NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
572048 | 2m45 | 18986 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 600 H1 GLY 600 2.477 15.416 7.342 2 H2 GLY 600 H2 GLY 600 3.385 14.374 8.217 3 H3 GLY 600 H3 GLY 600 1.806 13.994 7.875 4 HA2 GLY 600 HA2 GLY 600 1.038 15.847 9.204 5 HA3 GLY 600 HA3 GLY 600 2.043 14.728 10.160 6 H SER 601 H SER 601 2.903 16.335 11.656 7 HA SER 601 HA SER 601 4.186 18.709 10.876 8 HB2 SER 601 HB2 SER 601 4.908 16.891 13.204 9 HB3 SER 601 HB3 SER 601 5.059 18.657 13.121 10 HG SER 601 HG SER 601 2.863 18.834 13.261 11 H HIS 602 H HIS 602 5.155 15.434 10.384 12 HA HIS 602 HA HIS 602 7.510 16.310 8.980 13 HB2 HIS 602 HB2 HIS 602 8.897 14.449 9.828 14 HB3 HIS 602 HB3 HIS 602 8.499 15.587 11.105 15 HD1 HIS 602 HD1 HIS 602 7.088 14.630 13.151 16 HD2 HIS 602 HD2 HIS 602 7.652 11.978 9.925 17 HE1 HIS 602 HE1 HIS 602 6.249 12.336 13.922 18 H MET 603 H MET 603 8.227 13.990 7.798 19 HA MET 603 HA MET 603 5.893 12.438 7.028 20 HB2 MET 603 HB2 MET 603 6.324 12.785 4.606 21 HB3 MET 603 HB3 MET 603 5.750 14.220 5.428 22 HG2 MET 603 HG2 MET 603 7.429 14.896 3.886 23 HG3 MET 603 HG3 MET 603 8.047 15.133 5.508 24 HE1 MET 603 HE1 MET 603 9.549 11.982 2.452 25 HE2 MET 603 HE2 MET 603 7.878 11.982 3.051 26 HE3 MET 603 HE3 MET 603 8.466 13.338 2.064 27 H GLY 604 H GLY 604 6.911 10.773 5.192 28 HA2 GLY 604 HA2 GLY 604 9.632 10.054 5.580 29 HA3 GLY 604 HA3 GLY 604 8.504 8.911 6.358 30 H GLU 605 H GLU 605 9.784 7.723 4.382 31 HA GLU 605 HA GLU 605 8.796 8.102 1.717 32 HB2 GLU 605 HB2 GLU 605 10.047 5.702 3.133 33 HB3 GLU 605 HB3 GLU 605 9.796 5.820 1.388 34 HG2 GLU 605 HG2 GLU 605 11.355 7.690 1.225 35 HG3 GLU 605 HG3 GLU 605 11.531 7.761 2.982 36 H SER 606 H SER 606 7.100 6.963 0.596 37 HA SER 606 HA SER 606 4.979 5.733 2.057 38 HB2 SER 606 HB2 SER 606 5.791 5.588 -0.870 39 HB3 SER 606 HB3 SER 606 4.231 5.051 -0.224 40 HG SER 606 HG SER 606 4.422 7.274 -1.195 41 H GLY 607 H GLY 607 8.055 4.512 0.971 42 HA2 GLY 607 HA2 GLY 607 8.798 2.348 1.933 43 HA3 GLY 607 HA3 GLY 607 7.238 1.678 1.411 44 H LYS 608 H LYS 608 8.646 0.168 0.160 45 HA LYS 608 HA LYS 608 10.127 1.158 -2.121 46 HB2 LYS 608 HB2 LYS 608 10.384 -1.086 -0.771 47 HB3 LYS 608 HB3 LYS 608 9.100 -1.678 -1.818 48 HG2 LYS 608 HG2 LYS 608 10.976 -0.449 -3.585 49 HG3 LYS 608 HG3 LYS 608 11.969 -1.179 -2.337 50 HD2 LYS 608 HD2 LYS 608 11.749 -2.768 -4.099 51 HD3 LYS 608 HD3 LYS 608 10.764 -3.374 -2.752 52 HE2 LYS 608 HE2 LYS 608 8.726 -2.440 -3.835 53 HE3 LYS 608 HE3 LYS 608 9.708 -1.760 -5.126 54 HZ1 LYS 608 HZ1 LYS 608 9.404 -4.642 -4.561 55 HZ2 LYS 608 HZ2 LYS 608 10.315 -3.996 -5.775 56 HZ3 LYS 608 HZ3 LYS 608 8.681 -3.815 -5.787 57 H ILE 609 H ILE 609 7.025 1.709 -1.790 58 HA ILE 609 HA ILE 609 6.306 1.376 -4.572 59 HB ILE 609 HB ILE 609 4.372 0.609 -2.322 60 HG12 ILE 609 HG12 ILE 609 4.393 -1.683 -3.706 61 HG13 ILE 609 HG13 ILE 609 6.044 -1.210 -4.070 62 HG21 ILE 609 HG21 ILE 609 2.882 -0.075 -4.188 63 HG22 ILE 609 HG22 ILE 609 3.262 1.633 -4.243 64 HG23 ILE 609 HG23 ILE 609 4.086 0.516 -5.355 65 HD11 ILE 609 HD11 ILE 609 4.802 -1.568 -1.294 66 HD12 ILE 609 HD12 ILE 609 5.881 -2.713 -2.110 67 HD13 ILE 609 HD13 ILE 609 6.499 -1.143 -1.581 68 H ASP 610 H ASP 610 4.855 3.224 -5.091 69 HA ASP 610 HA ASP 610 4.125 4.974 -2.889 70 HB2 ASP 610 HB2 ASP 610 6.418 5.658 -4.312 71 HB3 ASP 610 HB3 ASP 610 5.159 6.570 -5.134 72 H ILE 611 H ILE 611 3.305 6.955 -4.198 73 HA ILE 611 HA ILE 611 0.780 6.082 -5.546 74 HB ILE 611 HB ILE 611 1.893 8.813 -4.810 75 HG12 ILE 611 HG12 ILE 611 -0.574 7.750 -3.462 76 HG13 ILE 611 HG13 ILE 611 0.915 6.923 -3.039 77 HG21 ILE 611 HG21 ILE 611 -0.442 9.672 -5.159 78 HG22 ILE 611 HG22 ILE 611 0.355 9.163 -6.648 79 HG23 ILE 611 HG23 ILE 611 -0.862 8.106 -5.902 80 HD11 ILE 611 HD11 ILE 611 0.499 9.924 -2.830 81 HD12 ILE 611 HD12 ILE 611 0.503 8.752 -1.489 82 HD13 ILE 611 HD13 ILE 611 1.987 9.040 -2.416 83 H ASP 612 H ASP 612 3.877 7.591 -6.373 84 HA ASP 612 HA ASP 612 3.095 8.870 -8.767 85 HB2 ASP 612 HB2 ASP 612 5.337 9.326 -9.126 86 HB3 ASP 612 HB3 ASP 612 5.202 9.251 -7.371 87 H THR 613 H THR 613 4.615 5.799 -8.160 88 HA THR 613 HA THR 613 4.859 4.798 -10.737 89 HB THR 613 HB THR 613 5.717 4.080 -8.347 90 HG1 THR 613 HG1 THR 613 6.579 3.233 -10.162 91 HG21 THR 613 HG21 THR 613 4.841 2.094 -7.411 92 HG22 THR 613 HG22 THR 613 3.618 1.934 -8.689 93 HG23 THR 613 HG23 THR 613 3.520 3.269 -7.518 94 H ILE 614 H ILE 614 1.956 5.164 -8.951 95 HA ILE 614 HA ILE 614 0.415 3.254 -10.611 96 HB ILE 614 HB ILE 614 -0.573 5.116 -8.404 97 HG12 ILE 614 HG12 ILE 614 1.085 3.752 -7.357 98 HG13 ILE 614 HG13 ILE 614 -0.511 3.259 -6.837 99 HG21 ILE 614 HG21 ILE 614 -1.825 2.666 -9.689 100 HG22 ILE 614 HG22 ILE 614 -2.469 3.528 -8.274 101 HG23 ILE 614 HG23 ILE 614 -2.358 4.352 -9.835 102 HD11 ILE 614 HD11 ILE 614 1.176 1.845 -8.943 103 HD12 ILE 614 HD12 ILE 614 0.949 1.340 -7.258 104 HD13 ILE 614 HD13 ILE 614 -0.433 1.329 -8.382 105 H MET 615 H MET 615 0.397 6.696 -9.672 106 HA MET 615 HA MET 615 -1.647 7.340 -11.574 107 HB2 MET 615 HB2 MET 615 -1.405 9.626 -10.873 108 HB3 MET 615 HB3 MET 615 -1.237 8.581 -9.464 109 HG2 MET 615 HG2 MET 615 0.470 10.100 -9.118 110 HG3 MET 615 HG3 MET 615 1.321 8.773 -9.899 111 HE1 MET 615 HE1 MET 615 2.996 11.168 -9.751 112 HE2 MET 615 HE2 MET 615 3.424 9.874 -10.902 113 HE3 MET 615 HE3 MET 615 3.450 11.572 -11.422 114 H THR 616 H THR 616 1.860 7.147 -11.939 115 HA THR 616 HA THR 616 1.982 8.730 -14.277 116 HB THR 616 HB THR 616 3.909 8.017 -12.856 117 HG1 THR 616 HG1 THR 616 4.201 8.834 -14.973 118 HG21 THR 616 HG21 THR 616 5.009 5.895 -13.184 119 HG22 THR 616 HG22 THR 616 3.834 5.395 -14.415 120 HG23 THR 616 HG23 THR 616 3.334 5.555 -12.720 121 H GLY 617 H GLY 617 0.688 5.529 -13.771 122 HA2 GLY 617 HA2 GLY 617 0.396 5.122 -16.728 123 HA3 GLY 617 HA3 GLY 617 0.864 3.832 -15.622 124 H LYS 618 H LYS 618 -1.363 5.659 -13.890 125 HA LYS 618 HA LYS 618 -3.790 4.479 -15.119 126 HB2 LYS 618 HB2 LYS 618 -2.824 4.236 -12.221 127 HB3 LYS 618 HB3 LYS 618 -4.514 4.213 -12.622 128 HG2 LYS 618 HG2 LYS 618 -4.093 1.952 -12.613 129 HG3 LYS 618 HG3 LYS 618 -3.903 2.324 -14.321 130 HD2 LYS 618 HD2 LYS 618 -1.321 2.664 -13.553 131 HD3 LYS 618 HD3 LYS 618 -1.837 1.686 -12.203 132 HE2 LYS 618 HE2 LYS 618 -0.787 0.342 -13.958 133 HE3 LYS 618 HE3 LYS 618 -2.473 -0.146 -13.731 134 HZ1 LYS 618 HZ1 LYS 618 -3.066 0.914 -15.716 135 HZ2 LYS 618 HZ2 LYS 618 -1.646 0.169 -16.098 136 HZ3 LYS 618 HZ3 LYS 618 -1.709 1.804 -15.816 137 HA PRO 619 HA PRO 619 -5.338 8.572 -14.110 138 HB2 PRO 619 HB2 PRO 619 -8.013 8.120 -13.724 139 HB3 PRO 619 HB3 PRO 619 -7.240 8.093 -15.341 140 HG2 PRO 619 HG2 PRO 619 -7.942 5.749 -13.550 141 HG3 PRO 619 HG3 PRO 619 -8.212 5.909 -15.314 142 HD2 PRO 619 HD2 PRO 619 -6.089 4.560 -14.207 143 HD3 PRO 619 HD3 PRO 619 -5.951 5.385 -15.778 144 H LYS 620 H LYS 620 -6.223 9.760 -12.248 145 HA LYS 620 HA LYS 620 -5.253 8.823 -9.830 146 HB2 LYS 620 HB2 LYS 620 -6.119 10.670 -8.761 147 HB3 LYS 620 HB3 LYS 620 -5.763 11.228 -10.386 148 HG2 LYS 620 HG2 LYS 620 -8.135 11.291 -10.957 149 HG3 LYS 620 HG3 LYS 620 -8.565 10.410 -9.481 150 HD2 LYS 620 HD2 LYS 620 -7.571 12.314 -8.141 151 HD3 LYS 620 HD3 LYS 620 -7.531 13.259 -9.638 152 HE2 LYS 620 HE2 LYS 620 -9.868 13.378 -9.770 153 HE3 LYS 620 HE3 LYS 620 -10.087 11.831 -8.934 154 HZ1 LYS 620 HZ1 LYS 620 -10.767 13.644 -7.537 155 HZ2 LYS 620 HZ2 LYS 620 -9.256 14.311 -7.584 156 HZ3 LYS 620 HZ3 LYS 620 -9.495 12.831 -6.878 157 H SER 621 H SER 621 -8.443 8.241 -11.148 158 HA SER 621 HA SER 621 -9.989 7.357 -9.062 159 HB2 SER 621 HB2 SER 621 -10.576 7.419 -11.496 160 HB3 SER 621 HB3 SER 621 -9.655 5.922 -11.724 161 HG SER 621 HG SER 621 -11.962 6.324 -10.113 162 H ALA 622 H ALA 622 -7.096 5.675 -10.411 163 HA ALA 622 HA ALA 622 -7.397 3.179 -9.085 164 HB1 ALA 622 HB1 ALA 622 -4.892 4.724 -9.874 165 HB2 ALA 622 HB2 ALA 622 -4.936 3.027 -9.342 166 HB3 ALA 622 HB3 ALA 622 -5.761 3.502 -10.836 167 H ARG 623 H ARG 623 -5.525 6.095 -7.952 168 HA ARG 623 HA ARG 623 -5.132 4.955 -5.291 169 HB2 ARG 623 HB2 ARG 623 -3.890 6.848 -4.821 170 HB3 ARG 623 HB3 ARG 623 -3.781 6.894 -6.582 171 HG2 ARG 623 HG2 ARG 623 -5.928 8.344 -6.421 172 HG3 ARG 623 HG3 ARG 623 -5.536 8.529 -4.720 173 HD2 ARG 623 HD2 ARG 623 -3.492 9.756 -5.437 174 HD3 ARG 623 HD3 ARG 623 -3.948 9.462 -7.142 175 HE ARG 623 HE ARG 623 -6.201 10.436 -6.490 176 HH11 ARG 623 HH11 ARG 623 -3.323 11.791 -4.955 177 HH12 ARG 623 HH12 ARG 623 -4.184 13.088 -4.191 178 HH21 ARG 623 HH21 ARG 623 -7.361 12.022 -5.499 179 HH22 ARG 623 HH22 ARG 623 -6.553 13.249 -4.567 180 H GLU 624 H GLU 624 -7.512 7.170 -6.728 181 HA GLU 624 HA GLU 624 -8.888 7.973 -4.463 182 HB2 GLU 624 HB2 GLU 624 -9.213 7.913 -7.329 183 HB3 GLU 624 HB3 GLU 624 -10.751 7.493 -6.616 184 HG2 GLU 624 HG2 GLU 624 -10.731 9.807 -7.098 185 HG3 GLU 624 HG3 GLU 624 -10.682 9.614 -5.363 186 H LYS 625 H LYS 625 -9.091 4.883 -6.161 187 HA LYS 625 HA LYS 625 -11.214 3.880 -4.340 188 HB2 LYS 625 HB2 LYS 625 -9.806 2.658 -6.744 189 HB3 LYS 625 HB3 LYS 625 -11.071 1.847 -5.808 190 HG2 LYS 625 HG2 LYS 625 -12.741 3.470 -6.451 191 HG3 LYS 625 HG3 LYS 625 -11.534 4.560 -7.121 192 HD2 LYS 625 HD2 LYS 625 -12.390 3.583 -9.012 193 HD3 LYS 625 HD3 LYS 625 -10.904 2.658 -8.746 194 HE2 LYS 625 HE2 LYS 625 -12.208 0.844 -7.679 195 HE3 LYS 625 HE3 LYS 625 -13.687 1.809 -7.798 196 HZ1 LYS 625 HZ1 LYS 625 -13.667 0.238 -9.545 197 HZ2 LYS 625 HZ2 LYS 625 -12.159 0.693 -10.058 198 HZ3 LYS 625 HZ3 LYS 625 -13.443 1.717 -10.214 199 H MET 626 H MET 626 -7.820 3.071 -5.270 200 HA MET 626 HA MET 626 -7.472 0.736 -3.737 201 HB2 MET 626 HB2 MET 626 -5.521 2.888 -4.618 202 HB3 MET 626 HB3 MET 626 -5.011 1.442 -3.769 203 HG2 MET 626 HG2 MET 626 -6.625 1.160 -6.309 204 HG3 MET 626 HG3 MET 626 -4.914 1.570 -6.372 205 HE1 MET 626 HE1 MET 626 -6.688 -2.535 -5.806 206 HE2 MET 626 HE2 MET 626 -7.565 -1.046 -5.361 207 HE3 MET 626 HE3 MET 626 -7.035 -1.297 -7.039 208 H MET 627 H MET 627 -6.728 4.183 -2.981 209 HA MET 627 HA MET 627 -5.768 3.606 -0.423 210 HB2 MET 627 HB2 MET 627 -6.877 6.220 -1.519 211 HB3 MET 627 HB3 MET 627 -6.019 6.058 0.009 212 HG2 MET 627 HG2 MET 627 -4.847 5.445 -2.726 213 HG3 MET 627 HG3 MET 627 -4.539 6.878 -1.748 214 HE1 MET 627 HE1 MET 627 -1.954 6.628 -1.912 215 HE2 MET 627 HE2 MET 627 -1.079 5.108 -1.624 216 HE3 MET 627 HE3 MET 627 -2.202 5.237 -2.997 217 H LYS 628 H LYS 628 -8.928 4.365 -1.664 218 HA LYS 628 HA LYS 628 -10.258 4.857 0.869 219 HB2 LYS 628 HB2 LYS 628 -11.072 4.526 -1.978 220 HB3 LYS 628 HB3 LYS 628 -12.274 3.938 -0.841 221 HG2 LYS 628 HG2 LYS 628 -10.968 6.656 -0.470 222 HG3 LYS 628 HG3 LYS 628 -12.363 6.437 -1.539 223 HD2 LYS 628 HD2 LYS 628 -13.771 5.689 0.195 224 HD3 LYS 628 HD3 LYS 628 -12.454 5.446 1.349 225 HE2 LYS 628 HE2 LYS 628 -12.854 8.169 0.143 226 HE3 LYS 628 HE3 LYS 628 -14.020 7.629 1.355 227 HZ1 LYS 628 HZ1 LYS 628 -11.098 7.465 1.942 228 HZ2 LYS 628 HZ2 LYS 628 -12.328 7.421 2.962 229 HZ3 LYS 628 HZ3 LYS 628 -11.962 8.848 2.224 230 H ILE 629 H ILE 629 -9.879 1.945 -1.153 231 HA ILE 629 HA ILE 629 -11.466 0.289 0.519 232 HB ILE 629 HB ILE 629 -9.107 -0.431 -1.245 233 HG12 ILE 629 HG12 ILE 629 -11.930 -1.007 -2.139 234 HG13 ILE 629 HG13 ILE 629 -11.453 0.677 -2.155 235 HG21 ILE 629 HG21 ILE 629 -9.514 -2.308 0.225 236 HG22 ILE 629 HG22 ILE 629 -11.259 -2.255 -0.114 237 HG23 ILE 629 HG23 ILE 629 -10.100 -2.712 -1.387 238 HD11 ILE 629 HD11 ILE 629 -9.322 -0.057 -3.389 239 HD12 ILE 629 HD12 ILE 629 -10.126 -1.601 -3.632 240 HD13 ILE 629 HD13 ILE 629 -10.813 -0.078 -4.285 241 H ILE 630 H ILE 630 -7.869 0.709 0.398 242 HA ILE 630 HA ILE 630 -7.473 -0.969 2.686 243 HB ILE 630 HB ILE 630 -5.185 -0.111 2.792 244 HG12 ILE 630 HG12 ILE 630 -4.502 1.306 0.664 245 HG13 ILE 630 HG13 ILE 630 -6.145 1.890 0.770 246 HG21 ILE 630 HG21 ILE 630 -5.886 -1.958 1.275 247 HG22 ILE 630 HG22 ILE 630 -6.051 -0.770 -0.036 248 HG23 ILE 630 HG23 ILE 630 -4.468 -1.065 0.701 249 HD11 ILE 630 HD11 ILE 630 -4.547 3.378 1.890 250 HD12 ILE 630 HD12 ILE 630 -5.708 2.753 3.051 251 HD13 ILE 630 HD13 ILE 630 -4.082 2.054 2.993 252 H GLU 631 H GLU 631 -8.287 2.517 2.504 253 HA GLU 631 HA GLU 631 -7.687 3.214 5.173 254 HB2 GLU 631 HB2 GLU 631 -9.513 4.093 2.954 255 HB3 GLU 631 HB3 GLU 631 -9.819 4.713 4.560 256 HG2 GLU 631 HG2 GLU 631 -7.840 5.920 4.642 257 HG3 GLU 631 HG3 GLU 631 -7.082 4.968 3.364 258 H ILE 632 H ILE 632 -10.676 1.904 3.587 259 HA ILE 632 HA ILE 632 -12.112 1.754 6.051 260 HB ILE 632 HB ILE 632 -12.542 0.182 3.486 261 HG12 ILE 632 HG12 ILE 632 -14.230 2.548 4.378 262 HG13 ILE 632 HG13 ILE 632 -12.737 2.850 3.520 263 HG21 ILE 632 HG21 ILE 632 -14.901 -0.092 4.389 264 