602 64 HD13 ILE 721 HD13 ILE 721 -7.280 -3.767 -0.899 65 H HIS 722 HN HIS 722 -4.626 -4.844 2.882 66 HA HIS 722 HA HIS 722 -5.946 -5.319 5.480 67 HB2 HIS 722 HB2 HIS 722 -5.581 -7.144 3.145 68 HB3 HIS 722 HB1 HIS 722 -5.655 -7.826 4.770 69 HD1 HIS 722 HD1 HIS 722 -7.815 -7.059 1.996 70 HD2 HIS 722 HD2 HIS 722 -8.042 -6.778 6.117 71 HE1 HIS 722 HE1 HIS 722 -10.236 -6.907 2.497 72 HE2 HIS 722 HE2 HIS 722 -10.372 -7.035 5.009 73 H ASP 723 HN ASP 723 -3.136 -4.771 4.057 74 HA ASP 723 HA ASP 723 -1.256 -6.506 5.086 75 HB2 ASP 723 HB2 ASP 723 -0.910 -3.527 4.681 76 HB3 ASP 723 HB1 ASP 723 0.331 -4.768 4.588 77 H ARG 724 HN ARG 724 -3.118 -4.200 6.624 78 HA ARG 724 HA ARG 724 -1.599 -4.478 9.160 79 HB2 ARG 724 HB2 ARG 724 -1.400 -2.252 8.332 80 HB3 ARG 724 HB1 ARG 724 -3.092 -2.156 7.973 81 HG2 ARG 724 HG2 ARG 724 -2.546 -0.849 10.030 82 HG3 ARG 724 HG1 ARG 724 -3.675 -2.192 10.290 83 HD2 ARG 724 HD2 ARG 724 -2.080 -3.520 11.198 84 HD3 ARG 724 HD1 ARG 724 -0.737 -2.427 10.790 85 HE ARG 724 HE ARG 724 -1.494 -0.962 12.510 86 HH11 ARG 724 HH11 ARG 724 -3.370 -3.986 12.391 87 HH12 ARG 724 HH12 ARG 724 -3.833 -3.869 14.042 88 HH21 ARG 724 HH21 ARG 724 -2.185 -0.867 14.777 89 HH22 ARG 724 HH22 ARG 724 -3.177 -2.143 15.358 90 H LYS 725 HN LYS 725 -4.590 -4.770 7.537 91 HA LYS 725 HA LYS 725 -6.215 -4.283 9.843 92 HB2 LYS 725 HB2 LYS 725 -6.895 -5.112 7.049 93 HB3 LYS 725 HB1 LYS 725 -8.122 -5.124 8.306 94 HG2 LYS 725 HG2 LYS 725 -6.485 -2.731 7.524 95 HG3 LYS 725 HG1 LYS 725 -8.127 -3.070 6.965 96 HD2 LYS 725 HD2 LYS 725 -8.892 -3.054 9.304 97 HD3 LYS 725 HD1 LYS 725 -7.255 -2.653 9.818 98 HE2 LYS 725 HE2 LYS 725 -8.657 -0.671 9.720 99 HE3 LYS 725 HE1 LYS 725 -7.350 -0.585 8.545 100 HZ1 LYS 725 HZ1 LYS 725 -10.086 -1.497 7.847 101 HZ2 LYS 725 HZ2 LYS 725 -8.844 -1.000 6.779 102 HZ3 LYS 725 HZ3 LYS 725 -9.600 0.109 7.777 103 H GLU 726 HN GLU 726 -4.882 -7.057 8.415 104 HA GLU 726 HA GLU 726 -6.658 -8.874 9.726 105 HB2 GLU 726 HB2 GLU 726 -4.972 -10.612 9.071 106 HB3 GLU 726 HB1 GLU 726 -5.751 -9.615 7.831 107 HG2 GLU 726 HG2 GLU 726 -3.612 -8.193 7.914 108 HG3 GLU 726 HG1 GLU 726 -2.922 -9.583 8.750 109 H PHE 727 HN PHE 727 -4.402 -7.007 10.780 110 HA PHE 727 HA PHE 727 -3.815 -8.647 13.162 111 HB2 PHE 727 HB2 PHE 727 -2.825 -5.870 12.602 112 HB3 PHE 727 HB1 PHE 727 -2.241 -7.042 13.784 113 HD1 PHE 727 HD2 PHE 727 -1.424 -9.285 12.808 114 HD2 PHE 727 HD1 PHE 727 -1.769 -5.683 10.606 115 HE1 PHE 727 HE2 PHE 727 0.126 -10.157 11.144 116 HE2 PHE 727 HE1 PHE 727 -0.218 -6.556 8.934 117 HZ PHE 727 HZ PHE 727 0.726 -8.787 9.197 118 H ALA 728 HN ALA 728 -6.184 -6.887 12.179 119 HA ALA 728 HA ALA 728 -6.749 -5.773 14.838 120 HB1 ALA 728 HB1 ALA 728 -8.327 -4.245 13.770 121 HB2 ALA 728 HB2 ALA 728 -7.953 -4.950 12.197 122 HB3 ALA 728 HB3 ALA 728 -6.712 -4.063 13.084 123 H LYS 729 HN LYS 729 -8.256 -7.374 12.051 124 HA LYS 729 HA LYS 729 -10.289 -8.396 13.875 125 HB2 LYS 729 HB2 LYS 729 -10.252 -8.278 10.845 126 HB3 LYS 729 HB1 LYS 729 -11.496 -9.119 11.753 127 HG2 LYS 729 HG2 LYS 729 -12.357 -6.973 11.117 128 HG3 LYS 729 HG1 LYS 729 -12.065 -6.941 12.857 129 HD2 LYS 729 HD2 LYS 729 -11.221 -4.856 12.003 130 HD3 LYS 729 HD1 LYS 729 -9.850 -5.880 12.349 131 HE2 LYS 729 HE2 LYS 729 -9.520 -4.783 10.224 132 HE3 LYS 729 HE1 LYS 729 -9.696 -6.521 9.997 133 HZ1 LYS 729 HZ1 LYS 729 -10.941 -5.214 8.366 134 HZ2 LYS 729 HZ2 LYS 729 -11.862 -4.533 9.609 135 HZ3 LYS 729 HZ3 LYS 729 -11.984 -6.159 9.288 136 H PHE 730 HN PHE 730 -7.641 -9.478 11.788 137 HA PHE 730 HA PHE 730 -6.544 -11.399 11.578 138 HB2 PHE 730 HB2 PHE 730 -7.982 -12.409 14.042 139 HB3 PHE 730 HB1 PHE 730 -6.421 -12.888 13.343 140 HD1 PHE 730 HD2 PHE 730 -8.239 -10.324 15.153 141 HD2 PHE 730 HD1 PHE 730 -4.456 -11.696 13.869 142 HE1 PHE 730 HE2 PHE 730 -7.278 -8.774 16.580 143 HE2 PHE 730 HE1 PHE 730 -3.367 -10.094 15.359 144 HZ PHE 730 HZ PHE 730 -4.746 -8.595 16.760 145 H GLU 731 HN GLU 731 -9.198 -11.051 10.511 146 HA GLU 731 HA GLU 731 -9.981 -13.897 10.191 147 HB2 GLU 731 HB2 GLU 731 -11.679 -11.437 9.818 148 HB3 GLU 731 HB1 GLU 731 -12.198 -13.085 9.499 149 HG2 GLU 731 HG2 GLU 731 -11.737 -13.594 11.895 150 HG3 GLU 731 HG1 GLU 731 -11.430 -11.889 12.137 151 H GLU 732 HN GLU 732 -8.725 -11.243 8.642 152 HA GLU 732 HA GLU 732 -9.634 -12.097 6.034 153 HB2 GLU 732 HB2 GLU 732 -8.217 -10.031 5.276 154 HB3 GLU 732 HB1 GLU 732 -9.778 -9.803 6.039 155 HG2 GLU 732 HG2 GLU 732 -7.203 -9.682 7.615 156 HG3 GLU 732 HG1 GLU 732 -7.862 -8.281 6.776 157 H GLU 733 HN GLU 733 -6.302 -10.817 6.576 158 HA GLU 733 HA GLU 733 -4.339 -11.551 5.968 159 HB2 GLU 733 HB2 GLU 733 -5.494 -14.207 6.443 160 HB3 GLU 733 HB1 GLU 733 -3.783 -13.774 6.295 161 HG2 GLU 733 HG2 GLU 733 -3.725 -12.638 8.273 162 HG3 GLU 733 HG1 GLU 733 -5.483 -12.521 8.409 163 H ARG 734 HN ARG 734 -4.544 -10.846 4.119 164 HA ARG 734 HA ARG 734 -5.214 -12.455 1.804 165 HB2 ARG 734 HB2 ARG 734 -3.483 -9.986 1.834 166 HB3 ARG 734 HB1 ARG 734 -4.289 -10.693 0.440 167 HG2 ARG 734 HG2 ARG 734 -5.558 -9.368 2.810 168 HG3 ARG 734 HG1 ARG 734 -5.539 -8.808 1.134 169 HD2 ARG 734 HD2 ARG 734 -6.766 -11.365 2.077 170 HD3 ARG 734 HD1 ARG 734 -7.661 -9.861 1.878 171 HE ARG 734 HE ARG 734 -6.698 -10.080 -0.554 172 HH11 ARG 734 HH11 ARG 734 -7.971 -12.732 1.466 173 HH12 ARG 734 HH12 ARG 734 -8.342 -13.734 0.168 174 HH21 ARG 734 HH21 ARG 734 -7.238 -11.505 -2.386 175 HH22 ARG 734 HH22 ARG 734 -7.913 -13.038 -2.054 176 H ALA 735 HN ALA 735 -2.172 -11.372 3.212 177 HA ALA 735 HA ALA 735 -0.861 -13.597 1.823 178 HB1 ALA 735 HB1 ALA 735 0.001 -11.408 1.178 179 HB2 ALA 735 HB2 ALA 735 1.222 -12.336 2.054 180 HB3 ALA 735 HB3 ALA 735 0.345 -11.039 2.869 181 H ARG 736 HN ARG 736 -2.334 -13.179 4.519 182 HA ARG 736 HA ARG 736 -2.292 -13.955 6.596 183 HB2 ARG 736 HB2 ARG 736 -0.152 -15.864 5.680 184 HB3 ARG 736 HB1 ARG 736 -1.309 -15.944 7.021 185 HG2 ARG 736 HG2 ARG 736 -3.161 -16.159 5.498 186 HG3 ARG 736 HG1 ARG 736 -2.083 -15.973 4.111 187 HD2 ARG 736 HD2 ARG 736 -2.138 -18.241 6.098 188 HD3 ARG 736 HD1 ARG 736 -2.604 -18.306 4.404 189 HE ARG 736 HE ARG 736 0.086 -17.439 4.705 190 HH11 ARG 736 HH11 ARG 736 -1.952 -20.351 4.690 191 HH12 ARG 736 HH12 ARG 736 -0.684 -21.420 4.321 192 HH21 ARG 736 HH21 ARG 736 1.866 -18.918 4.190 193 HH22 ARG 736 HH22 ARG 736 1.524 -20.576 4.038 194 H ALA 737 HN ALA 737 -1.310 -11.842 6.996 195 HA ALA 737 HA ALA 737 0.114 -10.468 8.162 196 HB1 ALA 737 HB1 ALA 737 0.884 -13.022 9.515 197 HB2 ALA 737 HB2 ALA 737 -0.513 -12.023 9.911 198 HB3 ALA 737 HB3 ALA 737 1.120 -11.391 10.136 199 H LYS 738 HN LYS 738 1.093 -11.784 5.858 200 HA LYS 738 HA LYS 738 3.807 -12.539 5.869 201 HB2 LYS 738 HB2 LYS 738 2.357 -12.520 3.849 202 HB3 LYS 738 HB1 LYS 738 2.580 -10.763 3.802 203 HG2 LYS 738 HG2 LYS 738 4.071 -11.831 2.198 204 HG3 LYS 738 HG1 LYS 738 5.008 -11.101 3.503 205 HD2 LYS 738 HD2 LYS 738 5.129 -13.334 4.599 206 HD3 LYS 738 HD1 LYS 738 4.314 -14.028 3.194 207 HE2 LYS 738 HE2 LYS 738 6.164 -13.186 1.774 208 HE3 LYS 738 HE1 LYS 738 6.981 -12.612 3.224 209 HZ1 LYS 738 HZ1 LYS 738 7.882 -14.714 2.619 210 HZ2 LYS 738 HZ2 LYS 738 6.370 -15.397 2.462 211 HZ3 LYS 738 HZ3 LYS 738 6.947 -15.025 4.007 212 H TRP 739 HN TRP 739 2.599 -9.283 5.372 213 HA TRP 739 HA TRP 739 5.151 -8.052 5.502 214 HB2 TRP 739 HB2 TRP 739 2.822 -6.401 6.158 215 HB3 TRP 739 HB1 TRP 739 4.038 -6.192 4.904 216 HD1 TRP 739 HD1 TRP 739 3.372 -6.882 2.509 217 HE1 TRP 739 HE1 TRP 739 1.194 -7.804 1.430 218 HE3 TRP 739 HE3 TRP 739 0.885 -8.023 6.652 219 HZ2 TRP 739 HZ2 TRP 739 -1.288 -8.878 2.283 220 HZ3 TRP 739 HZ3 TRP 739 -1.388 -8.983 6.486 221 HH2 TRP 739 HH2 TRP 739 -2.420 -9.382 4.291 222 H ASP 740 HN ASP 740 2.474 -8.546 7.673 223 HA ASP 740 HA ASP 740 2.192 -8.394 9.976 224 HB2 ASP 740 HB2 ASP 740 4.063 -10.074 9.738 225 HB3 ASP 740 HB1 ASP 740 5.174 -8.747 10.178 226 H THR 741 HN THR 741 2.485 -6.021 8.571 227 HA THR 741 HA THR 741 4.310 -4.141 9.175 228 HB THR 741 HB THR 741 1.420 -3.408 9.050 229 HG1 THR 741 HG1 THR 741 1.206 -4.613 7.295 230 HG21 THR 741 HG21 THR 741 3.147 -1.652 9.040 231 HG22 THR 741 HG22 THR 741 2.292 -1.733 7.495 232 HG23 THR 741 HG23 THR 741 3.907 -2.426 7.646 233 H ALA 742 HN ALA 742 1.755 -5.226 11.287 234 HA ALA 742 HA ALA 742 1.871 -2.839 12.946 235 HB1 ALA 742 HB1 ALA 742 0.159 -5.284 13.233 236 HB2 ALA 742 HB2 ALA 742 -0.281 -3.798 12.388 237 HB3 ALA 742 HB3 ALA 742 -0.007 -3.775 14.129 238 H ASN 743 HN ASN 743 3.573 -5.740 12.876 239 HA ASN 743 HA ASN 743 3.706 -5.759 15.795 240 HB2 ASN 743 HB2 ASN 743 4.129 -8.215 14.130 241 HB3 ASN 743 HB1 ASN 743 3.799 -8.100 15.849 242 HD21 ASN 743 HD21 ASN 743 2.518 -7.810 12.707 243 HD22 ASN 743 HD22 ASN 743 0.854 -8.063 13.063 244 H ASN 744 HN ASN 744 5.546 -7.450 13.221 245 HA ASN 744 HA ASN 744 7.920 -6.081 14.168 246 HB2 ASN 744 HB2 ASN 744 9.194 -8.223 14.152 247 HB3 ASN 744 HB1 ASN 744 7.883 -8.297 15.309 248 HD21 ASN 744 HD21 ASN 744 7.784 -8.797 11.778 249 HD22 ASN 744 HD22 ASN 744 7.221 -10.407 11.884 250 HA PRO 745 HA PRO 745 9.379 -5.505 9.992 251 HB2 PRO 745 HB2 PRO 745 11.525 -7.160 9.534 252 HB3 PRO 745 HB1 PRO 