HG22 ILE 632 HG22 ILE 632 -13.680 -0.918 5.347 265 HG23 ILE 632 HG23 ILE 632 -14.348 0.611 5.923 266 HD11 ILE 632 HD11 ILE 632 -15.056 1.190 2.472 267 HD12 ILE 632 HD12 ILE 632 -14.553 2.804 1.929 268 HD13 ILE 632 HD13 ILE 632 -13.500 1.408 1.637 269 H ILE 633 H ILE 633 -10.075 -0.665 4.295 270 HA ILE 633 HA ILE 633 -10.721 -2.857 6.002 271 HB ILE 633 HB ILE 633 -8.110 -2.412 4.507 272 HG12 ILE 633 HG12 ILE 633 -10.764 -2.929 3.422 273 HG13 ILE 633 HG13 ILE 633 -9.251 -2.521 2.632 274 HG21 ILE 633 HG21 ILE 633 -8.049 -4.182 6.270 275 HG22 ILE 633 HG22 ILE 633 -9.373 -5.014 5.454 276 HG23 ILE 633 HG23 ILE 633 -7.810 -4.818 4.645 277 HD11 ILE 633 HD11 ILE 633 -10.130 -4.547 1.698 278 HD12 ILE 633 HD12 ILE 633 -8.607 -4.871 2.522 279 HD13 ILE 633 HD13 ILE 633 -10.130 -5.344 3.282 280 H ASP 634 H ASP 634 -8.033 -0.394 6.117 281 HA ASP 634 HA ASP 634 -6.906 -1.607 8.412 282 HB2 ASP 634 HB2 ASP 634 -5.810 -0.011 6.703 283 HB3 ASP 634 HB3 ASP 634 -6.482 1.300 7.676 284 H SER 635 H SER 635 -9.251 1.078 7.956 285 HA SER 635 HA SER 635 -9.365 1.907 10.662 286 HB2 SER 635 HB2 SER 635 -11.624 1.922 8.614 287 HB3 SER 635 HB3 SER 635 -11.535 2.890 10.097 288 HG SER 635 HG SER 635 -9.909 3.015 7.767 289 H LEU 636 H LEU 636 -11.197 -0.649 8.911 290 HA LEU 636 HA LEU 636 -12.796 -1.375 11.204 291 HB2 LEU 636 HB2 LEU 636 -12.084 -2.721 8.613 292 HB3 LEU 636 HB3 LEU 636 -13.126 -3.509 9.807 293 HG LEU 636 HG LEU 636 -13.741 -0.797 8.542 294 HD11 LEU 636 HD11 LEU 636 -14.777 -3.558 7.792 295 HD12 LEU 636 HD12 LEU 636 -13.620 -2.581 6.867 296 HD13 LEU 636 HD13 LEU 636 -15.282 -2.003 7.083 297 HD21 LEU 636 HD21 LEU 636 -16.038 -1.234 9.325 298 HD22 LEU 636 HD22 LEU 636 -14.914 -1.145 10.683 299 HD23 LEU 636 HD23 LEU 636 -15.500 -2.726 10.118 300 H ALA 637 H ALA 637 -9.657 -2.525 9.872 301 HA ALA 637 HA ALA 637 -9.391 -4.729 11.694 302 HB1 ALA 637 HB1 ALA 637 -7.112 -4.864 10.822 303 HB2 ALA 637 HB2 ALA 637 -8.279 -4.648 9.501 304 HB3 ALA 637 HB3 ALA 637 -7.287 -3.273 10.054 305 H VAL 638 H VAL 638 -8.885 -1.344 12.192 306 HA VAL 638 HA VAL 638 -6.648 -1.240 13.739 307 HB VAL 638 HB VAL 638 -8.213 0.597 12.771 308 HG11 VAL 638 HG11 VAL 638 -9.674 1.752 14.265 309 HG12 VAL 638 HG12 VAL 638 -10.167 0.053 14.285 310 HG13 VAL 638 HG13 VAL 638 -9.230 0.720 15.638 311 HG21 VAL 638 HG21 VAL 638 -6.022 1.052 13.747 312 HG22 VAL 638 HG22 VAL 638 -7.192 2.317 14.149 313 HG23 VAL 638 HG23 VAL 638 -6.738 1.113 15.374 314 H SER 639 H SER 639 -9.468 -2.832 14.764 315 HA SER 639 HA SER 639 -8.092 -3.567 17.205 316 HB2 SER 639 HB2 SER 639 -10.826 -2.238 17.394 317 HB3 SER 639 HB3 SER 639 -10.040 -3.138 18.711 318 HG SER 639 HG SER 639 -8.381 -1.291 17.533 319 H SER 640 H SER 640 -8.616 -4.892 14.732 320 HA SER 640 HA SER 640 -10.156 -7.187 15.791 321 HB2 SER 640 HB2 SER 640 -11.720 -5.901 14.337 322 HB3 SER 640 HB3 SER 640 -10.537 -5.965 13.023 323 HG SER 640 HG SER 640 -11.616 -7.685 12.514 324 H GLU 641 H GLU 641 -9.629 -9.157 14.543 325 HA GLU 641 HA GLU 641 -6.806 -9.412 13.823 326 HB2 GLU 641 HB2 GLU 641 -9.206 -11.242 13.369 327 HB3 GLU 641 HB3 GLU 641 -7.523 -11.669 13.044 328 HG2 GLU 641 HG2 GLU 641 -6.995 -11.380 15.470 329 HG3 GLU 641 HG3 GLU 641 -8.703 -11.028 15.784 330 H CYS 642 H CYS 642 -9.875 -8.785 12.181 331 HA CYS 642 HA CYS 642 -8.557 -7.899 9.788 332 HB2 CYS 642 HB2 CYS 642 -9.782 -9.506 8.278 333 HB3 CYS 642 HB3 CYS 642 -8.499 -10.229 9.232 334 H ALA 643 H ALA 643 -10.021 -6.997 8.283 335 HA ALA 643 HA ALA 643 -12.505 -5.831 9.374 336 HB1 ALA 643 HB1 ALA 643 -10.871 -4.492 8.052 337 HB2 ALA 643 HB2 ALA 643 -11.104 -5.581 6.679 338 HB3 ALA 643 HB3 ALA 643 -12.458 -4.598 7.238 339 H LYS 644 H LYS 644 -14.386 -7.020 9.144 340 HA LYS 644 HA LYS 644 -14.753 -9.202 7.337 341 HB2 LYS 644 HB2 LYS 644 -17.176 -8.811 7.711 342 HB3 LYS 644 HB3 LYS 644 -16.103 -9.312 9.029 343 HG2 LYS 644 HG2 LYS 644 -16.235 -6.695 9.637 344 HG3 LYS 644 HG3 LYS 644 -17.739 -6.882 8.691 345 HD2 LYS 644 HD2 LYS 644 -18.138 -9.009 10.105 346 HD3 LYS 644 HD3 LYS 644 -16.894 -8.399 11.196 347 HE2 LYS 644 HE2 LYS 644 -19.382 -6.881 10.341 348 HE3 LYS 644 HE3 LYS 644 -19.298 -7.949 11.768 349 HZ1 LYS 644 HZ1 LYS 644 -17.968 -5.374 11.307 350 HZ2 LYS 644 HZ2 LYS 644 -17.407 -6.415 12.486 351 HZ3 LYS 644 HZ3 LYS 644 -18.938 -5.777 12.535 352 H VAL 645 H VAL 645 -15.044 -9.210 5.091 353 HA VAL 645 HA VAL 645 -15.194 -6.652 3.767 354 HB VAL 645 HB VAL 645 -14.093 -8.658 2.778 355 HG11 VAL 645 HG11 VAL 645 -15.932 -10.334 3.045 356 HG12 VAL 645 HG12 VAL 645 -16.894 -9.414 1.859 357 HG13 VAL 645 HG13 VAL 645 -15.373 -10.161 1.367 358 HG21 VAL 645 HG21 VAL 645 -14.571 -6.591 1.479 359 HG22 VAL 645 HG22 VAL 645 -14.648 -8.059 0.479 360 HG23 VAL 645 HG23 VAL 645 -16.133 -7.272 0.986 361 H LYS 646 H LYS 646 -17.625 -8.601 5.205 362 HA LYS 646 HA LYS 646 -19.924 -7.553 3.821 363 HB2 LYS 646 HB2 LYS 646 -19.610 -8.161 6.806 364 HB3 LYS 646 HB3 LYS 646 -21.125 -8.079 5.907 365 HG2 LYS 646 HG2 LYS 646 -18.926 -10.170 5.530 366 HG3 LYS 646 HG3 LYS 646 -20.460 -10.402 6.370 367 HD2 LYS 646 HD2 LYS 646 -21.727 -10.052 4.327 368 HD3 LYS 646 HD3 LYS 646 -20.278 -9.571 3.445 369 HE2 LYS 646 HE2 LYS 646 -20.790 -11.849 2.817 370 HE3 LYS 646 HE3 LYS 646 -19.262 -11.769 3.689 371 HZ1 LYS 646 HZ1 LYS 646 -21.821 -12.798 4.717 372 HZ2 LYS 646 HZ2 LYS 646 -20.492 -12.504 5.680 373 HZ3 LYS 646 HZ3 LYS 646 -20.382 -13.585 4.468 374 H ASP 647 H ASP 647 -17.724 -6.155 6.252 375 HA ASP 647 HA ASP 647 -19.554 -3.942 6.699 376 HB2 ASP 647 HB2 ASP 647 -16.928 -4.928 7.844 377 HB3 ASP 647 HB3 ASP 647 -17.253 -3.228 7.960 378 H ILE 648 H ILE 648 -16.578 -4.747 4.982 379 HA ILE 648 HA ILE 648 -16.103 -2.087 4.019 380 HB ILE 648 HB ILE 648 -15.328 -4.705 2.660 381 HG12 ILE 648 HG12 ILE 648 -13.718 -3.114 4.701 382 HG13 ILE 648 HG13 ILE 648 -14.571 -4.572 5.110 383 HG21 ILE 648 HG21 ILE 648 -14.071 -1.920 2.525 384 HG22 ILE 648 HG22 ILE 648 -13.520 -3.350 1.633 385 HG23 ILE 648 HG23 ILE 648 -15.081 -2.647 1.261 386 HD11 ILE 648 HD11 ILE 648 -12.169 -4.962 4.737 387 HD12 ILE 648 HD12 ILE 648 -13.186 -5.937 3.672 388 HD13 ILE 648 HD13 ILE 648 -12.363 -4.505 3.043 389 H LEU 649 H LEU 649 -17.997 -4.837 2.738 390 HA LEU 649 HA LEU 649 -18.977 -3.567 0.442 391 HB2 LEU 649 HB2 LEU 649 -20.006 -5.754 2.239 392 HB3 LEU 649 HB3 LEU 649 -21.016 -5.163 0.931 393 HG LEU 649 HG LEU 649 -18.141 -6.031 0.402 394 HD11 LEU 649 HD11 LEU 649 -19.002 -8.234 -0.269 395 HD12 LEU 649 HD12 LEU 649 -20.633 -7.790 0.281 396 HD13 LEU 649 HD13 LEU 649 -19.296 -7.947 1.445 397 HD21 LEU 649 HD21 LEU 649 -19.252 -4.716 -1.368 398 HD22 LEU 649 HD22 LEU 649 -20.632 -5.824 -1.325 399 HD23 LEU 649 HD23 LEU 649 -19.036 -6.391 -1.881 400 H LYS 650 H LYS 650 -20.263 -3.439 3.816 401 HA LYS 650 HA LYS 650 -22.452 -1.672 3.165 402 HB2 LYS 650 HB2 LYS 650 -20.775 -1.767 5.704 403 HB3 LYS 650 HB3 LYS 650 -22.201 -0.764 5.500 404 HG2 LYS 650 HG2 LYS 650 -23.648 -2.676 5.292 405 HG3 LYS 650 HG3 LYS 650 -22.272 -3.771 5.198 406 HD2 LYS 650 HD2 LYS 650 -21.638 -2.701 7.581 407 HD3 LYS 650 HD3 LYS 650 -23.346 -2.248 7.586 408 HE2 LYS 650 HE2 LYS 650 -23.190 -4.361 8.703 409 HE3 LYS 650 HE3 LYS 650 -23.889 -4.684 7.106 410 HZ1 LYS 650 HZ1 LYS 650 -22.186 -6.266 7.529 411 HZ2 LYS 650 HZ2 LYS 650 -21.090 -5.128 7.983 412 HZ3 LYS 650 HZ3 LYS 650 -21.560 -5.226 6.396 413 H GLU 651 H GLU 651 -19.242 -0.717 4.517 414 HA GLU 651 HA GLU 651 -19.904 2.033 4.197 415 HB2 GLU 651 HB2 GLU 651 -17.154 0.826 4.663 416 HB3 GLU 651 HB3 GLU 651 -17.642 2.497 4.944 417 HG2 GLU 651 HG2 GLU 651 -18.330 0.031 6.529 418 HG3 GLU 651 HG3 GLU 651 -17.687 1.564 7.087 419 H ALA 652 H ALA 652 -18.036 -0.166 2.094 420 HA ALA 652 HA ALA 652 -17.170 1.997 0.432 421 HB1 ALA 652 HB1 ALA 652 -15.833 0.047 0.526 422 HB2 ALA 652 HB2 ALA 652 -17.126 -0.897 -0.242 423 HB3 ALA 652 HB3 ALA 652 -16.334 0.434 -1.122 424 H GLN 653 H GLN 653 -20.120 -0.205 0.317 425 HA GLN 653 HA GLN 653 -21.009 1.113 -2.105 426 HB2 GLN 653 HB2 GLN 653 -22.498 -0.372 0.072 427 HB3 GLN 653 HB3 GLN 653 -23.305 0.379 -1.315 428 HG2 GLN 653 HG2 GLN 653 -21.988 -0.868 -2.906 429 HG3 GLN 653 HG3 GLN 653 -20.980 -1.560 -1.631 430 HE21 GLN 653 HE21 GLN 653 -22.255 -2.738 0.100 431 HE22 GLN 653 HE22 GLN 653 -23.517 -3.856 -0.470 432 H GLN 654 H GLN 654 -21.023 2.098 1.304 433 HA GLN 654 HA GLN 654 -22.727 4.386 0.793 434 HB2 GLN 654 HB2 GLN 654 -20.671 4.278 3.024 435 HB3 GLN 654 HB3 GLN 654 -22.048 5.340 2.860 436 HG2 GLN 654 HG2 GLN 654 -21.970 2.500 3.767 437 HG3 GLN 654 HG3 GLN 654 -22.818 3.867 4.431 438 HE21 GLN 654 HE21 GLN 654 -23.015 1.129 2.327 439 HE22 GLN 654 HE22 GLN 654 -24.701 1.392 1.817 440 H VAL 655 H VAL 655 -19.096 4.042 0.545 441 HA VAL 655 HA VAL 655 -18.947 6.842 -0.327 442 HB VAL 655 HB VAL 655 -16.575 6.115 -1.082 443 HG11 VAL 655 HG11 VAL 655 -15.781 6.401 1.270 444 HG12 VAL 655 HG12 VAL 655 -17.068 7.550 0.860 445 HG13 VAL 655 HG13 VAL 655 -17.432 6.119 1.847 446 HG21 VAL 655 HG21 VAL 655 -17.002 3.671 -0.858 447 HG22 VAL 655 HG22 VAL 655 -15.515 4.303 -0.163 448 HG23 VAL 655 HG23 VAL 655 -16.867 3.939 0.913 449 H GLY 656 H GLY 656 -19.888 3.921 -1.860 450 HA2 GLY 656 HA2 GLY 656 -21.369 4.408 -3.706 451 HA3 GLY 656 HA3 GLY 656 -20.207 5.586 -4.328 452 H ILE 657 H ILE 657 -18.748 2.701 -3.132 453 HA ILE 657 HA ILE 657 -17.876 1.972 -5.827 454 HB ILE 657 HB ILE 657 -17.344 0.626 -3.159 455 HG12 ILE 657 HG12 ILE 657 -16.523 2.657 -2.644 456 HG13 ILE 657 HG13 ILE 657 -15.121 1.739 -3.130 457 HG21 ILE 657 HG21 ILE 657 -16.832 -0.655 -5.290 458 HG22 ILE 657 HG22 ILE 657 -15.747 0.639 -5.781 459 HG23 ILE 657 HG23 ILE 657 -15.392 -0.339 -4.329 460 HD11 ILE 657 HD11 ILE 657 -16.516 3.935 -4.715 461 HD12 ILE 657 HD12 ILE 657 -14.964 4.031 -3.880 462 HD13 ILE 657 HD13 ILE 657 -15.127 2.979 -5.307 463 H GLU 658 H GLU 658 -18.510 0.005 -6.884 464 HA GLU 658 HA GLU 658 -21.170 -0.953 -6.166 465 HB2 GLU 658 HB2 GLU 658 -20.738 -0.448 -8.434 466 HB3 GLU 658 HB3 GLU 658 -19.187 -1.294 -8.438 467 HG2 GLU 658 HG2 GLU 658 -21.130 -2.277 -9.761 468 HG3 GLU 658 HG3 GLU 658 -20.075 -3.307 -8.799 469 H LYS 659 H LYS 659 -21.592 -3.006 -5.323 470 HA LYS 659 HA LYS 659 -19.582 -4.422 -3.948 471 HB2 LYS 659 HB2 LYS 659 -20.894 -6.217 -3.484 472 HB3 LYS 659 HB3 LYS 659 -21.873 -4.787 -3.300 473 HG2 LYS 659 HG2 LYS 659 -22.205 -6.349 -5.860 474 HG3 LYS 659 HG3 LYS 659 -22.579 -7.203 -4.376 475 HD2 LYS 659 HD2 LYS 659 -24.657 -6.307 -4.987 476 HD3 LYS 659 HD3 LYS 659 -24.086 -5.195 -3.722 477 HE2 LYS 659 HE2 LYS 659 -22.884 -4.292 -6.038 478 HE3 LYS 659 HE3 LYS 659 -24.424 -4.790 -6.676 479 HZ1 LYS 659 HZ1 LYS 659 -24.040 -2.491 -6.014 480 HZ2 LYS 659 HZ2 LYS 659 -24.096 -2.921 -4.389 481 HZ3 LYS 659 HZ3 LYS 659 -25.438 -3.121 -5.354 482 H SER 660 H SER 660 -20.524 -4.964 -7.368 483 HA SER 660 HA SER 660 -18.842 -7.293 -7.627 484 HB2 SER 660 HB2 SER 660 -20.579 -6.546 -9.282 485 HB3 SER 660 HB3 SER 660 -19.513 -5.211 -9.751 486 HG SER 660 HG SER 660 -19.067 -7.991 -10.025 487 H ASN 661 H ASN 661 -18.204 -3.815 -7.737 488 HA ASN 661 HA ASN 661 -15.440 -3.946 -8.568 489 HB2 ASN 661 HB2 ASN 661 -17.130 -1.772 -7.385 490 HB3 ASN 661 HB3 ASN 661 -15.416 -1.728 -7.136 491 HD21 ASN 661 HD21 ASN 661 -17.656 -2.403 -9.923 492 HD22 ASN 661 HD22 ASN 661 -16.713 -1.441 -11.042 493 H ILE 662 H ILE 662 -17.113 -3.880 -5.338 494 HA ILE 662 HA ILE 662 -14.695 -3.543 -3.860 495 HB ILE 662 HB ILE 662 -17.426 -4.643 -3.090 496 HG12 ILE 662 HG12 ILE 662 -16.178 -1.959 -2.356 497 HG13 ILE 662 HG13 ILE 662 -17.028 -2.193 -3.867 498 HG21 ILE 662 HG21 ILE 662 -15.081 -3.923 -1.266 499 HG22 ILE 662 HG22 ILE 662 -16.743 -4.190 -0.705 500 HG23 ILE 662 HG23 ILE 662 -15.847 -5.516 -1.439 501 HD11 ILE 662 HD11 ILE 662 -19.104 -2.758 -2.742 502 HD12 ILE 662 HD12 ILE 662 -18.308 -2.528 -1.174 503 HD13 ILE 662 HD13 ILE 662 -18.505 -1.169 -2.279 504 H GLU 663 H GLU 663 -16.482 -6.395 -4.950 505 HA GLU 663 HA GLU 663 -14.880 -8.232 -3.412 506 HB2 GLU 663 HB2 GLU 663 -16.875 -8.596 -5.678 507 HB3 GLU 663 HB3 GLU 663 -16.225 -9.928 -4.714 508 HG2 GLU 663 HG2 GLU 663 -17.584 -7.555 -3.343 509 HG3 GLU 663 HG3 GLU 663 -18.535 -8.807 -4.065 510 H LYS 664 H LYS 664 -14.887 -7.238 -6.910 511 HA LYS 664 HA LYS 664 -12.647 -9.013 -7.433 512 HB2 LYS 664 HB2 LYS 664 -12.561 -8.198 -9.608 513 HB3 LYS 664 HB3 LYS 664 -14.264 -8.290 -9.166 514 HG2 LYS 664 HG2 LYS 664 -14.035 -5.749 -8.628 515 HG3 LYS 664 HG3 LYS 664 -12.528 -5.820 -9.539 516 HD2 LYS 664 HD2 LYS 664 -15.315 -6.571 -10.538 517 HD3 LYS 664 HD3 LYS 664 -14.446 -5.076 -10.916 518 HE2 LYS 664 HE2 LYS 664 -12.675 -6.356 -12.064 519 HE3 LYS 664 HE3 LYS 664 -13.477 -7.877 -11.642 520 HZ1 LYS 664 HZ1 