745 11.619 -5.672 10.488 253 HG2 PRO 745 HG2 PRO 745 11.241 -8.497 11.443 254 HG3 PRO 745 HG1 PRO 745 12.345 -7.297 12.069 255 HD2 PRO 745 HD2 PRO 745 10.124 -7.769 13.312 256 HD3 PRO 745 HD1 PRO 745 10.645 -6.091 13.085 257 H LEU 746 HN LEU 746 9.902 -8.993 10.364 258 HA LEU 746 HA LEU 746 8.207 -9.379 8.021 259 HB2 LEU 746 HB2 LEU 746 9.572 -11.455 7.567 260 HB3 LEU 746 HB1 LEU 746 10.347 -9.913 7.239 261 HG LEU 746 HG LEU 746 11.026 -10.672 9.878 262 HD11 LEU 746 HD11 LEU 746 12.196 -12.788 9.459 263 HD12 LEU 746 HD12 LEU 746 11.395 -12.903 7.883 264 HD13 LEU 746 HD13 LEU 746 10.445 -12.923 9.375 265 HD21 LEU 746 HD21 LEU 746 12.353 -9.290 8.429 266 HD22 LEU 746 HD22 LEU 746 12.645 -10.656 7.341 267 HD23 LEU 746 HD23 LEU 746 13.274 -10.679 9.000 268 H PTR 747 HN PTR 747 9.624 -11.497 10.583 269 HA PTR 747 HA PTR 747 7.492 -11.734 12.164 270 HB2 PTR 747 HB2 PTR 747 6.361 -13.713 11.634 271 HB3 PTR 747 HB1 PTR 747 6.161 -12.541 10.370 272 HD1 PTR 747 HD1 PTR 747 8.061 -12.786 8.390 273 HD2 PTR 747 HD2 PTR 747 6.669 -15.986 10.820 274 HE1 PTR 747 HE1 PTR 747 8.760 -14.376 6.678 275 HE2 PTR 747 HE2 PTR 747 7.377 -17.591 9.103 276 H LYS 748 HN LYS 748 9.451 -11.718 13.354 277 HA LYS 748 HA LYS 748 10.615 -14.398 13.652 278 HB2 LYS 748 HB2 LYS 748 12.468 -13.475 14.811 279 HB3 LYS 748 HB1 LYS 748 12.137 -12.319 13.537 280 HG2 LYS 748 HG2 LYS 748 10.995 -11.929 16.275 281 HG3 LYS 748 HG1 LYS 748 12.665 -11.455 15.938 282 HD2 LYS 748 HD2 LYS 748 11.812 -10.001 14.133 283 HD3 LYS 748 HD1 LYS 748 10.166 -10.480 14.553 284 HE2 LYS 748 HE2 LYS 748 10.784 -8.299 15.537 285 HE3 LYS 748 HE1 LYS 748 10.401 -9.503 16.762 286 HZ1 LYS 748 HZ1 LYS 748 13.178 -8.871 15.910 287 HZ2 LYS 748 HZ2 LYS 748 12.705 -9.749 17.287 288 HZ3 LYS 748 HZ3 LYS 748 12.414 -8.105 17.194 289 H GLU 749 HN GLU 749 8.427 -12.250 15.111 290 HA GLU 749 HA GLU 749 8.542 -13.587 17.686 291 HB2 GLU 749 HB2 GLU 749 6.866 -11.292 16.708 292 HB3 GLU 749 HB1 GLU 749 6.844 -11.938 18.345 293 HG2 GLU 749 HG2 GLU 749 9.199 -10.710 16.962 294 HG3 GLU 749 HG1 GLU 749 8.183 -9.928 18.169 295 H ALA 750 HN ALA 750 5.940 -12.767 15.328 296 HA ALA 750 HA ALA 750 4.818 -15.342 15.705 297 HB1 ALA 750 HB1 ALA 750 2.654 -14.427 16.373 298 HB2 ALA 750 HB2 ALA 750 3.368 -12.818 16.494 299 HB3 ALA 750 HB3 ALA 750 3.892 -14.103 17.587 300 H THR 751 HN THR 751 2.665 -15.136 14.478 301 HA THR 751 HA THR 751 2.662 -13.271 12.281 302 HB THR 751 HB THR 751 2.549 -16.183 11.499 303 HG1 THR 751 HG1 THR 751 4.805 -14.636 12.106 304 HG21 THR 751 HG21 THR 751 3.483 -13.687 10.088 305 HG22 THR 751 HG22 THR 751 1.882 -14.414 9.913 306 HG23 THR 751 HG23 THR 751 3.316 -15.283 9.355 307 H SER 752 HN SER 752 0.561 -13.353 11.182 308 HA SER 752 HA SER 752 -1.417 -14.489 12.966 309 HB2 SER 752 HB2 SER 752 -1.583 -12.111 12.460 310 HB3 SER 752 HB1 SER 752 -1.865 -12.491 10.738 311 HG SER 752 HG SER 752 -3.789 -13.342 11.277 312 H THR 753 HN THR 753 -2.632 -16.044 12.474 313 HA THR 753 HA THR 753 -3.617 -16.718 9.977 314 HB THR 753 HB THR 753 -2.454 -19.120 10.275 315 HG1 THR 753 HG1 THR 753 -0.947 -17.394 11.580 316 HG21 THR 753 HG21 THR 753 -1.029 -18.558 8.324 317 HG22 THR 753 HG22 THR 753 -1.383 -16.850 8.597 318 HG23 THR 753 HG23 THR 753 -2.681 -17.964 8.165 319 H PHE 754 HN PHE 754 -5.150 -18.304 10.188 320 HA PHE 754 HA PHE 754 -5.660 -19.253 12.911 321 HB2 PHE 754 HB2 PHE 754 -8.033 -18.541 12.723 322 HB3 PHE 754 HB1 PHE 754 -6.889 -17.204 12.816 323 HD1 PHE 754 HD1 PHE 754 -6.350 -15.896 10.690 324 HD2 PHE 754 HD2 PHE 754 -9.477 -18.807 10.890 325 HE1 PHE 754 HE1 PHE 754 -7.298 -14.998 8.705 326 HE2 PHE 754 HE2 PHE 754 -10.446 -17.872 8.848 327 HZ PHE 754 HZ PHE 754 -9.372 -15.965 7.740 328 H THR 755 HN THR 755 -6.599 -19.428 9.490 329 HA THR 755 HA THR 755 -8.085 -21.825 9.848 330 HB THR 755 HB THR 755 -8.438 -20.254 7.912 331 HG1 THR 755 HG1 THR 755 -9.089 -22.485 7.894 332 HG21 THR 755 HG21 THR 755 -5.875 -21.483 6.878 333 HG22 THR 755 HG22 THR 755 -6.115 -19.801 7.363 334 HG23 THR 755 HG23 THR 755 -6.956 -20.438 5.948 335 H ASN 756 HN ASN 756 -4.832 -21.048 9.546 336 HA ASN 756 HA ASN 756 -4.137 -23.872 9.785 337 HB2 ASN 756 HB2 ASN 756 -2.114 -23.502 8.510 338 HB3 ASN 756 HB1 ASN 756 -3.474 -23.040 7.517 339 HD21 ASN 756 HD21 ASN 756 -0.729 -22.116 9.071 340 HD22 ASN 756 HD22 ASN 756 -0.696 -20.448 8.511 341 H ILE 757 HN ILE 757 -2.743 -24.283 11.307 342 HA ILE 757 HA ILE 757 -1.877 -21.990 12.899 343 HB ILE 757 HB ILE 757 -2.384 -23.583 14.939 344 HG12 ILE 757 HG12 ILE 757 -4.688 -24.621 14.562 345 HG13 ILE 757 HG11 ILE 757 -4.394 -24.364 12.848 346 HG21 ILE 757 HG21 ILE 757 -4.433 -21.832 13.571 347 HG22 ILE 757 HG22 ILE 757 -3.195 -21.302 14.712 348 HG23 ILE 757 HG23 ILE 757 -4.511 -22.344 15.256 349 HD11 ILE 757 HD11 ILE 757 -2.714 -26.073 14.677 350 HD12 ILE 757 HD12 ILE 757 -2.438 -25.822 12.956 351 HD13 ILE 757 HD13 ILE 757 -3.889 -26.669 13.500 352 H THR 758 HN THR 758 -0.819 -24.531 11.320 353 HA THR 758 HA THR 758 1.299 -25.094 13.209 354 HB THR 758 HB THR 758 1.915 -26.830 11.385 355 HG1 THR 758 HG1 THR 758 0.631 -26.829 9.736 356 HG21 THR 758 HG21 THR 758 0.322 -28.448 12.330 357 HG22 THR 758 HG22 THR 758 -0.634 -27.119 12.988 358 HG23 THR 758 HG23 THR 758 0.999 -27.411 13.584 359 H TYR 759 HN TYR 759 2.191 -23.152 12.956 360 HA TYR 759 HA TYR 759 3.891 -22.873 10.603 361 HB2 TYR 759 HB2 TYR 759 3.493 -20.381 10.601 362 HB3 TYR 759 HB1 TYR 759 2.114 -21.329 10.055 363 HD1 TYR 759 HD2 TYR 759 0.275 -21.763 11.914 364 HD2 TYR 759 HD1 TYR 759 3.192 -18.684 12.209 365 HE1 TYR 759 HE2 TYR 759 -1.134 -20.552 13.554 366 HE2 TYR 759 HE1 TYR 759 1.800 -17.507 13.815 367 HH TYR 759 HH TYR 759 -0.880 -18.962 15.304 368 H ARG 760 HN ARG 760 3.206 -21.345 13.702 369 HA ARG 760 HA ARG 760 6.056 -21.603 14.435 370 HB2 ARG 760 HB2 ARG 760 4.271 -19.346 15.293 371 HB3 ARG 760 HB1 ARG 760 6.012 -19.485 15.472 372 HG2 ARG 760 HG2 ARG 760 4.699 -19.438 12.837 373 HG3 ARG 760 HG1 ARG 760 5.042 -17.948 13.734 374 HD2 ARG 760 HD2 ARG 760 7.019 -20.090 12.989 375 HD3 ARG 760 HD1 ARG 760 6.801 -18.629 12.027 376 HE ARG 760 HE ARG 760 7.393 -18.064 14.780 377 HH11 ARG 760 HH11 ARG 760 8.937 -18.924 11.678 378 HH12 ARG 760 HH12 ARG 760 10.415 -18.209 12.075 379 HH21 ARG 760 HH21 ARG 760 9.409 -17.091 15.297 380 HH22 ARG 760 HH22 ARG 760 10.714 -17.133 14.179 381 H GLY 761 HN GLY 761 2.823 -21.010 15.480 382 HA2 GLY 761 HA2 GLY 761 1.716 -22.442 17.122 383 HA3 GLY 761 HA1 GLY 761 3.294 -22.692 17.868 384 H THR 762 HN THR 762 1.843 -19.676 16.767 385 HA THR 762 HA THR 762 2.403 -18.590 19.362 386 HB THR 762 HB THR 762 2.035 -16.409 18.126 387 HG1 THR 762 HG1 THR 762 0.838 -17.456 16.390 388 HG21 THR 762 HG21 THR 762 4.206 -16.485 17.022 389 HG22 THR 762 HG22 THR 762 4.147 -18.241 16.996 390 HG23 THR 762 HG23 THR 762 4.287 -17.388 18.542 Start of MODEL 13 1 H LYS 716 HT1 LYS 716 3.179 -2.951 5.887 2 HA LYS 716 HA LYS 716 2.375 -0.950 3.844 3 HB2 LYS 716 HB2 LYS 716 4.395 0.320 4.639 4 HB3 LYS 716 HB1 LYS 716 2.986 0.178 5.708 5 HG2 LYS 716 HG2 LYS 716 4.900 -0.060 7.123 6 HG3 LYS 716 HG1 LYS 716 4.205 -1.668 6.906 7 HD2 LYS 716 HD2 LYS 716 5.910 -2.180 5.227 8 HD3 LYS 716 HD1 LYS 716 6.584 -0.560 5.405 9 HE2 LYS 716 HE2 LYS 716 6.423 -2.648 7.581 10 HE3 LYS 716 HE1 LYS 716 7.870 -2.233 6.663 11 HZ1 LYS 716 HZ1 LYS 716 7.821 -1.128 8.826 12 HZ2 LYS 716 HZ2 LYS 716 6.373 -0.376 8.457 13 HZ3 LYS 716 HZ3 LYS 716 7.761 0.010 7.585 14 H LEU 717 HN LEU 717 3.367 -3.793 3.732 15 HA LEU 717 HA LEU 717 5.844 -3.372 2.250 16 HB2 LEU 717 HB2 LEU 717 4.471 -5.889 3.142 17 HB3 LEU 717 HB1 LEU 717 5.871 -5.882 2.090 18 HG LEU 717 HG LEU 717 5.735 -4.948 4.948 19 HD11 LEU 717 HD11 LEU 717 5.810 -7.350 4.625 20 HD12 LEU 717 HD12 LEU 717 7.319 -6.750 5.324 21 HD13 LEU 717 HD13 LEU 717 7.243 -7.182 3.611 22 HD21 LEU 717 HD21 LEU 717 8.041 -4.846 3.010 23 HD22 LEU 717 HD22 LEU 717 8.132 -4.484 4.737 24 HD23 LEU 717 HD23 LEU 717 7.170 -3.462 3.666 25 H LEU 718 HN LEU 718 2.857 -5.243 1.710 26 HA LEU 718 HA LEU 718 3.471 -5.065 -1.113 27 HB2 LEU 718 HB2 LEU 718 1.503 -6.800 0.358 28 HB3 LEU 718 HB1 LEU 718 1.671 -6.771 -1.386 29 HG LEU 718 HG LEU 718 3.771 -7.654 0.597 30 HD11 LEU 718 HD11 LEU 718 1.983 -9.273 0.305 31 HD12 LEU 718 HD12 LEU 718 3.473 -9.847 -0.440 32 HD13 LEU 718 HD13 LEU 718 2.182 -9.192 -1.442 33 HD21 LEU 718 HD21 LEU 718 3.891 -7.554 -2.419 34 HD22 LEU 718 HD22 LEU 718 5.114 -8.259 -1.364 35 HD23 LEU 718 HD23 LEU 718 4.797 -6.523 -1.314 36 H ILE 719 HN ILE 719 0.394 -4.930 0.699 37 HA ILE 719 HA ILE 719 -0.494 -3.056 -1.388 38 HB ILE 719 HB ILE 719 -2.320 -4.782 0.282 39 HG12 ILE 719 HG12 ILE 719 -0.720 -6.170 -0.997 40 HG13 ILE 719 HG11 ILE 719 -2.385 -6.394 -1.543 41 HG21 ILE 719 HG21 ILE 719 -3.896 -4.320 -1.558 42 HG22 ILE 719 HG22 ILE 719 -2.669 -3.342 -2.363 43 HG23 ILE 719 HG23 ILE 719 -3.332 -2.824 -0.812 44 HD11 ILE 719 HD11 ILE 719 -0.844 -6.324 -3.427 45 HD12 ILE 719 HD12 ILE 719 -0.232 -4.758 -2.892 46 HD13 ILE 719 HD13 ILE 719 -1.893 -4.905 -3.463 47 H THR 720 HN THR 720 -0.306 -3.572 2.059 48 HA THR 720 HA THR 720 -0.411 -2.139 3.767 49 HB THR 720 HB THR 720 -0.611 0.132 1.722 50 HG1 THR 720 HG1 THR 720 1.268 -0.742 1.167 51 HG21 THR 720 HG21 THR 720 0.493 0.062 4.552 52 HG22 THR 720 HG22 THR 720 -1.035 0.803 4.072 53 HG23 THR 720 HG23 THR 720 0.492 1.464 3.484 54 H ILE 721 HN ILE 721 -2.830 -3.261 2.428 55 HA ILE 721 HA ILE 721 -4.745 -1.475 3.719 56 HB ILE 721 HB ILE 721 -6.518 -2.307 2.254 57 HG12 ILE 721 HG12 ILE 721 -4.355 -3.591 0.604 58 HG13 ILE 721 HG11 ILE 721 -5.363 -4.528 1.695 59 HG21 ILE 721 HG21 ILE 721 -4.195 -1.120 0.743 60 HG22 ILE 721 HG22 ILE 721 -5.420 -0.237 1.654 61 HG23 ILE 721 HG23 ILE 721 -5.875 -1.124 0.198 62 HD11 ILE 721 HD11 ILE 721 -7.344 -3.797 0.387 63 HD12 ILE 721 HD12 ILE 721 -6.177 -4.699 -0.582 64 HD13 ILE 721 HD13 ILE 721 -6.267 -2.943 -0.719 65 H HIS 722 HN HIS 722 -3.747 -4.771 3.033 66 HA HIS 722 HA HIS 722 -5.390 -5.560 5.334 67 HB2 HIS 722 HB2 HIS 722 -4.374 -7.128 2.994 68 HB3 HIS 722 HB1 HIS 722 -4.864 -7.912 4.494 69 HD1 HIS 722 HD1 HIS 722 -6.141 -6.417 1.412 70 HD2 HIS 722 HD2 HIS 722 -7.579 -7.584 5.100 71 HE1 HIS 722 HE1 HIS 722 -8.636 -6.474 1.152 72 HE2 HIS 722 HE2 HIS 722 -9.453 -7.468 3.304 73 H ASP 723 HN ASP 723 -2.435 -4.709 4.486 74 HA ASP 723 HA ASP 723 -0.635 -6.450 5.703 75 HB2 ASP 723 HB2 ASP 723 -0.572 -3.443 5.423 76 HB3 ASP 723 HB1 ASP 723 0.746 -4.328 6.171 77 H ARG 724 HN ARG 724 -2.793 -4.191 7.108 78 HA ARG 724 HA ARG 724 -1.874 -4.923 9.807 79 HB2 ARG 724 HB2 ARG 724 -1.784 -2.590 9.350 80 HB3 ARG 724 HB1 ARG 724 -3.416 -2.578 8.760 81 HG2 ARG 724 HG2 ARG 724 -3.399 -1.662 11.065 82 HG3 ARG 724 HG1 ARG 724 -4.267 -3.207 10.919 83 HD2 ARG 724 HD2 ARG 724 -2.528 -4.392 11.714 84 HD3 ARG 724 HD1 ARG 724 -1.428 -2.997 11.847 85 HE ARG 724 HE ARG 724 -3.891 -3.441 13.446 86 HH11 ARG 724 HH11 ARG 724 -0.630 -1.984 13.167 87 HH12 ARG 724 HH12 ARG 724 -0.558 -1.608 14.838 88 HH21 ARG 724 HH21 ARG 724 -3.704 -2.880 15.710 89 HH22 ARG 724 HH22 ARG 724 -2.331 -2.087 16.310 90 H LYS 725 HN LYS 725 -4.514 -5.164 7.546 91 HA LYS 725 HA LYS 725 -6.442 -5.001 9.596 92 HB2 LYS 725 HB2 LYS 725 -6.767 -5.595 6.668 93 HB3 LYS 725 HB1 LYS 725 -8.137 -5.692 7.764 94 HG2 LYS 725 HG2 LYS 725 -7.738 -3.346 8.423 95 HG3 LYS 725 HG1 LYS 725 -6.437 -3.265 7.238 96 HD2 LYS 725 HD2 LYS 725 -8.438 -2.295 6.284 97 HD3 LYS 725 HD1 LYS 725 -8.082 -3.808 5.458 98 HE2 LYS 725 HE2 LYS 725 -9.758 -4.949 6.765 99 HE3 LYS 725 HE1 LYS 725 -10.068 -3.489 7.701 100 HZ1 LYS 725 HZ1 LYS 725 -10.848 -2.399 5.705 101 HZ2 LYS 725 HZ2 LYS 725 -11.730 -3.810 5.939 102 HZ3 LYS 725 HZ3 LYS 725 -10.524 -3.765 4.768 103 H GLU 726 HN GLU 726 -4.739 -7.512 8.293 104 HA GLU 726 HA GLU 726 -6.258 -9.828 8.978 105 HB2 GLU 726 HB2 GLU 726 -3.427 -9.837 9.893 106 HB3 GLU 726 HB1 GLU 726 -4.288 -11.031 8.947 107 HG2 GLU 726 HG2 GLU 726 -3.363 -8.410 7.772 108 HG3 GLU 726 HG1 GLU 726 -2.359 -9.782 7.973 109 H PHE 727 HN PHE 727 -4.362 -7.685 10.857 110 HA PHE 727 HA PHE 727 -4.766 -9.141 13.335 111 HB2 PHE 727 HB2 PHE 727 -3.523 -6.428 12.993 112 HB3 PHE 727 HB1 PHE 727 -3.319 -7.589 14.303 113 HD1 PHE 727 HD1 PHE 727 -2.404 -6.740 10.839 114 HD2 PHE 727 HD2 PHE 727 -1.817 -9.460 14.073 115 HE1 PHE 727 HE1 PHE 727 -0.459 -7.626 9.719 116 HE2 PHE 727 HE2 PHE 727 0.158 -10.372 12.933 117 HZ PHE 727 HZ PHE 727 0.848 -9.460 10.752 118 H ALA 728 HN ALA 728 -6.673 -7.337 11.659 119 HA ALA 728 HA ALA 728 -7.718 -5.785 13.897 120 HB1 ALA 728 HB1 ALA 728 -9.089 -4.594 12.283 121 HB2 ALA 728 HB2 ALA 728 -8.524 -5.658 10.994 122 HB3 ALA 728 HB3 ALA 728 -7.394 -4.570 11.796 123 H LYS 729 HN LYS 729 -8.788 -8.178 11.460 124 HA LYS 729 HA LYS 729 -10.981 -8.771 13.329 125 HB2 LYS 729 HB2 LYS 729 -11.074 -9.053 10.314 126 HB3 LYS 729 HB1 LYS 729 -12.351 -9.529 11.417 127 HG2 LYS 729 HG2 LYS 729 -13.089 -7.500 10.628 128 HG3 LYS 729 HG1 LYS 729 -12.304 -7.046 12.141 129 HD2 LYS 729 HD2 LYS 729 -10.282 -6.451 10.894 130 HD3 LYS 729 HD1 LYS 729 -11.091 -6.889 9.390 131 HE2 LYS 729 HE2 LYS 729 -11.924 -4.777 11.319 132 HE3 LYS 729 HE1 LYS 729 -11.101 -4.519 9.774 133 HZ1 LYS 729 HZ1 LYS 729 -13.816 -5.748 10.065 134 HZ2 LYS 729 HZ2 LYS 729 -13.007 -5.470 8.629 135 HZ3 LYS 729 HZ3 LYS 729 -13.520 -4.158 9.560 136 H PHE 730 HN PHE 730 -8.415 -10.011 11.368 137 HA PHE 730 HA PHE 730 -7.433 -11.995 11.201 138 HB2 PHE 730 HB2 PHE 730 -9.028 -12.872 13.636 139 HB3 PHE 730 HB1 PHE 730 -7.498 -13.503 12.979 140 HD1 PHE 730 HD2 PHE 730 -9.072 -10.624 14.610 141 HD2 PHE 730 HD1 PHE 730 -5.445 -12.590 13.658 142 HE1 PHE 730 HE2 PHE 730 -7.956 -9.111 16.020 143 HE2 PHE 730 HE1 PHE 730 -4.221 -11.041 15.126 144 HZ PHE 730 HZ PHE 730 -5.450 -9.279 16.339 145 H GLU 731 HN GLU 731 -9.669 -11.417 9.851 146 HA GLU 731 HA GLU 731 -10.911 -14.098 9.416 147 HB2 GLU 731 HB2 GLU 731 -12.204 -11.444 8.887 148 HB3 GLU 731 HB1 GLU 731 -12.934 -13.036 8.742 149 HG2 GLU 731 HG2 GLU 731 -12.729 -13.350 11.139 150 HG3 GLU 731 HG1 GLU 731 -11.943 -11.789 11.281 151 H GLU 732 HN GLU 732 -9.188 -11.564 8.124 152 HA GLU 732 HA GLU 732 -9.996 -12.125 5.400 153 HB2 GLU 732 HB2 GLU 732 -8.393 -10.104 4.889 154 HB3 GLU 732 HB1 GLU 732 -9.996 -9.831 5.538 155 HG2 GLU 732 HG2 GLU 732 -7.503 -9.933 7.248 156 HG3 GLU 732 HG1 GLU 732 -8.144 -8.447 6.556 157 H GLU 733 HN GLU 733 -6.589 -11.101 6.178 158 HA GLU 733 HA GLU 733 -4.655 -11.914 5.552 159 HB2 GLU 733 HB2 GLU 733 -5.874 -14.615 5.338 160 HB3 GLU 733 HB1 GLU 733 -4.197 -14.079 5.401 161 HG2 GLU 733 HG2 GLU 733 -4.292 -13.467 7.635 162 HG3 GLU 733 HG1 GLU 733 -6.047 -13.694 7.740 163 H ARG 734 HN ARG 734 -4.529 -10.979 3.755 164 HA ARG 734 HA ARG 734 -5.161 -12.428 1.287 165 HB2 ARG 734 HB2 ARG 734 -3.508 -9.927 1.518 166 HB3 ARG 734 HB1 ARG 734 -4.240 -10.586 0.061 167 HG2 ARG 734 HG2 ARG 734 -5.619 -9.418 2.431 168 HG3 ARG 734 HG1 ARG 734 -5.560 -8.774 0.790 169 HD2 ARG 734 HD2 ARG 734 -6.696 -11.448 1.463 170 HD3 ARG 734 HD1 ARG 734 -7.660 -9.977 1.522 171 HE ARG 734 HE ARG 734 -6.627 -9.896 -0.988 172 HH11 ARG 734 HH11 ARG 734 -8.266 -12.551 0.730 173 HH12 ARG 734 HH12 ARG 734 -8.902 -13.241 -0.675 174 HH21 ARG 734 HH21 ARG 734 -7.508 -10.846 -2.891 175 HH22 ARG 734 HH22 ARG 734 -8.482 -12.251 -2.793 176 H ALA 735 HN ALA 735 -2.246 -11.286 2.909 177 HA ALA 735 HA ALA 735 -0.797 -13.499 1.643 178 HB1 ALA 735 HB1 ALA 735 0.186 -11.293 1.258 179 HB2 ALA 735 HB2 ALA 735 1.256 -12.309 2.227 180 HB3 ALA 735 HB3 ALA 735 0.304 -11.041 2.998 181 H ARG 736 HN ARG 736 -2.488 -12.783 4.345 182 HA ARG 736 HA ARG 736 -2.870 -13.913 6.192 183 HB2 ARG 736 HB2 ARG 736 -0.668 -15.845 5.523 184 HB3 ARG 736 HB1 ARG 736 -2.144 -15.974 6.510 185 HG2 ARG 736 HG2 ARG 736 -3.562 -16.043 4.640 186 HG3 ARG 736 HG1 ARG 736 -2.292 -15.485 3.555 187 HD2 ARG 736 HD2 ARG 736 -2.495 -17.751 3.089 188 HD3 ARG 736 HD1 ARG 736 -1.098 -17.659 4.156 189 HE ARG 736 HE ARG 736 -3.524 -18.064 5.551 190 HH11 ARG 736 HH11 ARG 736 -0.918 -19.690 3.778 191 HH12 ARG 736 HH12 ARG 736 -1.222 -21.229 4.424 192 HH21 ARG 736 HH21 ARG 736 -3.970 -20.165 6.402 193 HH22 ARG 736 HH22 ARG 736 -3.014 -21.541 5.941 194 H ALA 737 HN ALA 737 -1.857 -11.871 6.819 195 HA ALA 737 HA ALA 737 -0.521 -10.580 8.238 196 HB1 ALA 737 HB1 ALA 737 -0.172 -13.205 9.690 197 HB2 ALA 737 HB2 ALA 737 -1.533 -12.101 9.883 198 HB3 ALA 737 HB3 ALA 737 0.086 -11.598 10.366 199 H LYS 738 HN LYS 738 0.701 -12.080 6.092 200 HA LYS 738 HA LYS 738 3.321 -13.003 6.447 201 HB2 LYS 738 HB2 LYS 738 2.152 -12.972 4.274 202 HB3 LYS 738 HB1 LYS 738 2.386 -11.220 4.236 203 HG2 LYS 738 HG2 LYS 738 4.012 -12.299 2.784 204 HG3 LYS 738 HG1 LYS 738 4.829 -11.559 4.157 205 HD2 LYS 738 HD2 LYS 738 5.018 -13.730 5.249 206 HD3 LYS 738 HD1 LYS 738 4.113 -14.495 3.939 207 HE2 LYS 738 HE2 LYS 738 5.887 -13.822 2.358 208 HE3 LYS 738 HE1 LYS 738 6.790 -13.121 3.698 209 HZ1 LYS 738 HZ1 LYS 738 7.569 -15.294 3.072 210 HZ2 LYS 738 HZ2 LYS 738 6.085 -16.017 3.444 211 HZ3 LYS 738 HZ3 LYS 738 7.039 -15.311 4.666 212 H TRP 739 HN TRP 739 2.443 -9.656 5.731 213 HA TRP 739 HA TRP 739 5.083 -8.628 5.952 214 HB2 TRP 739 HB2 TRP 739 2.898 -6.739 6.384 215 HB3 TRP 739 HB1 TRP 739 4.196 -6.725 5.200 216 HD1 TRP 739 HD1 TRP 739 3.599 -7.449 2.843 217 HE1 TRP 739 HE1 TRP 739 1.384 -8.252 1.672 218 HE3 TRP 739 HE3 TRP 739 0.857 -8.196 6.884 219 HZ2 TRP 739 HZ2 TRP 739 -1.187 -9.077 2.454 220 HZ3 TRP 739 HZ3 TRP 739 -1.496 -8.994 6.665 221 HH2 TRP 739 HH2 TRP 739 -2.462 -9.416 4.455 222 H ASP 740 HN ASP 740 2.386 -8.948 8.027 223 HA ASP 740 HA ASP 740 2.114 -8.762 10.383 224 HB2 ASP 740 HB2 ASP 740 4.092 -10.311 10.031 225 HB3 ASP 740 HB1 ASP 740 5.120 -8.950 10.503 226 H THR 741 HN THR 741 2.214 -6.414 8.943 227 HA THR 741 HA THR 741 4.075 -4.470 9.733 228 HB THR 741 HB THR 741 1.268 -4.107 8.631 229 HG1 THR 741 HG1 THR 741 3.778 -4.657 7.580 230 HG21 THR 741 HG21 THR 741 2.104 -2.047 9.664 231 HG22 THR 741 HG22 THR 741 2.031 -1.916 7.902 232 HG23 THR 741 HG23 THR 741 3.586 -2.172 8.706 233 H ALA 742 HN ALA 742 1.397 -5.686 11.403 234 HA ALA 742 HA ALA 742 0.840 -3.399 13.037 235 HB1 ALA 742 HB1 ALA 742 -0.814 -5.160 12.673 236 HB2 ALA 742 HB2 ALA 742 -0.472 -4.929 14.387 237 HB3 