LYS 664 -15.364 -7.187 -12.963 521 HZ2 LYS 664 HZ2 LYS 664 -13.999 -7.218 -13.879 522 HZ3 LYS 664 HZ3 LYS 664 -14.617 -5.779 -13.375 523 H LEU 665 H LEU 665 -12.911 -5.626 -6.398 524 HA LEU 665 HA LEU 665 -10.160 -4.899 -6.600 525 HB2 LEU 665 HB2 LEU 665 -12.452 -4.042 -4.788 526 HB3 LEU 665 HB3 LEU 665 -10.852 -3.410 -4.558 527 HG LEU 665 HG LEU 665 -12.219 -3.227 -7.282 528 HD11 LEU 665 HD11 LEU 665 -13.707 -2.147 -5.665 529 HD12 LEU 665 HD12 LEU 665 -12.913 -0.924 -6.664 530 HD13 LEU 665 HD13 LEU 665 -12.396 -1.230 -4.991 531 HD21 LEU 665 HD21 LEU 665 -10.690 -1.334 -7.638 532 HD22 LEU 665 HD22 LEU 665 -9.801 -2.823 -7.311 533 HD23 LEU 665 HD23 LEU 665 -9.965 -1.602 -6.041 534 H LEU 666 H LEU 666 -12.026 -6.126 -3.749 535 HA LEU 666 HA LEU 666 -9.855 -6.500 -2.001 536 HB2 LEU 666 HB2 LEU 666 -12.520 -7.896 -2.398 537 HB3 LEU 666 HB3 LEU 666 -11.393 -8.510 -1.233 538 HG LEU 666 HG LEU 666 -13.338 -6.631 -0.779 539 HD11 LEU 666 HD11 LEU 666 -10.750 -7.103 0.795 540 HD12 LEU 666 HD12 LEU 666 -12.232 -8.067 0.912 541 HD13 LEU 666 HD13 LEU 666 -12.224 -6.393 1.474 542 HD21 LEU 666 HD21 LEU 666 -10.804 -5.014 -0.651 543 HD22 LEU 666 HD22 LEU 666 -12.418 -4.577 -0.050 544 HD23 LEU 666 HD23 LEU 666 -12.167 -4.763 -1.785 545 H THR 667 H THR 667 -11.146 -8.697 -4.516 546 HA THR 667 HA THR 667 -9.371 -10.821 -4.005 547 HB THR 667 HB THR 667 -10.741 -10.051 -6.600 548 HG1 THR 667 HG1 THR 667 -12.248 -10.419 -5.085 549 HG21 THR 667 HG21 THR 667 -9.462 -12.689 -5.727 550 HG22 THR 667 HG22 THR 667 -8.941 -11.655 -7.072 551 HG23 THR 667 HG23 THR 667 -10.506 -12.470 -7.150 552 H ASP 668 H ASP 668 -8.947 -7.996 -6.258 553 HA ASP 668 HA ASP 668 -6.396 -8.797 -7.270 554 HB2 ASP 668 HB2 ASP 668 -7.592 -7.094 -8.418 555 HB3 ASP 668 HB3 ASP 668 -7.833 -6.141 -6.958 556 H MET 669 H MET 669 -7.379 -6.722 -4.519 557 HA MET 669 HA MET 669 -4.816 -6.043 -3.657 558 HB2 MET 669 HB2 MET 669 -7.347 -6.428 -2.009 559 HB3 MET 669 HB3 MET 669 -5.858 -5.660 -1.448 560 HG2 MET 669 HG2 MET 669 -6.291 -4.223 -3.693 561 HG3 MET 669 HG3 MET 669 -7.947 -4.606 -3.262 562 HE1 MET 669 HE1 MET 669 -6.999 -0.889 -2.048 563 HE2 MET 669 HE2 MET 669 -5.979 -1.779 -3.194 564 HE3 MET 669 HE3 MET 669 -7.755 -1.837 -3.347 565 H ARG 670 H ARG 670 -6.786 -8.823 -2.405 566 HA ARG 670 HA ARG 670 -4.694 -9.739 -0.672 567 HB2 ARG 670 HB2 ARG 670 -5.931 -11.822 -0.415 568 HB3 ARG 670 HB3 ARG 670 -7.006 -10.440 -0.271 569 HG2 ARG 670 HG2 ARG 670 -7.989 -10.807 -2.360 570 HG3 ARG 670 HG3 ARG 670 -6.721 -11.856 -2.934 571 HD2 ARG 670 HD2 ARG 670 -7.455 -13.676 -1.620 572 HD3 ARG 670 HD3 ARG 670 -8.561 -12.644 -0.697 573 HE ARG 670 HE ARG 670 -9.012 -12.606 -3.575 574 HH11 ARG 670 HH11 ARG 670 -9.880 -14.530 -0.723 575 HH12 ARG 670 HH12 ARG 670 -11.542 -14.621 -1.080 576 HH21 ARG 670 HH21 ARG 670 -11.351 -12.615 -4.070 577 HH22 ARG 670 HH22 ARG 670 -12.312 -13.721 -3.156 578 H LYS 671 H LYS 671 -5.369 -10.358 -4.101 579 HA LYS 671 HA LYS 671 -3.524 -12.568 -4.173 580 HB2 LYS 671 HB2 LYS 671 -5.625 -12.212 -5.557 581 HB3 LYS 671 HB3 LYS 671 -4.723 -11.014 -6.507 582 HG2 LYS 671 HG2 LYS 671 -3.114 -12.805 -7.134 583 HG3 LYS 671 HG3 LYS 671 -4.007 -13.952 -6.102 584 HD2 LYS 671 HD2 LYS 671 -6.017 -13.710 -7.493 585 HD3 LYS 671 HD3 LYS 671 -5.242 -12.443 -8.452 586 HE2 LYS 671 HE2 LYS 671 -5.255 -14.554 -9.667 587 HE3 LYS 671 HE3 LYS 671 -3.604 -14.010 -9.327 588 HZ1 LYS 671 HZ1 LYS 671 -5.062 -16.087 -7.816 589 HZ2 LYS 671 HZ2 LYS 671 -3.529 -15.577 -7.502 590 HZ3 LYS 671 HZ3 LYS 671 -3.862 -16.360 -8.909 591 H SER 672 H SER 672 -3.361 -9.127 -4.976 592 HA SER 672 HA SER 672 -0.688 -9.114 -6.049 593 HB2 SER 672 HB2 SER 672 -2.492 -7.463 -6.527 594 HB3 SER 672 HB3 SER 672 -2.441 -6.921 -4.843 595 HG SER 672 HG SER 672 -1.234 -5.659 -6.396 596 H GLY 673 H GLY 673 -2.103 -8.755 -2.771 597 HA2 GLY 673 HA2 GLY 673 -0.837 -9.414 -0.829 598 HA3 GLY 673 HA3 GLY 673 0.647 -8.834 -1.594 599 H ILE 674 H ILE 674 -2.103 -6.816 -2.059 600 HA ILE 674 HA ILE 674 -1.018 -4.594 -0.513 601 HB ILE 674 HB ILE 674 -3.682 -5.026 -1.935 602 HG12 ILE 674 HG12 ILE 674 -1.165 -3.580 -2.865 603 HG13 ILE 674 HG13 ILE 674 -1.745 -5.123 -3.470 604 HG21 ILE 674 HG21 ILE 674 -2.485 -2.433 -0.883 605 HG22 ILE 674 HG22 ILE 674 -3.991 -2.583 -1.822 606 HG23 ILE 674 HG23 ILE 674 -3.899 -3.277 -0.221 607 HD11 ILE 674 HD11 ILE 674 -3.836 -3.995 -4.295 608 HD12 ILE 674 HD12 ILE 674 -3.082 -2.435 -3.881 609 HD13 ILE 674 HD13 ILE 674 -2.333 -3.487 -5.085 610 H ILE 675 H ILE 675 -3.448 -7.166 -0.108 611 HA ILE 675 HA ILE 675 -3.578 -6.607 2.773 612 HB ILE 675 HB ILE 675 -5.961 -6.743 2.885 613 HG12 ILE 675 HG12 ILE 675 -5.848 -7.394 -0.058 614 HG13 ILE 675 HG13 ILE 675 -6.409 -8.428 1.239 615 HG21 ILE 675 HG21 ILE 675 -5.488 -4.813 0.577 616 HG22 ILE 675 HG22 ILE 675 -6.591 -4.635 1.941 617 HG23 ILE 675 HG23 ILE 675 -4.870 -4.491 2.177 618 HD11 ILE 675 HD11 ILE 675 -8.358 -6.995 1.588 619 HD12 ILE 675 HD12 ILE 675 -7.825 -5.925 0.266 620 HD13 ILE 675 HD13 ILE 675 -8.265 -7.605 -0.074 621 H TYR 676 H TYR 676 -4.815 -8.716 3.731 622 HA TYR 676 HA TYR 676 -4.597 -11.063 1.955 623 HB2 TYR 676 HB2 TYR 676 -3.711 -12.325 4.092 624 HB3 TYR 676 HB3 TYR 676 -2.610 -11.536 2.977 625 HD1 TYR 676 HD1 TYR 676 -4.416 -10.943 6.240 626 HD2 TYR 676 HD2 TYR 676 -0.954 -10.105 3.800 627 HE1 TYR 676 HE1 TYR 676 -3.401 -9.664 8.098 628 HE2 TYR 676 HE2 TYR 676 0.040 -8.797 5.676 629 HH TYR 676 HH TYR 676 -0.688 -7.421 7.503 630 H GLU 677 H GLU 677 -5.782 -12.952 3.011 631 HA GLU 677 HA GLU 677 -8.246 -11.989 4.314 632 HB2 GLU 677 HB2 GLU 677 -7.406 -14.470 2.846 633 HB3 GLU 677 HB3 GLU 677 -8.659 -14.648 4.091 634 HG2 GLU 677 HG2 GLU 677 -10.039 -13.000 3.151 635 HG3 GLU 677 HG3 GLU 677 -8.777 -12.529 1.979 636 H ALA 678 H ALA 678 -6.467 -14.898 4.829 637 HA ALA 678 HA ALA 678 -6.048 -16.161 6.471 638 HB1 ALA 678 HB1 ALA 678 -5.940 -13.723 8.289 639 HB2 ALA 678 HB2 ALA 678 -5.237 -15.317 8.631 640 HB3 ALA 678 HB3 ALA 678 -4.585 -14.317 7.299 641 H LYS 679 H LYS 679 -8.965 -14.382 6.559 642 HA LYS 679 HA LYS 679 -10.122 -16.689 7.965 643 HB2 LYS 679 HB2 LYS 679 -10.742 -13.766 8.549 644 HB3 LYS 679 HB3 LYS 679 -11.809 -15.094 9.017 645 HG2 LYS 679 HG2 LYS 679 -9.745 -16.054 10.279 646 HG3 LYS 679 HG3 LYS 679 -9.025 -14.451 10.019 647 HD2 LYS 679 HD2 LYS 679 -11.310 -13.586 11.047 