ALA 742 HB3 ALA 742 0.220 -6.305 13.526 238 H ASN 743 HN ASN 743 3.449 -5.435 12.894 239 HA ASN 743 HA ASN 743 3.948 -5.194 15.759 240 HB2 ASN 743 HB2 ASN 743 4.730 -7.588 14.115 241 HB3 ASN 743 HB1 ASN 743 4.728 -7.428 15.863 242 HD21 ASN 743 HD21 ASN 743 2.796 -7.715 13.057 243 HD22 ASN 743 HD22 ASN 743 1.366 -8.351 13.765 244 H ASN 744 HN ASN 744 5.515 -6.153 12.669 245 HA ASN 744 HA ASN 744 7.754 -4.431 13.230 246 HB2 ASN 744 HB2 ASN 744 9.337 -6.427 12.835 247 HB3 ASN 744 HB1 ASN 744 8.550 -6.356 14.404 248 HD21 ASN 744 HD21 ASN 744 8.537 -7.845 11.279 249 HD22 ASN 744 HD22 ASN 744 7.685 -9.274 11.744 250 HA PRO 745 HA PRO 745 8.319 -4.036 8.810 251 HB2 PRO 745 HB2 PRO 745 10.709 -5.053 8.009 252 HB3 PRO 745 HB1 PRO 745 10.574 -3.554 8.949 253 HG2 PRO 745 HG2 PRO 745 11.190 -6.334 9.851 254 HG3 PRO 745 HG1 PRO 745 11.976 -4.830 10.335 255 HD2 PRO 745 HD2 PRO 745 10.169 -6.051 11.857 256 HD3 PRO 745 HD1 PRO 745 10.273 -4.294 11.816 257 H LEU 746 HN LEU 746 9.554 -7.307 9.455 258 HA LEU 746 HA LEU 746 7.791 -8.222 7.322 259 HB2 LEU 746 HB2 LEU 746 9.488 -10.090 6.968 260 HB3 LEU 746 HB1 LEU 746 9.848 -8.513 6.287 261 HG LEU 746 HG LEU 746 11.000 -8.889 8.948 262 HD11 LEU 746 HD11 LEU 746 11.101 -11.211 8.221 263 HD12 LEU 746 HD12 LEU 746 12.707 -10.491 8.248 264 HD13 LEU 746 HD13 LEU 746 11.872 -10.724 6.711 265 HD21 LEU 746 HD21 LEU 746 12.167 -8.223 6.249 266 HD22 LEU 746 HD22 LEU 746 12.993 -8.083 7.806 267 HD23 LEU 746 HD23 LEU 746 11.592 -7.073 7.458 268 H PTR 747 HN PTR 747 9.847 -10.014 9.585 269 HA PTR 747 HA PTR 747 8.205 -10.520 11.578 270 HB2 PTR 747 HB2 PTR 747 7.141 -12.642 11.235 271 HB3 PTR 747 HB1 PTR 747 6.455 -11.450 10.154 272 HD1 PTR 747 HD1 PTR 747 7.602 -14.777 10.417 273 HD2 PTR 747 HD2 PTR 747 7.536 -11.533 7.670 274 HE1 PTR 747 HE1 PTR 747 7.911 -16.348 8.567 275 HE2 PTR 747 HE2 PTR 747 7.854 -13.105 5.810 276 H LYS 748 HN LYS 748 10.195 -10.438 12.399 277 HA LYS 748 HA LYS 748 11.919 -12.744 12.072 278 HB2 LYS 748 HB2 LYS 748 13.497 -11.678 13.520 279 HB3 LYS 748 HB1 LYS 748 12.844 -10.412 12.499 280 HG2 LYS 748 HG2 LYS 748 11.787 -10.939 15.270 281 HG3 LYS 748 HG1 LYS 748 13.169 -9.876 14.988 282 HD2 LYS 748 HD2 LYS 748 11.700 -8.488 13.518 283 HD3 LYS 748 HD1 LYS 748 10.362 -9.566 13.930 284 HE2 LYS 748 HE2 LYS 748 10.404 -7.480 15.207 285 HE3 LYS 748 HE1 LYS 748 10.444 -8.932 16.212 286 HZ1 LYS 748 HZ1 LYS 748 12.778 -8.608 16.594 287 HZ2 LYS 748 HZ2 LYS 748 12.009 -7.136 16.915 288 HZ3 LYS 748 HZ3 LYS 748 12.861 -7.344 15.475 289 H GLU 749 HN GLU 749 9.233 -11.888 13.932 290 HA GLU 749 HA GLU 749 9.953 -13.642 16.120 291 HB2 GLU 749 HB2 GLU 749 7.696 -11.687 15.770 292 HB3 GLU 749 HB1 GLU 749 7.934 -12.698 17.186 293 HG2 GLU 749 HG2 GLU 749 9.901 -10.683 16.169 294 HG3 GLU 749 HG1 GLU 749 8.734 -10.388 17.454 295 H ALA 750 HN ALA 750 6.807 -12.983 14.510 296 HA ALA 750 HA ALA 750 6.382 -15.660 13.761 297 HB1 ALA 750 HB1 ALA 750 6.287 -15.968 16.182 298 HB2 ALA 750 HB2 ALA 750 4.714 -16.236 15.431 299 HB3 ALA 750 HB3 ALA 750 5.036 -14.729 16.291 300 H THR 751 HN THR 751 4.694 -15.683 12.303 301 HA THR 751 HA THR 751 3.197 -13.317 11.926 302 HB THR 751 HB THR 751 2.272 -14.928 10.136 303 HG1 THR 751 HG1 THR 751 3.042 -16.843 10.516 304 HG21 THR 751 HG21 THR 751 5.137 -13.964 10.068 305 HG22 THR 751 HG22 THR 751 3.722 -12.998 9.668 306 HG23 THR 751 HG23 THR 751 4.165 -14.372 8.653 307 H SER 752 HN SER 752 0.773 -13.817 11.367 308 HA SER 752 HA SER 752 -0.315 -15.678 13.349 309 HB2 SER 752 HB2 SER 752 -1.491 -12.995 12.552 310 HB3 SER 752 HB1 SER 752 -2.185 -14.155 13.655 311 HG SER 752 HG SER 752 0.325 -12.842 14.059 312 H THR 753 HN THR 753 -2.066 -16.861 12.722 313 HA THR 753 HA THR 753 -3.371 -16.357 10.225 314 HB THR 753 HB THR 753 -2.934 -18.912 9.707 315 HG1 THR 753 HG1 THR 753 -1.506 -19.318 11.364 316 HG21 THR 753 HG21 THR 753 -2.525 -17.108 8.120 317 HG22 THR 753 HG22 THR 753 -1.187 -18.254 8.084 318 HG23 THR 753 HG23 THR 753 -1.009 -16.715 8.930 319 H PHE 754 HN PHE 754 -5.292 -16.967 10.324 320 HA PHE 754 HA PHE 754 -6.211 -18.579 12.640 321 HB2 PHE 754 HB2 PHE 754 -8.386 -17.677 12.347 322 HB3 PHE 754 HB1 PHE 754 -7.278 -16.291 12.280 323 HD1 PHE 754 HD1 PHE 754 -6.644 -15.530 9.874 324 HD2 PHE 754 HD2 PHE 754 -9.975 -18.023 10.761 325 HE1 PHE 754 HE1 PHE 754 -7.632 -14.941 7.756 326 HE2 PHE 754 HE2 PHE 754 -10.994 -17.430 8.607 327 HZ PHE 754 HZ PHE 754 -9.833 -15.887 7.091 328 H THR 755 HN THR 755 -5.956 -18.490 9.242 329 HA THR 755 HA THR 755 -7.899 -20.337 8.537 330 HB THR 755 HB THR 755 -6.260 -20.679 6.523 331 HG1 THR 755 HG1 THR 755 -5.161 -18.187 7.172 332 HG21 THR 755 HG21 THR 755 -7.454 -17.979 7.180 333 HG22 THR 755 HG22 THR 755 -8.311 -19.335 6.450 334 HG23 THR 755 HG23 THR 755 -7.009 -18.539 5.568 335 H ASN 756 HN ASN 756 -4.742 -20.660 9.864 336 HA ASN 756 HA ASN 756 -5.188 -23.497 10.102 337 HB2 ASN 756 HB2 ASN 756 -2.819 -23.955 9.694 338 HB3 ASN 756 HB1 ASN 756 -3.528 -23.151 8.286 339 HD21 ASN 756 HD21 ASN 756 -3.056 -20.991 8.066 340 HD22 ASN 756 HD22 ASN 756 -1.568 -20.364 8.757 341 H ILE 757 HN ILE 757 -4.426 -24.281 12.058 342 HA ILE 757 HA ILE 757 -3.798 -22.185 13.984 343 HB ILE 757 HB ILE 757 -4.829 -24.952 14.541 344 HG12 ILE 757 HG12 ILE 757 -7.052 -23.483 14.901 345 HG13 ILE 757 HG11 ILE 757 -6.242 -22.517 13.659 346 HG21 ILE 757 HG21 ILE 757 -5.615 -23.917 16.677 347 HG22 ILE 757 HG22 ILE 757 -4.906 -22.388 16.159 348 HG23 ILE 757 HG23 ILE 757 -3.864 -23.777 16.476 349 HD11 ILE 757 HD11 ILE 757 -6.951 -25.435 13.408 350 HD12 ILE 757 HD12 ILE 757 -6.217 -24.399 12.176 351 HD13 ILE 757 HD13 ILE 757 -7.866 -24.087 12.715 352 H THR 758 HN THR 758 -2.292 -24.287 12.159 353 HA THR 758 HA THR 758 -0.254 -24.931 14.165 354 HB THR 758 HB THR 758 -0.790 -26.594 11.763 355 HG1 THR 758 HG1 THR 758 -1.848 -26.987 14.427 356 HG21 THR 758 HG21 THR 758 0.538 -27.171 14.420 357 HG22 THR 758 HG22 THR 758 1.355 -26.916 12.878 358 HG23 THR 758 HG23 THR 758 0.351 -28.346 13.119 359 H TYR 759 HN TYR 759 0.950 -23.418 13.699 360 HA TYR 759 HA TYR 759 2.097 -23.260 11.014 361 HB2 TYR 759 HB2 TYR 759 2.391 -20.658 11.652 362 HB3 TYR 759 HB1 TYR 759 0.964 -21.271 10.835 363 HD1 TYR 759 HD2 TYR 759 -1.123 -21.854 12.370 364 HD2 TYR 759 HD1 TYR 759 2.153 -19.420 13.726 365 HE1 TYR 759 HE2 TYR 759 -2.507 -20.945 14.100 366 HE2 TYR 759 HE1 TYR 759 0.723 -18.528 15.463 367 HH TYR 759 HH TYR 759 -2.205 -19.938 16.292 368 H ARG 760 HN ARG 760 2.900 -21.421 13.869 369 HA ARG 760 HA ARG 760 5.491 -22.827 13.959 370 HB2 ARG 760 HB2 ARG 760 6.664 -20.728 14.281 371 HB3 ARG 760 HB1 ARG 760 5.728 -20.705 12.785 372 HG2 ARG 760 HG2 ARG 760 5.154 -18.618 13.567 373 HG3 ARG 760 HG1 ARG 760 3.945 -19.585 14.359 374 HD2 ARG 760 HD2 ARG 760 4.922 -18.065 15.987 375 HD3 ARG 760 HD1 ARG 760 5.304 -19.740 16.378 376 HE ARG 760 HE ARG 760 7.300 -18.357 14.826 377 HH11 ARG 760 HH11 ARG 760 6.180 -19.165 18.125 378 HH12 ARG 760 HH12 ARG 760 7.700 -18.898 18.845 379 HH21 ARG 760 HH21 ARG 760 9.405 -18.003 15.877 380 HH22 ARG 760 HH22 ARG 760 9.562 -18.269 17.551 381 H GLY 761 HN GLY 761 2.902 -21.422 15.610 382 HA2 GLY 761 HA2 GLY 761 2.379 -21.832 17.903 383 HA3 GLY 761 HA1 GLY 761 4.090 -22.140 18.200 384 H THR 762 HN THR 762 1.788 -19.625 17.407 385 HA THR 762 HA THR 762 3.745 -17.602 18.076 386 HB THR 762 HB THR 762 0.954 -17.336 16.921 387 HG1 THR 762 HG1 THR 762 2.312 -16.777 14.998 388 HG21 THR 762 HG21 THR 762 3.211 -15.346 17.148 389 HG22 THR 762 HG22 THR 762 1.685 -15.290 18.056 390 HG23 THR 762 HG23 THR 762 1.693 -15.098 16.290 Start of MODEL 14 1 H LYS 716 HT1 LYS 716 1.570 -1.033 3.580 2 HA LYS 716 HA LYS 716 2.834 -0.427 1.630 3 HB2 LYS 716 HB2 LYS 716 5.044 -0.233 2.863 4 HB3 LYS 716 HB1 LYS 716 3.642 0.378 3.721 5 HG2 LYS 716 HG2 LYS 716 3.572 -1.710 5.037 6 HG3 LYS 716 HG1 LYS 716 5.026 -2.256 4.195 7 HD2 LYS 716 HD2 LYS 716 6.272 -0.347 5.075 8 HD3 LYS 716 HD1 LYS 716 4.813 0.252 5.864 9 HE2 LYS 716 HE2 LYS 716 4.733 -1.748 7.260 10 HE3 LYS 716 HE1 LYS 716 6.165 -2.383 6.452 11 HZ1 LYS 716 HZ1 LYS 716 6.081 0.124 8.069 12 HZ2 LYS 716 HZ2 LYS 716 7.425 -0.492 7.292 13 HZ3 LYS 716 HZ3 LYS 716 6.755 -1.344 8.576 14 H LEU 717 HN LEU 717 3.459 -3.752 2.715 15 HA LEU 717 HA LEU 717 5.606 -4.178 0.970 16 HB2 LEU 717 HB2 LEU 717 3.758 -5.946 2.521 17 HB3 LEU 717 HB1 LEU 717 4.866 -6.635 1.357 18 HG LEU 717 HG LEU 717 5.705 -6.785 3.613 19 HD11 LEU 717 HD11 LEU 717 7.311 -6.636 1.828 20 HD12 LEU 717 HD12 LEU 717 7.936 -5.803 3.254 21 HD13 LEU 717 HD13 LEU 717 7.281 -4.876 1.905 22 HD21 LEU 717 HD21 LEU 717 4.686 -4.837 4.612 23 HD22 LEU 717 HD22 LEU 717 5.694 -3.776 3.629 24 HD23 LEU 717 HD23 LEU 717 6.430 -4.799 4.864 25 H LEU 718 HN LEU 718 2.279 -5.506 0.758 26 HA LEU 718 HA LEU 718 2.681 -5.544 -2.156 27 HB2 LEU 718 HB2 LEU 718 1.246 -7.613 -0.492 28 HB3 LEU 718 HB1 LEU 718 1.309 -7.596 -2.240 29 HG LEU 718 HG LEU 718 3.598 -8.071 -0.339 30 HD11 LEU 718 HD11 LEU 718 3.684 -10.263 -1.387 31 HD12 LEU 718 HD12 LEU 718 2.322 -9.834 -2.416 32 HD13 LEU 718 HD13 LEU 718 2.095 -9.973 -0.678 33 HD21 LEU 718 HD21 LEU 718 3.634 -7.885 -3.347 34 HD22 LEU 718 HD22 LEU 718 4.992 -8.374 -2.327 35 HD23 LEU 718 HD23 LEU 718 4.348 -6.729 -2.222 36 H ILE 719 HN ILE 719 0.102 -5.699 0.329 37 HA ILE 719 HA ILE 719 -1.701 -4.748 -1.736 38 HB ILE 719 HB ILE 719 -3.504 -5.508 -0.150 39 HG12 ILE 719 HG12 ILE 719 -1.154 -6.777 1.278 40 HG13 ILE 719 HG11 ILE 719 -2.149 -5.471 1.907 41 HG21 ILE 719 HG21 ILE 719 -1.529 -7.555 -1.136 42 HG22 ILE 719 HG22 ILE 719 -2.834 -6.822 -2.072 43 HG23 ILE 719 HG23 ILE 719 -3.209 -7.874 -0.706 44 HD11 ILE 719 HD11 ILE 719 -2.768 -7.589 2.881 45 HD12 ILE 719 HD12 ILE 719 -3.061 -8.260 1.276 46 HD13 ILE 719 HD13 ILE 719 -4.085 -6.962 1.891 47 H THR 720 HN THR 720 -0.730 -3.992 1.621 48 HA THR 720 HA THR 720 -1.039 -2.159 2.907 49 HB THR 720 HB THR 720 -1.507 -0.631 0.313 50 HG1 THR 720 HG1 THR 720 0.675 -0.575 0.053 51 HG21 THR 720 HG21 THR 720 -0.381 1.208 1.520 52 HG22 THR 720 HG22 THR 720 -0.206 0.168 2.936 53 HG23 THR 720 HG23 THR 720 -1.810 0.661 2.400 54 H ILE 721 HN ILE 721 -3.292 -3.779 2.452 55 HA ILE 721 HA ILE 721 -5.489 -1.914 2.909 56 HB ILE 721 HB ILE 721 -7.003 -3.429 1.512 57 HG12 ILE 721 HG12 ILE 721 -4.349 -4.182 0.280 58 HG13 ILE 721 HG11 ILE 721 -5.383 -5.300 1.145 59 HG21 ILE 721 HG21 ILE 721 -6.499 -1.158 0.840 60 HG22 ILE 721 HG22 ILE 721 -6.507 -2.201 -0.585 61 HG23 ILE 721 HG23 ILE 721 -4.979 -1.680 0.117 62 HD11 ILE 721 HD11 ILE 721 -5.584 -5.622 -1.236 63 HD12 ILE 721 HD12 ILE 721 -5.976 -3.919 -1.471 64 HD13 ILE 721 HD13 ILE 721 -7.102 -4.975 -0.615 65 H HIS 722 HN HIS 722 -4.576 -5.354 2.794 66 HA HIS 722 HA HIS 722 -6.217 -5.762 5.208 67 HB2 HIS 722 HB2 HIS 722 -5.773 -7.585 2.854 68 HB3 HIS 722 HB1 HIS 722 -6.314 -8.108 4.461 69 HD1 HIS 722 HD1 HIS 722 -7.668 -7.219 1.251 70 HD2 HIS 722 HD2 HIS 722 -8.708 -6.548 5.180 71 HE1 HIS 722 HE1 HIS 722 -10.061 -6.591 1.165 72 HE2 HIS 722 HE2 HIS 722 -10.774 -6.518 3.531 73 H ASP 723 HN ASP 723 -3.539 -5.011 4.831 74 HA ASP 723 HA ASP 723 -2.040 -7.311 5.908 75 HB2 ASP 723 HB2 ASP 723 -0.022 -6.104 5.215 76 HB3 ASP 723 HB1 ASP 723 -1.142 -6.480 3.892 77 H ARG 724 HN ARG 724 -3.526 -4.780 6.768 78 HA ARG 724 HA ARG 724 -1.976 -4.476 9.299 79 HB2 ARG 724 HB2 ARG 724 -1.625 -2.426 8.159 80 HB3 ARG 724 HB1 ARG 724 -3.304 -2.327 7.663 81 HG2 ARG 724 HG2 ARG 724 -2.934 -0.721 9.441 82 HG3 ARG 724 HG1 ARG 724 -3.942 -2.077 9.986 83 HD2 ARG 724 HD2 ARG 724 -2.208 -3.069 11.110 84 HD3 ARG 724 HD1 ARG 724 -0.987 -1.924 10.495 85 HE ARG 724 HE ARG 724 -3.205 -1.261 12.324 86 HH11 ARG 724 HH11 ARG 724 0.158 -0.800 11.243 87 HH12 ARG 724 HH12 ARG 724 0.532 0.369 12.413 88 HH21 ARG 724 HH21 ARG 724 -2.676 0.380 13.949 89 HH22 ARG 724 HH22 ARG 724 -1.130 1.068 13.997 90 H LYS 725 HN LYS 725 -5.160 -4.290 7.750 91 HA LYS 725 HA LYS 725 -6.428 -4.053 10.259 92 HB2 LYS 725 HB2 LYS 725 -7.532 -4.645 7.522 93 HB3 LYS 725 HB1 LYS 725 -8.542 -4.512 8.953 94 HG2 LYS 725 HG2 LYS 725 -7.641 -2.203 9.269 95 HG3 LYS 725 HG1 LYS 725 -6.840 -2.372 7.709 96 HD2 LYS 725 HD2 LYS 725 -9.809 -2.625 8.167 97 HD3 LYS 725 HD1 LYS 725 -8.999 -1.179 7.564 98 HE2 LYS 725 HE2 LYS 725 -8.180 -2.480 5.635 99 HE3 LYS 725 HE1 LYS 725 -9.054 -3.887 6.236 100 HZ1 LYS 725 HZ1 LYS 725 -10.289 -2.643 4.501 101 HZ2 LYS 725 HZ2 LYS 725 -10.315 -1.304 5.510 102 HZ3 LYS 725 HZ3 LYS 725 -11.118 -2.713 5.969 103 H GLU 726 HN GLU 726 -5.070 -6.521 8.557 104 HA GLU 726 HA GLU 726 -6.567 -8.705 9.361 105 HB2 GLU 726 HB2 GLU 726 -4.514 -9.980 9.005 106 HB3 GLU 726 HB1 GLU 726 -4.835 -8.863 7.688 107 HG2 GLU 726 HG2 GLU 726 -3.155 -7.344 8.552 108 HG3 GLU 726 HG1 GLU 726 -2.866 -8.423 9.916 109 H PHE 727 HN PHE 727 -4.345 -6.639 10.995 110 HA PHE 727 HA PHE 727 -4.212 -8.334 13.353 111 HB2 PHE 727 HB2 PHE 727 -3.184 -5.526 12.991 112 HB3 PHE 727 HB1 PHE 727 -2.752 -6.704 14.225 113 HD1 PHE 727 HD2 PHE 727 -1.783 -8.952 13.284 114 HD2 PHE 727 HD1 PHE 727 -1.793 -5.234 11.213 115 HE1 PHE 727 HE2 PHE 727 0.057 -9.736 11.875 116 HE2 PHE 727 HE1 PHE 727 0.051 -6.018 9.803 117 HZ PHE 727 HZ PHE 727 0.976 -8.265 10.129 118 H ALA 728 HN ALA 728 -6.503 -6.640 12.165 119 HA ALA 728 HA ALA 728 -7.347 -5.488 14.738 120 HB1 ALA 728 HB1 ALA 728 -8.872 -4.039 13.516 121 HB2 ALA 728 HB2 ALA 728 -8.394 -4.798 11.995 122 HB3 ALA 728 HB3 ALA 728 -7.222 -3.846 12.910 123 H LYS 729 HN LYS 729 -8.525 -7.314 11.945 124 HA LYS 729 HA LYS 729 -10.721 -8.281 13.649 125 HB2 LYS 729 HB2 LYS 729 -10.519 -8.556 10.626 126 HB3 LYS 729 HB1 LYS 729 -11.896 -8.996 11.607 127 HG2 LYS 729 HG2 LYS 729 -12.501 -6.980 10.580 128 HG3 LYS 729 HG1 LYS 729 -12.032 -6.509 12.211 129 HD2 LYS 729 HD2 LYS 729 -9.993 -5.614 11.486 130 HD3 LYS 729 HD1 LYS 729 -10.068 -6.474 9.948 131 HE2 LYS 729 HE2 LYS 729 -10.501 -4.093 9.718 132 HE3 LYS 729 HE1 LYS 729 -11.872 -5.086 9.216 133 HZ1 LYS 729 HZ1 LYS 729 -12.500 -3.120 10.569 134 HZ2 LYS 729 HZ2 LYS 729 -11.686 -3.768 11.900 135 HZ3 LYS 729 HZ3 LYS 729 -13.010 -4.571 11.234 136 H PHE 730 HN PHE 730 -7.917 -9.317 11.784 137 HA PHE 730 HA PHE 730 -6.870 -11.259 11.495 138 HB2 PHE 730 HB2 PHE 730 -8.316 -12.261 13.969 139 HB3 PHE 730 HB1 PHE 730 -6.746 -12.752 13.291 140 HD1 PHE 730 HD2 PHE 730 -8.593 -10.093 14.966 141 HD2 PHE 730 HD1 PHE 730 -4.785 -11.628 13.941 142 HE1 PHE 730 HE2 PHE 730 -7.671 -8.525 16.384 143 HE2 PHE 730 HE1 PHE 730 -3.726 -9.993 15.439 144 HZ PHE 730 HZ PHE 730 -5.132 -8.409 16.702 145 H GLU 731 HN GLU 731 -9.307 -10.865 10.272 146 HA GLU 731 HA GLU 731 -10.246 -13.644 9.857 147 HB2 GLU 731 HB2 GLU 731 -11.832 -11.113 9.537 148 HB3 GLU 731 HB1 GLU 731 -12.395 -12.739 9.178 149 HG2 GLU 731 HG2 GLU 731 -12.014 -13.310 11.564 150 HG3 GLU 731 HG1 GLU 731 -11.610 -11.635 11.848 151 H GLU 732 HN GLU 732 -8.730 -11.090 8.529 152 HA GLU 732 HA GLU 732 -9.530 -11.723 5.800 153 HB2 GLU 732 HB2 GLU 732 -8.051 -9.599 5.330 154 HB3 GLU 732 HB1 GLU 732 -9.696 -9.441 5.929 155 HG2 GLU 732 HG2 GLU 732 -8.714 -9.303 8.248 156 HG3 GLU 732 HG1 GLU 732 -7.134 -9.149 7.495 157 H GLU 733 HN GLU 733 -6.327 -10.327 6.436 158 HA GLU 733 HA GLU 733 -4.262 -11.052 6.039 159 HB2 GLU 733 HB2 GLU 733 -5.412 -13.520 7.042 160 HB3 GLU 733 HB1 GLU 733 -3.697 -13.125 7.030 161 HG2 GLU 733 HG2 GLU 733 -3.988 -11.359 8.611 162 HG3 GLU 733 HG1 GLU 733 -5.738 -11.514 8.553 163 H ARG 734 HN ARG 734 -4.572 -11.027 3.723 164 HA ARG 734 HA ARG 734 -5.163 -13.265 2.142 165 HB2 ARG 734 HB2 ARG 734 -3.168 -11.115 1.583 166 HB3 ARG 734 HB1 ARG 734 -3.875 -12.210 0.399 167 HG2 ARG 734 HG2 ARG 734 -6.035 -11.322 0.823 168 HG3 ARG 734 HG1 ARG 734 -5.379 -10.285 2.087 169 HD2 ARG 734 HD2 ARG 734 -5.671 -9.074 0.307 170 HD3 ARG 734 HD1 ARG 734 -3.946 -9.256 0.452 171 HE ARG 734 HE ARG 734 -4.382 -11.252 -1.286 172 HH11 ARG 734 HH11 ARG 734 -5.707 -7.972 -1.465 173 HH12 ARG 734 HH12 ARG 734 -5.749 -7.931 -3.172 174 HH21 ARG 734 HH21 ARG 734 -4.475 -11.198 -3.608 175 HH22 ARG 734 HH22 ARG 734 -5.069 -9.833 -4.416 176 H ALA 735 HN ALA 735 -2.134 -12.312 3.641 177 HA ALA 735 HA ALA 735 -1.093 -14.949 2.914 178 HB1 ALA 735 HB1 ALA 735 0.460 -12.411 3.357 179 HB2 ALA 735 HB2 ALA 735 0.115 -13.152 1.793 180 HB3 ALA 735 HB3 ALA 735 1.142 -13.985 2.959 181 H ARG 736 HN ARG 736 -2.598 -13.653 5.342 182 HA ARG 736 HA ARG 736 -2.656 -13.724 7.511 183 HB2 ARG 736 HB2 ARG 736 -1.330 -16.293 6.808 184 HB3 ARG 736 HB1 ARG 736 -1.393 -15.716 8.480 185 HG2 ARG 736 HG2 ARG 736 -3.273 -17.202 8.077 186 HG3 ARG 736 HG1 ARG 736 -3.837 -15.557 8.349 187 HD2 ARG 736 HD2 ARG 736 -5.095 -16.395 6.550 188 HD3 ARG 736 HD1 ARG 736 -3.897 -15.316 5.837 189 HE ARG 736 HE ARG 736 -3.006 -18.016 5.936 190 HH11 ARG 736 HH11 ARG 736 -4.993 -15.730 4.080 191 HH12 ARG 736 HH12 ARG 736 -4.909 -16.626 2.637 192 HH21 ARG 736 HH21 ARG 736 -2.932 -19.270 3.893 193 HH22 ARG 736 HH22 ARG 736 -3.749 -18.640 2.538 194 H ALA 737 HN ALA 737 -1.495 -11.743 7.695 195 HA ALA 737 HA ALA 737 -0.018 -10.387 8.704 196 HB1 ALA 737 HB1 ALA 737 0.910 -11.145 10.814 197 HB2 ALA 737 HB2 ALA 737 0.561 -12.820 10.380 198 HB3 ALA 737 HB3 ALA 737 -0.762 -11.681 10.638 199 H LYS 738 HN LYS 738 0.929 -12.100 6.530 200 HA LYS 738 HA LYS 738 3.564 -13.039 6.892 201 HB2 LYS 738 HB2 LYS 738 2.183 -13.571 4.912 202 HB3 LYS 738 HB1 LYS 738 2.434 -11.921 4.338 203 HG2 LYS 738 HG2 LYS 738 3.936 -13.390 3.174 204 HG3 LYS 738 HG1 LYS 738 4.868 -12.362 4.267 205 HD2 LYS 738 HD2 LYS 738 4.824 -14.234 5.928 206 HD3 LYS 738 HD1 LYS 738 4.087 -15.244 4.681 207 HE2 LYS 738 HE2 LYS 738 6.066 -14.746 3.236 208 HE3 LYS 738 HE1 LYS 738 6.800 -13.937 4.620 209 HZ1 LYS 738 HZ1 LYS 738 6.490 -16.124 5.827 210 HZ2 LYS 738 HZ2 LYS 738 7.650 -16.112 4.621 211 HZ3 LYS 738 HZ3 LYS 738 6.133 -16.802 4.321 212 H TRP 739 HN TRP 739 2.564 -10.006 5.406 213 HA TRP 739 HA TRP 739 5.198 -9.004 5.227 214 HB2 TRP 739 HB2 TRP 739 2.968 -7.111 5.247 215 HB3 TRP 739 HB1 TRP 739 4.279 -7.312 4.094 216 HD1 TRP 739 HD1 TRP 739 3.787 -8.647 2.011 217 HE1 TRP 739 HE1 TRP 739 1.586 -9.730 1.015 218 HE3 TRP 739 HE3 TRP 739 0.904 -8.338 6.019 219 HZ2 TRP 739 HZ2 TRP 739 -0.943 -10.298 1.859 220 HZ3 TRP 739 HZ3 TRP 739 -1.458 -9.161 5.910 221 HH2 TRP 739 HH2 TRP 739 -2.342 -10.103 