648 HD3 LYS 679 HD3 LYS 679 -11.448 -15.225 11.681 649 HE2 LYS 679 HE2 LYS 679 -9.097 -13.317 12.098 650 HE3 LYS 679 HE3 LYS 679 -10.388 -13.591 13.269 651 HZ1 LYS 679 HZ1 LYS 679 -8.480 -15.654 12.369 652 HZ2 LYS 679 HZ2 LYS 679 -9.668 -15.826 13.531 653 HZ3 LYS 679 HZ3 LYS 679 -8.424 -14.799 13.786 654 HA PRO 680 HA PRO 680 -12.800 -16.447 4.406 655 HB2 PRO 680 HB2 PRO 680 -15.254 -17.253 5.397 656 HB3 PRO 680 HB3 PRO 680 -13.895 -18.370 5.071 657 HG2 PRO 680 HG2 PRO 680 -14.687 -17.116 7.715 658 HG3 PRO 680 HG3 PRO 680 -14.276 -18.829 7.380 659 HD2 PRO 680 HD2 PRO 680 -12.443 -17.116 8.417 660 HD3 PRO 680 HD3 PRO 680 -11.955 -18.323 7.196 661 H GLU 681 H GLU 681 -13.760 -14.727 3.479 662 HA GLU 681 HA GLU 681 -14.818 -12.757 3.132 663 HB2 GLU 681 HB2 GLU 681 -16.579 -13.822 5.362 664 HB3 GLU 681 HB3 GLU 681 -17.022 -12.491 4.301 665 HG2 GLU 681 HG2 GLU 681 -17.349 -13.833 2.454 666 HG3 GLU 681 HG3 GLU 681 -16.214 -15.075 2.971 667 H CYS 682 H CYS 682 -12.598 -12.799 5.273 668 HA CYS 682 HA CYS 682 -13.094 -10.107 6.346 669 HB2 CYS 682 HB2 CYS 682 -13.943 -11.799 7.949 670 HB3 CYS 682 HB3 CYS 682 -12.358 -12.529 8.019 671 H TYR 683 H TYR 683 -11.342 -8.904 5.987 672 HA TYR 683 HA TYR 683 -8.833 -10.243 5.092 673 HB2 TYR 683 HB2 TYR 683 -10.340 -7.876 3.882 674 HB3 TYR 683 HB3 TYR 683 -8.743 -8.397 3.398 675 HD1 TYR 683 HD1 TYR 683 -12.232 -9.891 3.698 676 HD2 TYR 683 HD2 TYR 683 -8.606 -9.531 1.393 677 HE1 TYR 683 HE1 TYR 683 -13.274 -11.163 1.856 678 HE2 TYR 683 HE2 TYR 683 -9.695 -10.663 -0.499 679 HH TYR 683 HH TYR 683 -11.724 -11.524 -1.322 680 H LYS 684 H LYS 684 -6.887 -8.909 5.377 681 HA LYS 684 HA LYS 684 -7.348 -6.509 7.085 682 HB2 LYS 684 HB2 LYS 684 -6.942 -8.526 8.489 683 HB3 LYS 684 HB3 LYS 684 -5.381 -8.725 7.739 684 HG2 LYS 684 HG2 LYS 684 -5.959 -5.985 8.826 685 HG3 LYS 684 HG3 LYS 684 -5.909 -7.263 10.038 686 HD2 LYS 684 HD2 LYS 684 -3.671 -7.912 9.444 687 HD3 LYS 684 HD3 LYS 684 -3.725 -6.978 7.948 688 HE2 LYS 684 HE2 LYS 684 -3.923 -4.899 9.499 689 HE3 LYS 684 HE3 LYS 684 -3.382 -5.997 10.789 690 HZ1 LYS 684 HZ1 LYS 684 -1.993 -5.366 8.248 691 HZ2 LYS 684 HZ2 LYS 684 -1.462 -6.516 9.261 692 HZ3 LYS 684 HZ3 LYS 684 -1.483 -4.926 9.753 693 H LYS 685 H LYS 685 -6.087 -4.861 6.679 694 HA LYS 685 HA LYS 685 -4.790 -4.606 4.191 695 HB2 LYS 685 HB2 LYS 685 -6.034 -2.861 5.456 696 HB3 LYS 685 HB3 LYS 685 -4.789 -2.835 6.689 697 HG2 LYS 685 HG2 LYS 685 -4.262 -2.206 3.754 698 HG3 LYS 685 HG3 LYS 685 -4.821 -0.995 4.899 699 HD2 LYS 685 HD2 LYS 685 -2.753 -0.598 5.610 700 HD3 LYS 685 HD3 LYS 685 -2.586 -2.264 6.156 701 HE2 LYS 685 HE2 LYS 685 -2.077 -2.856 3.697 702 HE3 LYS 685 HE3 LYS 685 -1.961 -1.149 3.391 703 HZ1 LYS 685 HZ1 LYS 685 -0.316 -2.801 5.260 704 HZ2 LYS 685 HZ2 LYS 685 -0.243 -1.152 5.257 705 HZ3 LYS 685 HZ3 LYS 685 0.217 -2.022 3.925 706 H VAL 686 H VAL 686 -2.596 -4.996 3.613 707 HA VAL 686 HA VAL 686 -1.404 -6.904 5.022 708 HB VAL 686 HB VAL 686 -0.930 -6.380 2.700 709 HG11 VAL 686 HG11 VAL 686 -0.412 -3.964 2.808 710 HG12 VAL 686 HG12 VAL 686 1.109 -4.338 3.664 711 HG13 VAL 686 HG13 VAL 686 0.845 -4.886 1.996 712 HG21 VAL 686 HG21 VAL 686 1.450 -7.066 2.644 713 HG22 VAL 686 HG22 VAL 686 1.527 -6.846 4.407 714 HG23 VAL 686 HG23 VAL 686 0.434 -8.051 3.671 Start of MODEL 2 1 H1 GLY 600 H1 GLY 600 -10.013 6.081 8.689 2 H2 GLY 600 H2 GLY 600 -8.630 6.013 7.807 3 H3 GLY 600 H3 GLY 600 -8.882 4.919 9.018 4 HA2 GLY 600 HA2 GLY 600 -8.409 7.811 9.258 5 HA3 GLY 600 HA3 GLY 600 -8.839 6.760 10.632 6 H SER 601 H SER 601 -6.199 8.302 9.439 7 HA SER 601 HA SER 601 -4.225 6.201 9.483 8 HB2 SER 601 HB2 SER 601 -2.760 8.343 9.546 9 HB3 SER 601 HB3 SER 601 -3.777 8.081 8.120 10 HG SER 601 HG SER 601 -3.897 10.228 9.002 11 H HIS 602 H HIS 602 -2.301 6.679 11.025 12 HA HIS 602 HA HIS 602 -3.070 7.491 13.752 13 HB2 HIS 602 HB2 HIS 602 -1.625 4.972 12.852 14 HB3 HIS 602 HB3 HIS 602 -1.145 5.746 14.345 15 HD1 HIS 602 HD1 HIS 602 -1.960 3.194 15.201 16 HD2 HIS 602 HD2 HIS 602 -4.859 6.104 14.258 17 HE1 HIS 602 HE1 HIS 602 -4.107 2.531 16.417 18 H MET 603 H MET 603 -0.884 7.974 14.933 19 HA MET 603 HA MET 603 0.607 9.894 13.328 20 HB2 MET 603 HB2 MET 603 0.840 9.009 16.236 21 HB3 MET 603 HB3 MET 603 1.795 10.299 15.489 22 HG2 MET 603 HG2 MET 603 -0.238 11.579 14.999 23 HG3 MET 603 HG3 MET 603 -1.240 10.282 15.645 24 HE1 MET 603 HE1 MET 603 1.219 13.209 16.442 25 HE2 MET 603 HE2 MET 603 1.405 13.102 18.207 26 HE3 MET 603 HE3 MET 603 2.148 11.871 17.166 27 H GLY 604 H GLY 604 1.227 7.956 11.816 28 HA2 GLY 604 HA2 GLY 604 4.010 7.645 11.942 29 HA3 GLY 604 HA3 GLY 604 3.282 6.151 12.573 30 H GLU 605 H GLU 605 4.696 5.732 10.340 31 HA GLU 605 HA GLU 605 2.732 5.066 8.328 32 HB2 GLU 605 HB2 GLU 605 4.002 6.075 6.496 33 HB3 GLU 605 HB3 GLU 605 3.425 7.315 7.606 34 HG2 GLU 605 HG2 GLU 605 5.716 7.389 8.660 35 HG3 GLU 605 HG3 GLU 605 6.271 6.216 7.462 36 H SER 606 H SER 606 3.932 3.600 6.626 37 HA SER 606 HA SER 606 6.489 2.594 7.199 38 HB2 SER 606 HB2 SER 606 5.187 1.462 9.063 39 HB3 SER 606 HB3 SER 606 4.202 0.667 7.823 40 HG SER 606 HG SER 606 6.069 -0.522 8.653 41 H GLY 607 H GLY 607 6.646 0.449 5.796 42 HA2 GLY 607 HA2 GLY 607 6.484 -0.570 3.707 43 HA3 GLY 607 HA3 GLY 607 4.975 0.314 3.410 44 H LYS 608 H LYS 608 6.357 0.178 1.221 45 HA LYS 608 HA LYS 608 7.256 2.931 0.847 46 HB2 LYS 608 HB2 LYS 608 9.231 1.021 1.175 47 HB3 LYS 608 HB3 LYS 608 9.082 1.046 -0.568 48 HG2 LYS 608 HG2 LYS 608 9.672 3.364 1.317 49 HG3 LYS 608 HG3 LYS 608 10.796 2.622 0.190 50 HD2 LYS 608 HD2 LYS 608 8.337 4.250 -0.602 51 HD3 LYS 608 HD3 LYS 608 9.955 4.894 -0.496 52 HE2 LYS 608 HE2 LYS 608 9.289 2.550 -2.318 53 HE3 LYS 608 HE3 LYS 608 9.013 4.218 -2.807 54 HZ1 LYS 608 HZ1 LYS 608 11.126 3.442 -3.549 55 HZ2 LYS 608 HZ2 LYS 608 11.624 3.126 -2.004 56 HZ3 LYS 608 HZ3 LYS 608 11.313 4.680 -2.485 57 H ILE 609 H ILE 609 4.844 1.420 0.075 58 HA ILE 609 HA ILE 609 5.008 1.625 -2.891 59 HB ILE 609 HB ILE 609 2.650 1.070 -1.092 60 HG12 ILE 609 HG12 ILE 609 2.514 -1.123 -2.357 61 HG13 ILE 609 HG13 ILE 609 4.083 -0.777 -3.075 62 HG21 ILE 609 HG21 ILE 609 2.826 1.248 -4.131 63 HG22 ILE 609 HG22 ILE 609 1.395 0.706 -3.225 64 HG23 ILE 609 HG23 ILE 609 1.961 2.361 -3.056 65 HD11 ILE 609 HD11 ILE 609 5.186 -1.074 -0.942 66 HD12 ILE 609 HD12 ILE 609 3.626 -1.047 -0.071 67 HD13 ILE 609 HD13 ILE 609 4.046 -2.406 -1.134 68 H ASP 610 H ASP 610 5.437 3.697 -3.230 69 HA ASP 610 HA ASP 610 4.355 5.866 -1.614 70 HB2 ASP 610 HB2 ASP 610 5.259 6.687 -4.296 71 HB3 ASP 610 HB3 ASP 610 5.636 7.282 -2.752 72 H ILE 611 H ILE 611 3.011 7.601 -2.682 73 HA ILE 611 HA ILE 611 0.680 6.414 -4.061 74 HB ILE 611 HB ILE 611 1.228 9.299 -3.197 75 HG12 ILE 611 HG12 ILE 611 -0.735 8.624 -1.542 76 HG13 ILE 611 HG13 ILE 611 -0.169 6.980 -1.805 77 HG21 ILE 611 HG21 ILE 611 -0.394 9.216 -5.030 78 HG22 ILE 611 HG22 ILE 611 -1.329 7.961 -4.180 79 HG23 ILE 611 HG23 ILE 611 -1.213 9.614 -3.525 80 HD11 ILE 611 HD11 ILE 611 1.543 9.301 -0.779 81 HD12 ILE 611 HD12 ILE 611 0.731 8.104 0.247 82 HD13 ILE 611 HD13 ILE 611 2.027 7.589 -0.831 83 H ASP 612 H ASP 612 3.473 8.352 -4.680 84 HA ASP 612 HA ASP 612 2.681 9.645 -7.081 85 HB2 ASP 612 HB2 ASP 612 5.425 9.112 -5.889 86 HB3 ASP 612 HB3 ASP 612 5.081 10.249 -7.208 87 H THR 613 H THR 613 4.626 6.952 -6.281 88 HA THR 613 HA THR 613 5.554 5.701 -8.562 89 HB THR 613 HB THR 613 5.133 5.381 -5.761 90 HG1 THR 613 HG1 THR 613 6.967 4.654 -5.684 91 HG21 THR 613 HG21 THR 613 3.522 3.739 -6.041 92 HG22 THR 613 HG22 THR 613 4.983 3.169 -5.255 93 HG23 THR 613 HG23 THR 613 4.675 2.732 -6.969 94 H ILE 614 H ILE 614 2.208 5.865 -7.370 95 HA ILE 614 HA ILE 614 1.322 3.872 -9.396 96 HB ILE 614 HB ILE 614 -0.133 5.282 -7.123 97 HG12 ILE 614 HG12 ILE 614 0.169 2.286 -7.412 98 HG13 ILE 614 HG13 ILE 614 1.513 3.215 -6.774 99 HG21 ILE 614 HG21 ILE 614 -1.247 3.285 -9.141 100 HG22 ILE 614 HG22 ILE 614 -2.083 3.829 -7.675 101 HG23 ILE 614 HG23 ILE 614 -1.733 4.986 -8.957 102 HD11 ILE 614 HD11 ILE 614 0.124 4.150 -4.994 103 HD12 ILE 614 HD12 ILE 614 -1.271 3.207 -5.576 104 HD13 ILE 614 HD13 ILE 614 0.171 2.380 -4.950 105 H MET 615 H MET 615 0.555 7.245 -8.305 106 HA MET 615 HA MET 615 -1.248 7.598 -10.494 107 HB2 MET 615 HB2 MET 615 -1.611 9.795 -9.569 108 HB3 MET 615 HB3 MET 615 -1.440 8.641 -8.250 109 HG2 MET 615 HG2 MET 615 -0.136 10.348 -7.458 110 HG3 MET 615 HG3 MET 615 1.071 9.365 -8.275 111 HE1 MET 615 HE1 MET 615 2.946 11.292 -8.538 112 HE2 MET 615 HE2 MET 615 2.479 12.976 -8.831 113 HE3 MET 615 HE3 MET 615 1.862 12.126 -7.399 114 H THR 616 H THR 616 2.202 8.021 -10.347 115 HA THR 616 HA THR 616 2.442 9.861 -12.482 116 HB THR 616 HB THR 616 4.238 9.208 -10.870 117 HG1 THR 616 HG1 THR 616 4.852 10.295 -12.682 118 HG21 THR 616 HG21 THR 616 3.946 6.680 -11.039 119 HG22 THR 616 HG22 THR 616 5.609 7.265 -11.190 120 HG23 THR 616 HG23 THR 616 4.716 6.769 -12.637 121 H GLY 617 H GLY 617 1.826 6.374 -12.407 122 HA2 GLY 617 HA2 GLY 617 1.929 6.233 -15.402 123 HA3 GLY 617 HA3 GLY 617 2.617 5.008 -14.338 124 H LYS 618 H LYS 618 -0.202 6.058 -12.846 125 HA LYS 618 HA LYS 618 -2.069 4.386 -14.435 126 HB2 LYS 618 HB2 LYS 618 -1.576 4.378 -11.413 127 HB3 LYS 618 HB3 LYS 618 -3.146 4.000 -12.065 128 HG2 LYS 618 HG2 LYS 618 -2.231 1.890 -11.849 129 HG3 LYS 618 HG3 LYS 618 -1.990 2.250 -13.550 130 HD2 LYS 618 HD2 LYS 618 0.407 3.145 -12.535 131 HD3 LYS 618 HD3 LYS 618 -0.019 2.005 -11.286 132 HE2 LYS 618 HE2 LYS 618 1.425 0.981 -12.967 133 HE3 LYS 618 HE3 LYS 618 -0.155 0.183 -12.952 134 HZ1 LYS 618 HZ1 LYS 618 -0.737 1.281 -14.937 135 HZ2 LYS 618 HZ2 LYS 618 0.803 0.756 -15.198 136 HZ3 LYS 618 HZ3 LYS 618 0.489 2.350 -14.866 137 HA PRO 619 HA PRO 619 -4.482 8.080 -14.261 138 HB2 PRO 619 HB2 PRO 619 -7.084 7.191 -14.039 139 HB3 PRO 619 HB3 PRO 619 -6.121 7.067 -15.544 140 HG2 PRO 619 HG2 PRO 619 -6.577 4.937 -13.437 141 HG3 PRO 619 HG3 PRO 619 -6.696 4.776 -15.219 142 HD2 PRO 619 HD2 PRO 619 -4.476 4.018 -13.843 143 HD3 PRO 619 HD3 PRO 619 -4.326 4.764 -15.453 144 H LYS 620 H LYS 620 -5.268 9.500 -12.674 145 HA LYS 620 HA LYS 620 -4.610 8.922 -9.999 146 HB2 LYS 620 HB2 LYS 620 -6.167 11.142 -11.349 147 HB3 LYS 620 HB3 LYS 620 -6.165 11.035 -9.597 148 HG2 LYS 620 HG2 LYS 620 -4.448 12.561 -10.307 149 HG3 LYS 620 HG3 LYS 620 -3.741 11.170 -9.489 150 HD2 LYS 620 HD2 LYS 620 -2.990 10.233 -11.629 151 HD3 LYS 620 HD3 LYS 620 -3.817 11.535 -12.522 152 HE2 LYS 620 HE2 LYS 620 -2.368 13.218 -11.510 153 HE3 LYS 620 HE3 LYS 620 -1.654 12.012 -10.432 154 HZ1 LYS 620 HZ1 LYS 620 -1.350 12.034 -13.370 155 HZ2 LYS 620 HZ2 LYS 620 -0.724 10.897 -12.347 156 HZ3 LYS 620 HZ3 LYS 620 -0.202 12.444 -12.255 157 H SER 621 H SER 621 -7.705 8.377 -11.652 158 HA SER 621 HA SER 621 -9.433 7.929 -9.599 159 HB2 SER 621 HB2 SER 621 -9.269 6.256 -12.106 160 HB3 SER 621 HB3 SER 621 -10.713 6.813 -11.231 161 HG SER 621 HG SER 621 -10.438 8.159 -12.990 162 H ALA 622 H ALA 622 -6.750 5.867 -10.698 163 HA ALA 622 HA ALA 622 -7.563 3.360 -9.592 164 HB1 ALA 622 HB1 ALA 622 -4.751 4.467 -10.060 165 HB2 ALA 622 HB2 ALA 622 -5.190 2.774 -9.782 166 HB3 ALA 622 HB3 ALA 622 -5.736 3.599 -11.257 167 H ARG 623 H ARG 623 -5.206 5.791 -8.342 168 HA ARG 623 HA ARG 623 -5.210 4.835 -5.671 169 HB2 ARG 623 HB2 ARG 623 -3.733 6.486 -5.288 170 HB3 ARG 623 HB3 ARG 623 -3.807 6.790 -7.021 171 HG2 ARG 623 HG2 ARG 623 -5.794 8.303 -6.423 172 HG3 ARG 623 HG3 ARG 623 -5.226 8.233 -4.766 173 HD2 ARG 623 HD2 ARG 623 -3.081 9.287 -5.683 174 HD3 ARG 623 HD3 ARG 623 -3.919 9.447 -7.241 175 HE ARG 623 HE ARG 623 -4.186 11.137 -4.969 176 HH11 ARG 623 HH11 ARG 623 -6.452 9.767 -7.496 177 HH12 ARG 623 HH12 ARG 623 -7.756 10.696 -6.748 178 HH21 ARG 623 HH21 ARG 623 -6.183 12.257 -4.232 179 HH22 ARG 623 HH22 ARG 623 -7.649 11.830 -5.117 180 H GLU 624 H GLU 624 -7.371 7.186 -7.288 181 HA GLU 624 HA GLU 624 -8.716 8.088 -5.036 182 HB2 GLU 624 HB2 GLU 624 -8.842 8.892 -7.513 183 HB3 GLU 624 HB3 GLU 624 -10.129 7.694 -7.676 184 HG2 GLU 624 HG2 GLU 624 -11.004 9.940 -7.367 185 HG3 GLU 624 HG3 GLU 624 -11.513 8.850 -6.088 186 H LYS 625 H LYS 625 -9.195 5.033 -6.691 187 HA LYS 625 HA LYS 625 -11.262 4.423 -4.554 188 HB2 LYS 625 HB2 LYS 625 -11.861 2.404 -5.665 189 HB3 LYS 625 HB3 LYS 625 -12.025 3.814 -6.716 190 HG2 LYS 625 HG2 LYS 625 -9.767 3.146 -7.728 191 HG3 LYS 625 HG3 LYS 625 -9.890 1.637 -6.829 192 HD2 LYS 625 HD2 LYS 625 -11.396 0.763 -8.266 193 HD3 LYS 625 HD3 LYS 625 -12.396 2.204 -8.290 194 HE2 LYS 625 HE2 LYS 625 -9.807 1.873 -9.862 195 HE3 LYS 625 HE3 LYS 625 -11.436 1.633 -10.518 196 HZ1 LYS 625 HZ1 LYS 625 -11.918 3.939 -9.952 197 HZ2 LYS 625 HZ2 LYS 625 -10.663 3.827 -11.009 198 HZ3 LYS 625 HZ3 LYS 625 -10.373 4.175 -9.417 