3.878 222 H ASP 740 HN ASP 740 2.379 -8.453 7.315 223 HA ASP 740 HA ASP 740 2.159 -7.522 9.437 224 HB2 ASP 740 HB2 ASP 740 4.018 -8.922 10.039 225 HB3 ASP 740 HB1 ASP 740 5.141 -7.743 9.386 226 H THR 741 HN THR 741 1.486 -5.626 9.524 227 HA THR 741 HA THR 741 3.229 -3.427 8.704 228 HB THR 741 HB THR 741 0.275 -3.335 8.269 229 HG1 THR 741 HG1 THR 741 0.734 -5.051 7.060 230 HG21 THR 741 HG21 THR 741 2.631 -2.134 6.876 231 HG22 THR 741 HG22 THR 741 1.630 -1.325 8.093 232 HG23 THR 741 HG23 THR 741 0.933 -1.787 6.513 233 H ALA 742 HN ALA 742 2.664 -4.533 11.304 234 HA ALA 742 HA ALA 742 1.788 -2.093 12.650 235 HB1 ALA 742 HB1 ALA 742 0.040 -3.103 13.979 236 HB2 ALA 742 HB2 ALA 742 0.292 -4.652 13.175 237 HB3 ALA 742 HB3 ALA 742 -0.323 -3.272 12.263 238 H ASN 743 HN ASN 743 3.304 -5.254 12.836 239 HA ASN 743 HA ASN 743 3.627 -4.964 15.701 240 HB2 ASN 743 HB2 ASN 743 4.394 -7.357 14.038 241 HB3 ASN 743 HB1 ASN 743 4.029 -7.300 15.751 242 HD21 ASN 743 HD21 ASN 743 2.726 -7.083 12.592 243 HD22 ASN 743 HD22 ASN 743 1.127 -7.582 12.884 244 H ASN 744 HN ASN 744 5.578 -6.184 12.990 245 HA ASN 744 HA ASN 744 7.866 -4.656 13.877 246 HB2 ASN 744 HB2 ASN 744 9.252 -6.829 13.796 247 HB3 ASN 744 HB1 ASN 744 8.198 -6.653 15.190 248 HD21 ASN 744 HD21 ASN 744 8.820 -8.349 12.272 249 HD22 ASN 744 HD22 ASN 744 7.594 -9.555 12.538 250 HA PRO 745 HA PRO 745 8.962 -4.374 9.606 251 HB2 PRO 745 HB2 PRO 745 11.386 -5.487 9.123 252 HB3 PRO 745 HB1 PRO 745 11.193 -3.992 10.055 253 HG2 PRO 745 HG2 PRO 745 11.561 -6.798 11.007 254 HG3 PRO 745 HG1 PRO 745 12.339 -5.335 11.608 255 HD2 PRO 745 HD2 PRO 745 10.277 -6.488 12.845 256 HD3 PRO 745 HD1 PRO 745 10.484 -4.741 12.869 257 H LEU 746 HN LEU 746 9.644 -7.680 10.570 258 HA LEU 746 HA LEU 746 8.248 -8.589 8.186 259 HB2 LEU 746 HB2 LEU 746 10.011 -10.466 8.065 260 HB3 LEU 746 HB1 LEU 746 10.377 -8.908 7.336 261 HG LEU 746 HG LEU 746 11.322 -9.200 10.124 262 HD11 LEU 746 HD11 LEU 746 11.673 -11.476 9.384 263 HD12 LEU 746 HD12 LEU 746 13.208 -10.623 9.536 264 HD13 LEU 746 HD13 LEU 746 12.507 -10.902 7.937 265 HD21 LEU 746 HD21 LEU 746 13.330 -8.221 9.173 266 HD22 LEU 746 HD22 LEU 746 11.891 -7.303 8.741 267 HD23 LEU 746 HD23 LEU 746 12.652 -8.367 7.546 268 H PTR 747 HN PTR 747 10.149 -10.411 10.496 269 HA PTR 747 HA PTR 747 8.357 -10.871 12.409 270 HB2 PTR 747 HB2 PTR 747 7.612 -13.198 12.026 271 HB3 PTR 747 HB1 PTR 747 6.794 -12.027 11.017 272 HD1 PTR 747 HD1 PTR 747 8.887 -15.018 11.090 273 HD2 PTR 747 HD2 PTR 747 7.312 -12.004 8.538 274 HE1 PTR 747 HE1 PTR 747 9.365 -16.431 9.142 275 HE2 PTR 747 HE2 PTR 747 7.795 -13.403 6.582 276 H LYS 748 HN LYS 748 10.161 -10.596 13.582 277 HA LYS 748 HA LYS 748 12.370 -12.291 13.398 278 HB2 LYS 748 HB2 LYS 748 12.904 -11.198 15.549 279 HB3 LYS 748 HB1 LYS 748 12.556 -10.079 14.236 280 HG2 LYS 748 HG2 LYS 748 10.092 -10.192 15.288 281 HG3 LYS 748 HG1 LYS 748 11.026 -10.646 16.703 282 HD2 LYS 748 HD2 LYS 748 12.389 -8.738 16.409 283 HD3 LYS 748 HD1 LYS 748 11.456 -8.219 15.033 284 HE2 LYS 748 HE2 LYS 748 9.450 -7.997 16.318 285 HE3 LYS 748 HE1 LYS 748 10.227 -8.628 17.780 286 HZ1 LYS 748 HZ1 LYS 748 11.612 -6.658 17.838 287 HZ2 LYS 748 HZ2 LYS 748 9.985 -6.176 17.755 288 HZ3 LYS 748 HZ3 LYS 748 10.953 -6.081 16.397 289 H GLU 749 HN GLU 749 9.237 -12.587 14.796 290 HA GLU 749 HA GLU 749 10.171 -14.818 16.446 291 HB2 GLU 749 HB2 GLU 749 7.817 -13.011 16.961 292 HB3 GLU 749 HB1 GLU 749 8.327 -14.361 17.966 293 HG2 GLU 749 HG2 GLU 749 10.436 -13.204 18.402 294 HG3 GLU 749 HG1 GLU 749 9.881 -11.855 17.427 295 H ALA 750 HN ALA 750 6.918 -13.696 15.362 296 HA ALA 750 HA ALA 750 6.459 -15.977 13.773 297 HB1 ALA 750 HB1 ALA 750 4.787 -17.023 15.205 298 HB2 ALA 750 HB2 ALA 750 5.159 -15.872 16.489 299 HB3 ALA 750 HB3 ALA 750 6.376 -17.040 15.972 300 H THR 751 HN THR 751 4.769 -15.532 12.413 301 HA THR 751 HA THR 751 3.467 -13.080 12.621 302 HB THR 751 HB THR 751 2.367 -14.112 10.575 303 HG1 THR 751 HG1 THR 751 3.085 -15.987 9.893 304 HG21 THR 751 HG21 THR 751 4.196 -12.479 10.455 305 HG22 THR 751 HG22 THR 751 4.364 -13.704 9.197 306 HG23 THR 751 HG23 THR 751 5.369 -13.782 10.642 307 H SER 752 HN SER 752 0.959 -13.394 11.896 308 HA SER 752 HA SER 752 -0.251 -15.103 13.945 309 HB2 SER 752 HB2 SER 752 -1.302 -12.540 12.695 310 HB3 SER 752 HB1 SER 752 -2.134 -13.497 13.921 311 HG SER 752 HG SER 752 0.379 -12.155 14.210 312 H THR 753 HN THR 753 -2.109 -16.397 13.387 313 HA THR 753 HA THR 753 -3.264 -16.231 10.816 314 HB THR 753 HB THR 753 -1.803 -18.738 11.605 315 HG1 THR 753 HG1 THR 753 -0.958 -16.564 10.249 316 HG21 THR 753 HG21 THR 753 -3.326 -18.085 9.088 317 HG22 THR 753 HG22 THR 753 -3.835 -19.187 10.365 318 HG23 THR 753 HG23 THR 753 -2.431 -19.577 9.373 319 H PHE 754 HN PHE 754 -5.094 -17.468 10.770 320 HA PHE 754 HA PHE 754 -6.147 -18.416 13.365 321 HB2 PHE 754 HB2 PHE 754 -8.330 -17.342 12.777 322 HB3 PHE 754 HB1 PHE 754 -7.028 -16.178 12.993 323 HD1 PHE 754 HD1 PHE 754 -5.690 -15.803 10.627 324 HD2 PHE 754 HD2 PHE 754 -9.780 -16.849 11.045 325 HE1 PHE 754 HE1 PHE 754 -6.076 -14.911 8.492 326 HE2 PHE 754 HE2 PHE 754 -10.223 -15.905 8.805 327 HZ PHE 754 HZ PHE 754 -8.387 -14.939 7.504 328 H THR 755 HN THR 755 -6.607 -18.457 9.833 329 HA THR 755 HA THR 755 -8.575 -20.426 9.706 330 HB THR 755 HB THR 755 -8.096 -18.977 7.814 331 HG1 THR 755 HG1 THR 755 -8.154 -21.751 7.520 332 HG21 THR 755 HG21 THR 755 -5.678 -18.789 8.005 333 HG22 THR 755 HG22 THR 755 -6.108 -19.316 6.378 334 HG23 THR 755 HG23 THR 755 -5.492 -20.483 7.550 335 H ASN 756 HN ASN 756 -5.133 -20.714 9.977 336 HA ASN 756 HA ASN 756 -5.555 -23.523 10.506 337 HB2 ASN 756 HB2 ASN 756 -3.346 -24.074 9.527 338 HB3 ASN 756 HB1 ASN 756 -4.461 -23.427 8.319 339 HD21 ASN 756 HD21 ASN 756 -4.029 -21.566 7.497 340 HD22 ASN 756 HD22 ASN 756 -2.484 -20.753 7.679 341 H ILE 757 HN ILE 757 -3.708 -24.370 11.813 342 HA ILE 757 HA ILE 757 -2.879 -22.282 13.678 343 HB ILE 757 HB ILE 757 -3.235 -25.216 14.287 344 HG12 ILE 757 HG12 ILE 757 -5.159 -22.999 14.936 345 HG13 ILE 757 HG11 ILE 757 -5.324 -24.009 13.512 346 HG21 ILE 757 HG21 ILE 757 -1.772 -23.986 15.822 347 HG22 ILE 757 HG22 ILE 757 -3.285 -24.432 16.615 348 HG23 ILE 757 HG23 ILE 757 -3.033 -22.776 16.065 349 HD11 ILE 757 HD11 ILE 757 -6.717 -24.808 15.303 350 HD12 ILE 757 HD12 ILE 757 -5.262 -24.951 16.335 351 HD13 ILE 757 HD13 ILE 757 -5.422 -25.935 14.866 352 H THR 758 HN THR 758 -1.899 -24.447 11.413 353 HA THR 758 HA THR 758 0.610 -25.140 12.664 354 HB THR 758 HB THR 758 0.987 -26.252 10.409 355 HG1 THR 758 HG1 THR 758 -1.871 -26.244 10.335 356 HG21 THR 758 HG21 THR 758 -0.331 -28.238 11.141 357 HG22 THR 758 HG22 THR 758 -1.154 -27.208 12.314 358 HG23 THR 758 HG23 THR 758 0.579 -27.494 12.454 359 H TYR 759 HN TYR 759 0.081 -22.475 11.843 360 HA TYR 759 HA TYR 759 1.674 -21.762 9.590 361 HB2 TYR 759 HB2 TYR 759 1.764 -19.397 10.714 362 HB3 TYR 759 HB1 TYR 759 0.218 -20.005 10.152 363 HD1 TYR 759 HD2 TYR 759 -1.260 -21.167 11.979 364 HD2 TYR 759 HD1 TYR 759 1.955 -18.513 13.004 365 HE1 TYR 759 HE2 TYR 759 -2.229 -20.765 14.179 366 HE2 TYR 759 HE1 TYR 759 0.962 -18.148 15.130 367 HH TYR 759 HH TYR 759 -1.347 -18.231 16.040 368 H ARG 760 HN ARG 760 2.687 -20.363 12.606 369 HA ARG 760 HA ARG 760 5.407 -21.268 12.156 370 HB2 ARG 760 HB2 ARG 760 4.416 -19.682 14.498 371 HB3 ARG 760 HB1 ARG 760 6.008 -19.682 13.761 372 HG2 ARG 760 HG2 ARG 760 3.614 -18.705 12.294 373 HG3 ARG 760 HG1 ARG 760 4.458 -17.683 13.455 374 HD2 ARG 760 HD2 ARG 760 5.290 -17.221 11.251 375 HD3 ARG 760 HD1 ARG 760 6.562 -18.059 12.163 376 HE ARG 760 HE ARG 760 4.790 -19.469 10.294 377 HH11 ARG 760 HH11 ARG 760 8.081 -18.436 11.224 378 HH12 ARG 760 HH12 ARG 760 8.837 -19.492 10.119 379 HH21 ARG 760 HH21 ARG 760 5.937 -20.931 8.742 380 HH22 ARG 760 HH22 ARG 760 7.642 -20.868 8.748 381 H GLY 761 HN GLY 761 2.911 -21.297 14.559 382 HA2 GLY 761 HA2 GLY 761 2.392 -23.317 15.770 383 HA3 GLY 761 HA1 GLY 761 4.145 -23.640 15.897 384 H THR 762 HN THR 762 1.765 -21.162 16.532 385 HA THR 762 HA THR 762 3.508 -20.089 18.580 386 HB THR 762 HB THR 762 1.227 -18.778 17.118 387 HG1 THR 762 HG1 THR 762 3.975 -19.082 16.469 388 HG21 THR 762 HG21 THR 762 2.432 -16.774 17.644 389 HG22 THR 762 HG22 THR 762 3.643 -17.697 18.550 390 HG23 THR 762 HG23 THR 762 1.956 -17.608 19.126 Start of MODEL 15 1 H LYS 716 HT1 LYS 716 -0.554 1.710 -0.327 2 HA LYS 716 HA LYS 716 1.318 2.046 1.194 3 HB2 LYS 716 HB2 LYS 716 0.193 1.087 3.244 4 HB3 LYS 716 HB1 LYS 716 -0.848 2.055 2.217 5 HG2 LYS 716 HG2 LYS 716 -1.871 0.051 1.312 6 HG3 LYS 716 HG1 LYS 716 -0.753 -0.961 2.221 7 HD2 LYS 716 HD2 LYS 716 -2.957 -0.825 3.312 8 HD3 LYS 716 HD1 LYS 716 -1.684 -0.136 4.322 9 HE2 LYS 716 HE2 LYS 716 -2.344 2.103 3.700 10 HE3 LYS 716 HE1 LYS 716 -3.514 1.478 2.540 11 HZ1 LYS 716 HZ1 LYS 716 -4.569 2.178 4.612 12 HZ2 LYS 716 HZ2 LYS 716 -3.648 1.042 5.486 13 HZ3 LYS 716 HZ3 LYS 716 -4.760 0.524 4.326 14 H LEU 717 HN LEU 717 0.551 -1.451 0.866 15 HA LEU 717 HA LEU 717 3.235 -1.934 1.734 16 HB2 LEU 717 HB2 LEU 717 0.738 -3.446 2.487 17 HB3 LEU 717 HB1 LEU 717 2.375 -3.869 2.944 18 HG LEU 717 HG LEU 717 0.951 -1.340 3.821 19 HD11 LEU 717 HD11 LEU 717 1.525 -3.858 5.354 20 HD12 LEU 717 HD12 LEU 717 -0.060 -3.287 4.829 21 HD13 LEU 717 HD13 LEU 717 0.859 -2.372 6.027 22 HD21 LEU 717 HD21 LEU 717 3.595 -2.516 4.682 23 HD22 LEU 717 HD22 LEU 717 2.829 -1.083 5.371 24 HD23 LEU 717 HD23 LEU 717 3.376 -1.071 3.695 25 H LEU 718 HN LEU 718 0.513 -4.044 0.660 26 HA LEU 718 HA LEU 718 1.729 -4.229 -2.002 27 HB2 LEU 718 HB2 LEU 718 1.125 -6.699 -0.376 28 HB3 LEU 718 HB1 LEU 718 1.492 -6.690 -2.058 29 HG LEU 718 HG LEU 718 3.442 -5.812 0.071 30 HD11 LEU 718 HD11 LEU 718 3.014 -8.195 0.216 31 HD12 LEU 718 HD12 LEU 718 4.628 -7.902 -0.432 32 HD13 LEU 718 HD13 LEU 718 3.318 -8.375 -1.510 33 HD21 LEU 718 HD21 LEU 718 3.793 -6.273 -2.896 34 HD22 LEU 718 HD22 LEU 718 5.084 -5.891 -1.758 35 HD23 LEU 718 HD23 LEU 718 3.810 -4.712 -2.076 36 H ILE 719 HN ILE 719 -0.963 -5.389 0.055 37 HA ILE 719 HA ILE 719 -2.532 -5.723 -2.409 38 HB ILE 719 HB ILE 719 -3.411 -6.727 0.300 39 HG12 ILE 719 HG12 ILE 719 -1.100 -7.572 -0.067 40 HG13 ILE 719 HG11 ILE 719 -2.290 -8.866 -0.117 41 HG21 ILE 719 HG21 ILE 719 -3.895 -7.674 -2.524 42 HG22 ILE 719 HG22 ILE 719 -5.022 -6.761 -1.523 43 HG23 ILE 719 HG23 ILE 719 -4.569 -8.402 -1.066 44 HD11 ILE 719 HD11 ILE 719 -0.596 -9.152 -1.845 45 HD12 ILE 719 HD12 ILE 719 -0.977 -7.560 -2.499 46 HD13 ILE 719 HD13 ILE 719 -2.177 -8.851 -2.571 47 H THR 720 HN THR 720 -2.405 -3.981 0.550 48 HA THR 720 HA THR 720 -3.363 -2.015 1.198 49 HB THR 720 HB THR 720 -5.052 -1.932 -1.312 50 HG1 THR 720 HG1 THR 720 -3.320 -1.803 -2.451 51 HG21 THR 720 HG21 THR 720 -3.692 0.215 0.334 52 HG22 THR 720 HG22 THR 720 -5.405 -0.197 0.395 53 HG23 THR 720 HG23 THR 720 -4.717 0.499 -1.076 54 H ILE 721 HN ILE 721 -4.682 -4.778 1.526 55 HA ILE 721 HA ILE 721 -7.247 -3.760 2.514 56 HB ILE 721 HB ILE 721 -8.383 -5.876 1.731 57 HG12 ILE 721 HG12 ILE 721 -6.104 -5.901 -0.237 58 HG13 ILE 721 HG11 ILE 721 -6.325 -7.125 1.001 59 HG21 ILE 721 HG21 ILE 721 -8.937 -3.716 0.806 60 HG22 ILE 721 HG22 ILE 721 -8.946 -4.928 -0.476 61 HG23 ILE 721 HG23 ILE 721 -7.581 -3.821 -0.319 62 HD11 ILE 721 HD11 ILE 721 -7.083 -7.927 -1.142 63 HD12 ILE 721 HD12 ILE 721 -8.152 -6.534 -1.327 64 HD13 ILE 721 HD13 ILE 721 -8.474 -7.734 -0.070 65 H HIS 722 HN HIS 722 -5.343 -6.726 2.384 66 HA HIS 722 HA HIS 722 -6.421 -7.349 5.036 67 HB2 HIS 722 HB2 HIS 722 -4.948 -9.048 3.025 68 HB3 HIS 722 HB1 HIS 722 -5.231 -9.544 4.693 69 HD1 HIS 722 HD1 HIS 722 -6.867 -9.339 1.365 70 HD2 HIS 722 HD2 HIS 722 -7.918 -9.951 5.323 71 HE1 HIS 722 HE1 HIS 722 -9.195 -10.217 1.281 72 HE2 HIS 722 HE2 HIS 722 -9.745 -10.819 3.652 73 H ASP 723 HN ASP 723 -3.854 -5.955 3.559 74 HA ASP 723 HA ASP 723 -1.561 -6.672 4.783 75 HB2 ASP 723 HB2 ASP 723 -2.416 -3.819 4.238 76 HB3 ASP 723 HB1 ASP 723 -0.776 -4.455 4.263 77 H ARG 724 HN ARG 724 -4.112 -4.615 6.064 78 HA ARG 724 HA ARG 724 -2.694 -4.488 8.627 79 HB2 ARG 724 HB2 ARG 724 -3.273 -2.357 7.707 80 HB3 ARG 724 HB1 ARG 724 -4.923 -2.851 7.462 81 HG2 ARG 724 HG2 ARG 724 -4.682 -1.375 9.489 82 HG3 ARG 724 HG1 ARG 724 -5.356 -2.988 9.797 83 HD2 ARG 724 HD2 ARG 724 -3.245 -3.782 10.527 84 HD3 ARG 724 HD1 ARG 724 -2.465 -2.206 10.257 85 HE ARG 724 HE ARG 724 -4.615 -1.860 12.034 86 HH11 ARG 724 HH11 ARG 724 -1.540 -3.556 11.997 87 HH12 ARG 724 HH12 ARG 724 -1.274 -3.465 13.688 88 HH21 ARG 724 HH21 ARG 724 -4.310 -1.730 14.296 89 HH22 ARG 724 HH22 ARG 724 -2.912 -2.385 15.048 90 H LYS 725 HN LYS 725 -5.338 -5.857 7.025 91 HA LYS 725 HA LYS 725 -6.984 -5.778 9.360 92 HB2 LYS 725 HB2 LYS 725 -7.542 -6.891 6.636 93 HB3 LYS 725 HB1 LYS 725 -8.689 -6.965 7.969 94 HG2 LYS 725 HG2 LYS 725 -7.563 -4.469 6.701 95 HG3 LYS 725 HG1 LYS 725 -9.206 -5.088 6.537 96 HD2 LYS 725 HD2 LYS 725 -9.596 -4.744 8.923 97 HD3 LYS 725 HD1 LYS 725 -7.933 -4.182 9.127 98 HE2 LYS 725 HE2 LYS 725 -8.386 -2.306 7.618 99 HE3 LYS 725 HE1 LYS 725 -10.045 -2.871 7.411 100 HZ1 LYS 725 HZ1 LYS 725 -10.396 -2.496 9.802 101 HZ2 LYS 725 HZ2 LYS 725 -9.935 -1.091 9.000 102 HZ3 LYS 725 HZ3 LYS 725 -8.819 -1.907 9.953 103 H GLU 726 HN GLU 726 -4.778 -7.945 8.086 104 HA GLU 726 HA GLU 726 -5.893 -10.198 9.434 105 HB2 GLU 726 HB2 GLU 726 -3.695 -11.290 8.944 106 HB3 GLU 726 HB1 GLU 726 -4.638 -10.645 7.604 107 HG2 GLU 726 HG2 GLU 726 -3.183 -8.656 7.606 108 HG3 GLU 726 HG1 GLU 726 -2.156 -9.488 8.782 109 H PHE 727 HN PHE 727 -4.101 -7.565 10.324 110 HA PHE 727 HA PHE 727 -3.363 -8.712 12.921 111 HB2 PHE 727 HB2 PHE 727 -3.384 -5.793 12.155 112 HB3 PHE 727 HB1 PHE 727 -2.580 -6.562 13.520 113 HD1 PHE 727 HD2 PHE 727 -0.919 -8.524 12.718 114 HD2 PHE 727 HD1 PHE 727 -2.095 -5.150 10.437 115 HE1 PHE 727 HE2 PHE 727 1.105 -8.736 11.347 116 HE2 PHE 727 HE1 PHE 727 -0.085 -5.357 9.075 117 HZ PHE 727 HZ PHE 727 1.507 -7.121 9.514 118 H ALA 728 HN ALA 728 -6.119 -8.069 11.665 119 HA ALA 728 HA ALA 728 -7.262 -6.806 14.055 120 HB1 ALA 728 HB1 ALA 728 -7.793 -5.680 11.950 121 HB2 ALA 728 HB2 ALA 728 -9.241 -6.306 12.737 122 HB3 ALA 728 HB3 ALA 728 -8.549 -7.157 11.354 123 H LYS 729 HN LYS 729 -8.095 -9.375 11.732 124 HA LYS 729 HA LYS 729 -9.539 -10.722 13.887 125 HB2 LYS 729 HB2 LYS 729 -9.496 -11.546 10.995 126 HB3 LYS 729 HB1 LYS 729 -10.664 -11.992 12.229 127 HG2 LYS 729 HG2 LYS 729 -10.316 -9.356 10.850 128 HG3 LYS 729 HG1 LYS 729 -11.724 -10.422 10.841 129 HD2 LYS 729 HD2 LYS 729 -10.588 -9.196 13.257 130 HD3 LYS 729 HD1 LYS 729 -11.821 -8.344 12.319 131 HE2 LYS 729 HE2 LYS 729 -12.042 -11.030 13.719 132 HE3 LYS 729 HE1 LYS 729 -12.864 -9.552 14.217 133 HZ1 LYS 729 HZ1 LYS 729 -13.392 -11.233 11.832 134 HZ2 LYS 729 HZ2 LYS 729 -13.940 -9.677 11.898 135 HZ3 LYS 729 HZ3 LYS 729 -14.482 -10.816 13.057 136 H PHE 730 HN PHE 730 -6.776 -10.965 11.906 137 HA PHE 730 HA PHE 730 -5.021 -12.394 11.773 138 HB2 PHE 730 HB2 PHE 730 -5.949 -13.551 14.416 139 HB3 PHE 730 HB1 PHE 730 -4.334 -13.529 13.670 140 HD1 PHE 730 HD2 PHE 730 -6.937 -11.464 15.181 141 HD2 PHE 730 HD1 PHE 730 -2.873 -11.761 14.076 142 HE1 PHE 730 HE2 PHE 730 -6.551 -9.492 16.355 143 HE2 PHE 730 HE1 PHE 730 -2.384 -9.697 15.301 144 HZ PHE 730 HZ PHE 730 -4.206 -8.514 16.475 145 H GLU 731 HN GLU 731 -7.426 -13.046 10.643 146 HA GLU 731 HA GLU 731 -7.382 -16.016 10.701 147 HB2 GLU 731 HB2 GLU 731 -9.699 -14.211 10.099 148 HB3 GLU 731 HB1 GLU 731 -9.707 -15.964 10.000 149 HG2 GLU 731 HG2 GLU 731 -9.148 -16.022 12.416 150 HG3 GLU 731 HG1 GLU 731 -9.317 -14.281 12.444 151 H GLU 732 HN GLU 732 -6.763 -13.375 8.914 152 HA GLU 732 HA GLU 732 -7.372 -14.717 6.399 153 HB2 GLU 732 HB2 GLU 732 -6.837 -12.362 5.385 154 HB3 GLU 732 HB1 GLU 732 -8.383 -12.667 6.152 155 HG2 GLU 732 HG2 GLU 732 -6.075 -11.379 7.618 156 HG3 GLU 732 HG1 GLU 732 -7.255 -10.452 6.688 157 H GLU 733 HN GLU 733 -4.741 -12.210 6.744 158 HA GLU 733 HA GLU 733 -2.616 -12.231 6.161 159 HB2 GLU 733 HB2 GLU 733 -2.680 -15.103 6.825 160 HB3 GLU 733 HB1 GLU 733 -1.297 -14.029 6.633 161 HG2 GLU 733 HG2 GLU 733 -1.680 -12.866 8.527 162 HG3 GLU 733 HG1 GLU 733 -3.342 -13.465 8.736 163 H ARG 734 HN ARG 734 -2.808 -11.820 4.257 164 HA ARG 734 HA ARG 734 -2.907 -13.837 2.157 165 HB2 ARG 734 HB2 ARG 734 -2.060 -10.967 1.853 166 HB3 ARG 734 HB1 ARG 734 -2.564 -12.072 0.578 167 HG2 ARG 734 HG2 ARG 734 -4.240 -10.960 2.786 168 HG3 ARG 734 HG1 ARG 734 -4.351 -10.600 1.059 169 HD2 ARG 734 HD2 ARG 734 -4.673 -13.345 2.188 170 HD3 ARG 734 HD1 ARG 734 -6.024 -12.228 2.018 171 HE ARG 734 HE ARG 734 -4.983 -12.236 -0.464 172 HH11 ARG 734 HH11 ARG 734 -5.769 -14.992 1.681 173 HH12 ARG 734 HH12 ARG 734 -6.157 -16.032 0.408 174 HH21 ARG 734 HH21 ARG 734 -5.537 -13.742 -2.233 175 HH22 ARG 734 HH22 ARG 734 -5.999 -15.328 -1.833 176 H ALA 735 HN ALA 735 -0.470 -11.683 3.451 177 HA ALA 735 HA ALA 735 1.538 -13.518 2.378 178 HB1 ALA 735 HB1 ALA 735 1.817 -10.588 3.006 179 HB2 ALA 735 HB2 ALA 735 1.652 -11.289 1.396 180 HB3 ALA 735 HB3 ALA 735 3.081 -11.636 2.373 181 H ARG 736 HN ARG 736 -0.092 -12.845 5.110 182 HA ARG 736 HA ARG 736 0.113 -13.307 7.232 183 HB2 ARG 736 HB2 ARG 736 2.590 -14.839 6.467 184 HB3 ARG 736 HB1 ARG 736 1.612 -14.912 7.940 185 HG2 ARG 736 HG2 ARG 736 -0.266 -15.807 6.744 186 HG3 ARG 736 HG1 ARG 736 0.581 -15.616 5.207 187 HD2 ARG 736 HD2 ARG 736 1.381 -17.426 7.475 188 HD3 ARG 736 HD1 ARG 736 0.662 -17.931 5.942 189 HE ARG 736 HE ARG 736 2.849 -16.580 5.161 190 HH11 ARG 736 HH11 ARG 736 2.403 -19.246 7.460 191 HH12 ARG 736 HH12 ARG 736 3.962 -19.888 7.220 192 HH21 ARG 736 HH21 ARG 736 4.930 -17.418 4.873 193 HH22 ARG 736 HH22 ARG 736 5.476 -18.826 5.708 194 H ALA 737 HN ALA 737 0.524 -11.037 7.453 195 HA ALA 737 HA ALA 737 1.520 -9.255 8.540 196 HB1 ALA 737 HB1 ALA 737 2.987 -9.726 10.393 197 HB2 ALA 737 HB2 ALA 737 3.230 -11.370 9.807 198 HB3 ALA 737 HB3 ALA 737 1.636 -10.858 10.371 199 H LYS 738 HN LYS 738 2.801 -10.668 6.261 200 HA LYS 738 HA LYS 738 5.559 -10.407 5.992 201 HB2 LYS 738 HB2 LYS 738 3.984 -11.174 4.183 202 HB3 LYS 738 HB1 LYS 738 3.686 -9.480 3.814 203 HG2 LYS 738 HG2 LYS 738 6.479 -10.610 3.737 204 HG3 LYS 738 HG1 LYS 738 5.385 -10.807 2.372 205 HD2 LYS 738 HD2 LYS 738 5.150 -8.366 2.222 206 HD3 LYS 738 HD1 LYS 738 6.227 -8.180 3.605 207 HE2 LYS 738 HE2 LYS 738 6.968 -9.492 1.003 208 HE3 LYS 738 HE1 LYS 738 7.365 -7.829 1.438 209 HZ1 LYS 738 HZ1 LYS 738 8.702 -8.666 3.280 210 HZ2 LYS 738 HZ2 LYS 738 9.193 -9.416 1.825 211 HZ3 LYS 738 HZ3 LYS 738 8.282 -10.267 2.907 212 H TRP 739 HN TRP 739 3.330 -7.798 5.138 213 HA TRP 739 HA TRP 739 5.384 -5.874 4.879 214 HB2 TRP 739 HB2 TRP 739 2.686 -4.911 5.423 215 HB3 TRP 739 HB1 TRP 739 3.763 -4.568 4.082 216 HD1 TRP 739 HD1 TRP 739 3.225 -5.714 1.874 217 HE1 TRP 739 HE1 TRP 739 1.428 -7.441 1.102 218 HE3 TRP 739 HE3 TRP 739 1.308 -7.020 6.322 219 HZ2 TRP 739 HZ2 TRP 739 -0.537 -9.057 2.196 220 HZ3 TRP 739 HZ3 TRP 739 -0.555 -8.636 6.395 221 HH2 TRP 739 HH2 TRP 739 -1.448 -9.618 4.310 222 H ASP 740 HN ASP 740 2.750 -6.378 7.182 223 HA ASP 740 HA ASP 740 2.284 -5.599 9.248 224 HB2 ASP 740 HB2 ASP 740 4.396 -6.768 9.842 225 HB3 ASP 740 HB1 ASP 740 5.251 -5.214 9.639 226 H THR 741 HN THR 741 1.325 -3.868 9.630 227 HA THR 741 HA THR 741 1.823 -1.584 8.125 228 HB THR 741 HB THR 741 0.028 -0.627 9.674 229 HG1 THR 741 HG1 THR 741 -0.382 -1.790 11.312 230 HG21 THR 741 HG21 THR 741 -0.488 -3.140 8.078 231 HG22 THR 741 HG22 THR 741 -0.397 -1.507 7.425 232 HG23 THR 741 HG23 THR 741 -1.701 -1.945 8.532 233 H ALA 742 HN ALA 742 2.132 -2.158 11.631 234 HA ALA 742 HA ALA 742 4.148 -0.122 11.959 235 HB1 ALA 742 HB1 ALA 742 2.766 1.413 13.282 236 HB2 ALA 742 HB2 ALA 742 1.380 0.378 12.865 237 HB3 ALA 742 HB3 ALA 742 2.210 1.278 11.589 238 H ASN 743 HN ASN 743 3.733 -2.818 12.707 239 HA ASN 743 HA ASN 743 3.228 -2.654 15.582 240 HB2 ASN 743 HB2 ASN 743 3.363 -5.170 13.943 241 HB3 ASN 743 HB1 ASN 743 2.571 -4.938 15.494 242 HD21 ASN 743 HD21 ASN 743 2.431 -4.332 12.196 243 HD22 ASN 743 HD22 ASN 743 0.753 -3.984 11.947 244 H ASN 744 HN ASN 744 5.325 -4.036 13.096 245 HA ASN 744 HA ASN 744 7.615 -3.611 14.777 246 HB2 ASN 744 HB2 ASN 744 8.490 -5.887 14.311 247 HB3 ASN 744 HB1 ASN 744 7.036 -5.956 15.297 248 HD21 ASN 744 HD21 ASN 744 8.466 -6.586 12.297 249 HD22 ASN 744 HD22 ASN 744 7.228 -7.569 11.600 250 HA PRO 745 HA PRO 745 9.486 -2.316 11.032 251 HB2 PRO 745 HB2 PRO 745 11.852 -3.632 10.699 252 HB3 PRO 745 HB1 PRO 745 11.604 -2.390 11.930 253 HG2 PRO 745 HG2 PRO 745 11.551 -5.366 12.204 254 HG3 PRO 745 HG1 PRO 745 12.261 -4.156 13.285 255 HD2 PRO 745 HD2 PRO 745 9.888 -5.351 13.758 256 HD3 PRO 745 HD1 PRO 745 10.253 -3.700 14.283 257 H LEU 746 HN LEU 746 10.151 -5.770 11.001 258 HA LEU 746 HA LEU 746 8.751 -6.024 8.470 259 HB2 LEU 746 HB2 LEU 746 10.649 -7.662 7.796 260 HB3 LEU 746 HB1 LEU 746 10.876 -5.943 7.556 261 HG LEU 746 HG LEU 746 11.905 -6.964 10.137 262 HD11 LEU 746 HD11 LEU 746 13.887 -7.930 9.139 263 HD12 LEU 746 HD12 LEU 746 13.160 -7.767 7.529 264 HD13 LEU 746 HD13 LEU 746 12.426 -8.829 8.741 265 HD21 LEU 746 HD21 LEU 746 13.756 -5.537 9.540 266 HD22 LEU 746 HD22 LEU 746 12.195 -4.717 9.418 267 HD23 LEU 746 HD23 LEU 746 13.030 -5.245 7.946 268 H PTR 747 HN PTR 747 10.830 -8.290 10.235 269 HA PTR 747 HA PTR 747 9.277 -9.306 12.064 270 HB2 PTR 747 HB2 PTR 747 8.366 -11.421 11.185 271 HB3 PTR 747 HB1 PTR 747 7.505 -10.026 10.564 272 HD1 PTR 747 HD1 PTR 747 7.788 -9.446 8.097 273 HD2 PTR 747 HD2 PTR 747 9.465 -12.990 9.747 274 HE1 PTR 747 HE1 PTR 747 8.003 -10.394 5.838 275 HE2 PTR 747 HE2 PTR 747 9.697 -13.935 7.503 276 H LYS 748 HN LYS 748 11.148 -9.510 13.047 277 HA LYS 748 HA LYS 748 12.662 -11.869 12.235 278 HB2 LYS 748 HB2 LYS 748 14.766 -10.891 12.836 279 HB3 LYS 748 HB1 LYS 748 14.009 -9.855 11.640 280 HG2 LYS 748 HG2 LYS 748 13.973 -9.308 14.617 281 HG3 LYS 748 HG1 LYS 748 15.217 -8.693 13.535 282 HD2 LYS 748 HD2 LYS 748 13.439 -7.548 12.233 283 HD3 LYS 748 HD1 LYS 748 12.257 -8.111 13.415 284 HE2 LYS 748 HE2 LYS 748 12.871 -5.847 13.959 285 HE3 LYS 748 HE1 LYS 748 13.526 -6.925 15.185 286 HZ1 LYS 748 HZ1 LYS 748 15.034 -5.732 12.918 287 HZ2 LYS 748 HZ2 LYS 748 15.693 -6.792 14.049 288 HZ3 LYS 748 HZ3 LYS 748 15.161 -5.282 14.530 289 H GLU 749 HN GLU 749 11.306 -9.921 14.742 290 HA GLU 749 HA GLU 749 12.320 -11.609 16.828 291 HB2 GLU 749 HB2 GLU 749 10.995 -10.114 18.311 292 HB3 GLU 749 HB1 GLU 749 12.129 -9.237 17.300 293 HG2 GLU 749 HG2 GLU 749 9.207 -9.503 16.560 294 HG3 GLU 749 HG1 GLU 749 9.790 -8.221 17.614 295 H ALA 750 HN ALA 750 9.342 -10.995 15.005 296 HA ALA 750 HA ALA 750 8.322 -13.535 15.512 297 HB1 ALA 750 HB1 ALA 750 6.324 -12.855 16.747 298 HB2 ALA 750 HB2 ALA 750 6.958 -11.214 16.882 299 HB3 ALA 750 HB3 ALA 750 7.786 -12.550 17.689 300 H THR 751 HN THR 751 6.434 -13.802 14.341 301 HA THR 751 HA THR 751 5.729 -11.623 12.480 302 HB THR 751 HB THR 751 5.696 -14.568 11.741 303 HG1 THR 751 HG1 THR 751 7.862 -13.632 12.281 304 HG21 THR 751 HG21 THR 751 5.740 -12.043 10.066 305 HG22 THR 751 HG22 THR 751 4.324 -13.049 10.370 306 HG23 THR 751 HG23 THR 751 5.676 -13.694 9.442 307 H SER 752 HN SER 752 3.407 -11.782 11.735 308 HA SER 752 HA SER 752 1.837 -13.084 13.807 309 HB2 SER 752 HB2 SER 752 0.789 -11.302 11.692 310 HB3 SER 752 HB1 SER 752 0.075 -11.681 13.235 311 HG SER 752 HG SER 752 2.336 -10.007 12.772 312 H THR 753 HN THR 753 1.456 -15.031 13.324 313 HA THR 753 HA THR 753 0.150 -15.725 10.828 314 HB THR 753 HB THR 753 1.588 -17.803 10.708 315 HG1 THR 753 HG1 THR 753 3.872 -16.821 11.574 316 HG21 THR 753 HG21 THR 753 2.887 -15.144 10.115 317 HG22 THR 753 HG22 THR 753 1.790 -16.033 9.054 318 HG23 THR 753 HG23 THR 753 3.387 -16.687 9.422 319 H PHE 754 HN PHE 754 -1.517 -16.872 11.316 320 HA PHE 754 HA PHE 754 -1.679 -18.201 13.938 321 HB2 PHE 754 HB2 PHE 754 -4.085 -18.331 13.619 322 HB3 PHE 754 HB1 PHE 754 -3.529 -16.703 13.246 323 HD1 PHE 754 HD1 PHE 754 -3.290 -16.043 10.836 324 HD2 PHE 754 HD2 PHE 754 -5.247 -19.617 12.035 325 HE1 PHE 754 HE1 PHE 754 -4.368 -16.166 8.668 326 HE2 PHE 754 HE2 PHE 754 -6.346 -19.757 9.844 327 HZ PHE 754 HZ PHE 754 -5.914 -18.032 8.149 328 H THR 755 HN THR 755 -1.630 -18.997 10.544 329 HA THR 755 HA THR 755 -2.959 -21.399 10.389 330 HB THR 755 HB THR 755 -1.426 -21.911 8.459 331 HG1 THR 755 HG1 THR 755 0.206 -20.506 8.045 332 HG21 THR 755 HG21 THR 755 -3.468 -20.576 8.221 333 HG22 THR 755 HG22 THR 755 -2.165 -19.979 7.167 334 HG23 THR 755 HG23 THR 755 -2.533 -19.152 8.688 335 H ASN 756 HN ASN 756 0.283 -20.894 11.467 336 HA ASN 756 HA ASN 756 1.256 -23.504 11.378 337 HB2 ASN 756 HB2 ASN 756 2.901 -22.681 13.173 338 HB3 ASN 756 HB1 ASN 756 2.811 -21.743 11.674 339 HD21 ASN 756 HD21 ASN 756 1.881 -19.761 11.730 340 HD22 ASN 756 HD22 ASN 756 1.621 -18.969 13.265 341 H ILE 757 HN ILE 757 -0.657 -22.009 13.727 342 HA ILE 757 HA ILE 757 -0.865 -24.617 15.060 343 HB ILE 757 HB ILE 757 -1.388 -23.308 17.253 344 HG12 ILE 757 HG12 ILE 757 0.133 -21.244 17.404 345 HG13 ILE 757 HG11 ILE 757 0.136 -21.260 15.649 346 HG21 ILE 757 HG21 ILE 757 0.978 -23.387 17.888 347 HG22 ILE 757 HG22 ILE 757 1.406 -23.571 16.186 348 HG23 ILE 757 HG23 ILE 757 0.464 -24.823 16.999 349 HD11 ILE 757 HD11 ILE 757 -2.249 -21.064 15.651 350 HD12 ILE 757 HD12 ILE 757 -1.484 -19.696 16.486 351 HD13 ILE 757 HD13 ILE 757 -2.267 -21.002 17.406 352 H THR 758 HN THR 758 -2.651 -21.944 13.838 353 HA THR 758 HA THR 758 -5.153 -22.983 14.951 354 HB THR 758 HB THR 758 -4.831 -20.528 13.180 355 HG1 THR 758 HG1 THR 758 -4.441 -20.900 15.951 356 HG21 THR 758 HG21 THR 758 -6.891 -21.274 15.279 357 HG22 THR 758 HG22 THR 758 -7.133 -21.342 13.532 358 HG23 THR 758 HG23 THR 758 -6.886 -19.788 14.327 359 H TYR 759 HN TYR 759 -3.522 -24.311 12.834 360 HA TYR 759 HA TYR 759 -4.569 -24.218 10.273 361 HB2 TYR 759 HB2 TYR 759 -4.075 -26.818 10.280 362 HB3 TYR 759 HB1 TYR 759 -2.757 -25.667 10.419 363 HD1 TYR 759 HD2 TYR 759 -1.679 -25.304 12.621 364 HD2 TYR 759 HD1 TYR 759 -4.596 -28.410 12.155 365 HE1 TYR 759 HE2 TYR 759 -0.936 -26.347 14.682 366 HE2 TYR 759 HE1 TYR 759 -3.851 -29.414 14.181 367 HH TYR 759 HH TYR 759 -2.058 -27.956 16.472 368 H ARG 760 HN ARG 760 -5.682 -26.470 12.746 369 HA ARG 760 HA ARG 760 -8.357 -26.405 11.521 370 HB2 ARG 760 HB2 ARG 760 -7.129 -28.756 12.946 371 HB3 ARG 760 HB1 ARG 760 -8.599 -28.725 11.985 372 HG2 ARG 760 HG2 ARG 760 -5.881 -28.195 10.881 373 HG3 ARG 760 HG1 ARG 760 -6.598 -29.801 10.961 374 HD2 ARG 760 HD2 ARG 760 -8.392 -29.125 9.505 375 HD3 ARG 760 HD1 ARG 760 -7.900 -27.435 9.621 376 HE ARG 760 HE ARG 760 -5.844 -29.091 8.553 377 HH11 ARG 760 HH11 ARG 760 -8.858 -27.401 7.713 378 HH12 ARG 760 HH12 ARG 760 -8.460 -27.170 6.078 379 HH21 ARG 760 HH21 ARG 760 -5.294 -28.773 6.222 380 HH22 ARG 760 HH22 ARG 760 -6.431 -27.960 5.236 381 H GLY 761 HN GLY 761 -6.676 -27.568 14.354 382 HA2 GLY 761 HA2 GLY 761 -7.125 -26.228 16.391 383 HA3 GLY 761 HA1 GLY 761 -8.845 -26.599 16.077 384 H THR 762 HN THR 762 -5.729 -28.190 16.090 385 HA THR 762 HA THR 762 -7.065 -30.624 16.909 386 HB THR 762 HB THR 762 -4.330 -30.307 15.686 387 HG1 THR 762 HG1 THR 762 -6.895 -30.532 14.442 388 HG21 THR 762 HG21 THR 762 -4.747 -32.543 14.910 389 HG22 THR 762 HG22 THR 762 -6.326 -32.568 15.709 390 HG23 THR 762 HG23 THR 762 -4.828 -32.499 16.675
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