199 H MET 626 H MET 626 -8.089 3.155 -5.708 200 HA MET 626 HA MET 626 -8.007 0.916 -3.998 201 HB2 MET 626 HB2 MET 626 -5.809 2.639 -5.228 202 HB3 MET 626 HB3 MET 626 -5.489 1.139 -4.371 203 HG2 MET 626 HG2 MET 626 -6.794 -0.133 -5.980 204 HG3 MET 626 HG3 MET 626 -7.300 1.338 -6.801 205 HE1 MET 626 HE1 MET 626 -4.505 -1.297 -6.238 206 HE2 MET 626 HE2 MET 626 -3.077 -0.553 -6.987 207 HE3 MET 626 HE3 MET 626 -3.719 0.104 -5.469 208 H MET 627 H MET 627 -6.923 4.275 -3.535 209 HA MET 627 HA MET 627 -5.451 3.736 -1.181 210 HB2 MET 627 HB2 MET 627 -4.719 5.863 -1.410 211 HB3 MET 627 HB3 MET 627 -5.291 5.595 -3.026 212 HG2 MET 627 HG2 MET 627 -6.148 7.663 -2.673 213 HG3 MET 627 HG3 MET 627 -7.521 6.714 -2.139 214 HE1 MET 627 HE1 MET 627 -4.620 9.113 -1.291 215 HE2 MET 627 HE2 MET 627 -4.595 9.178 0.485 216 HE3 MET 627 HE3 MET 627 -4.021 7.726 -0.353 217 H LYS 628 H LYS 628 -8.765 4.660 -1.809 218 HA LYS 628 HA LYS 628 -9.513 5.258 0.953 219 HB2 LYS 628 HB2 LYS 628 -11.197 4.427 -1.465 220 HB3 LYS 628 HB3 LYS 628 -11.848 4.889 0.112 221 HG2 LYS 628 HG2 LYS 628 -10.864 7.129 -0.089 222 HG3 LYS 628 HG3 LYS 628 -10.137 6.695 -1.653 223 HD2 LYS 628 HD2 LYS 628 -12.399 6.262 -2.585 224 HD3 LYS 628 HD3 LYS 628 -13.119 6.721 -1.033 225 HE2 LYS 628 HE2 LYS 628 -12.941 8.923 -1.481 226 HE3 LYS 628 HE3 LYS 628 -11.210 8.725 -1.837 227 HZ1 LYS 628 HZ1 LYS 628 -13.418 8.622 -3.741 228 HZ2 LYS 628 HZ2 LYS 628 -11.953 7.874 -4.033 229 HZ3 LYS 628 HZ3 LYS 628 -11.969 9.476 -3.784 230 H ILE 629 H ILE 629 -9.836 2.446 -1.251 231 HA ILE 629 HA ILE 629 -11.059 0.671 0.526 232 HB ILE 629 HB ILE 629 -9.169 0.185 -1.794 233 HG12 ILE 629 HG12 ILE 629 -12.155 -0.397 -1.590 234 HG13 ILE 629 HG13 ILE 629 -11.578 1.203 -2.031 235 HG21 ILE 629 HG21 ILE 629 -10.738 -1.900 -0.209 236 HG22 ILE 629 HG22 ILE 629 -9.928 -2.196 -1.761 237 HG23 ILE 629 HG23 ILE 629 -8.969 -1.791 -0.348 238 HD11 ILE 629 HD11 ILE 629 -11.013 -1.347 -3.557 239 HD12 ILE 629 HD12 ILE 629 -12.081 -0.023 -4.040 240 HD13 ILE 629 HD13 ILE 629 -10.329 0.244 -3.955 241 H ILE 630 H ILE 630 -7.432 0.857 -0.039 242 HA ILE 630 HA ILE 630 -6.915 -0.845 2.167 243 HB ILE 630 HB ILE 630 -4.633 0.199 2.307 244 HG12 ILE 630 HG12 ILE 630 -4.225 1.401 -0.134 245 HG13 ILE 630 HG13 ILE 630 -5.779 2.079 0.307 246 HG21 ILE 630 HG21 ILE 630 -3.861 -0.929 0.324 247 HG22 ILE 630 HG22 ILE 630 -5.138 -1.852 1.122 248 HG23 ILE 630 HG23 ILE 630 -5.512 -0.919 -0.347 249 HD11 ILE 630 HD11 ILE 630 -4.826 2.873 2.465 250 HD12 ILE 630 HD12 ILE 630 -3.251 2.193 1.991 251 HD13 ILE 630 HD13 ILE 630 -3.969 3.521 1.057 252 H GLU 631 H GLU 631 -7.749 2.610 2.302 253 HA GLU 631 HA GLU 631 -6.623 2.916 4.957 254 HB2 GLU 631 HB2 GLU 631 -7.706 4.744 3.133 255 HB3 GLU 631 HB3 GLU 631 -8.967 4.632 4.346 256 HG2 GLU 631 HG2 GLU 631 -7.010 4.839 6.090 257 HG3 GLU 631 HG3 GLU 631 -6.063 5.440 4.729 258 H ILE 632 H ILE 632 -9.792 2.023 3.619 259 HA ILE 632 HA ILE 632 -11.136 1.772 6.166 260 HB ILE 632 HB ILE 632 -11.729 0.538 3.446 261 HG12 ILE 632 HG12 ILE 632 -13.311 2.783 4.736 262 HG13 ILE 632 HG13 ILE 632 -11.821 3.178 3.899 263 HG21 ILE 632 HG21 ILE 632 -12.817 -0.825 5.122 264 HG22 ILE 632 HG22 ILE 632 -13.384 0.601 6.010 265 HG23 ILE 632 HG23 ILE 632 -14.058 0.207 4.416 266 HD11 ILE 632 HD11 ILE 632 -13.688 3.432 2.383 267 HD12 ILE 632 HD12 ILE 632 -12.624 2.128 1.829 268 HD13 ILE 632 HD13 ILE 632 -14.168 1.737 2.621 269 H ILE 633 H ILE 633 -9.283 -0.544 4.070 270 HA ILE 633 HA ILE 633 -9.885 -2.785 5.765 271 HB ILE 633 HB ILE 633 -7.469 -2.502 3.941 272 HG12 ILE 633 HG12 ILE 633 -10.367 -3.066 3.322 273 HG13 ILE 633 HG13 ILE 633 -9.181 -2.107 2.462 274 HG21 ILE 633 HG21 ILE 633 -8.959 -5.015 4.779 275 HG22 ILE 633 HG22 ILE 633 -7.438 -4.917 3.912 276 HG23 ILE 633 HG23 ILE 633 -7.516 -4.433 5.618 277 HD11 ILE 633 HD11 ILE 633 -9.800 -3.998 1.126 278 HD12 ILE 633 HD12 ILE 633 -8.090 -4.036 1.550 279 HD13 ILE 633 HD13 ILE 633 -9.239 -5.121 2.372 280 H ASP 634 H ASP 634 -7.164 -0.421 5.689 281 HA ASP 634 HA ASP 634 -5.622 -1.620 7.716 282 HB2 ASP 634 HB2 ASP 634 -4.899 0.113 6.005 283 HB3 ASP 634 HB3 ASP 634 -5.739 1.336 6.950 284 H SER 635 H SER 635 -8.097 0.999 7.800 285 HA SER 635 HA SER 635 -7.730 1.188 10.677 286 HB2 SER 635 HB2 SER 635 -9.283 3.074 10.605 287 HB3 SER 635 HB3 SER 635 -7.866 3.212 9.561 288 HG SER 635 HG SER 635 -9.187 2.666 7.758 289 H LEU 636 H LEU 636 -9.722 -0.789 8.755 290 HA LEU 636 HA LEU 636 -11.504 -1.414 11.009 291 HB2 LEU 636 HB2 LEU 636 -10.872 -2.765 8.378 292 HB3 LEU 636 HB3 LEU 636 -11.814 -3.578 9.626 293 HG LEU 636 HG LEU 636 -12.622 -0.859 8.503 294 HD11 LEU 636 HD11 LEU 636 -13.616 -3.595 7.617 295 HD12 LEU 636 HD12 LEU 636 -12.531 -2.526 6.689 296 HD13 LEU 636 HD13 LEU 636 -14.177 -2.007 7.046 297 HD21 LEU 636 HD21 LEU 636 -13.659 -1.380 10.663 298 HD22 LEU 636 HD22 LEU 636 -14.165 -2.975 10.064 299 HD23 LEU 636 HD23 LEU 636 -14.856 -1.495 9.373 300 H ALA 637 H ALA 637 -8.586 -2.900 9.416 301 HA ALA 637 HA ALA 637 -8.279 -4.960 11.346 302 HB1 ALA 637 HB1 ALA 637 -6.113 -5.329 10.264 303 HB2 ALA 637 HB2 ALA 637 -7.386 -5.061 9.055 304 HB3 ALA 637 HB3 ALA 637 -6.234 -3.757 9.439 305 H VAL 638 H VAL 638 -7.199 -1.594 11.535 306 HA VAL 638 HA VAL 638 -5.329 -1.997 13.640 307 HB VAL 638 HB VAL 638 -5.864 0.104 12.218 308 HG11 VAL 638 HG11 VAL 638 -7.309 1.772 13.121 309 HG12 VAL 638 HG12 VAL 638 -8.262 0.276 13.044 310 HG13 VAL 638 HG13 VAL 638 -7.618 0.833 14.594 311 HG21 VAL 638 HG21 VAL 638 -4.069 0.006 13.878 312 HG22 VAL 638 HG22 VAL 638 -4.860 1.590 13.841 313 HG23 VAL 638 HG23 VAL 638 -5.217 0.451 15.162 314 H SER 639 H SER 639 -8.740 -2.517 13.656 315 HA SER 639 HA SER 639 -8.790 -2.718 16.615 316 HB2 SER 639 HB2 SER 639 -9.761 -0.544 15.529 317 HB3 SER 639 HB3 SER 639 -11.099 -1.589 15.017 318 HG SER 639 HG SER 639 -11.506 -0.630 17.033 319 H SER 640 H SER 640 -8.580 -4.732 14.228 320 HA SER 640 HA SER 640 -10.300 -6.701 15.407 321 HB2 SER 640 HB2 SER 640 -10.945 -5.628 12.619 322 HB3 SER 640 HB3 SER 640 -11.455 -7.235 13.175 323 HG SER 640 HG SER 640 -11.957 -5.063 14.867 324 H GLU 641 H GLU 641 -9.839 -8.879 14.327 325 HA GLU 641 HA GLU 641 -7.075 -9.236 13.815 326 HB2 GLU 641 HB2 GLU 641 -9.443 -10.968 12.990 327 HB3 GLU 641 HB3 GLU 641 -7.762 -11.501 13.056 328 HG2 GLU 641 HG2 GLU 641 -7.718 -11.213 15.495 329 HG3 GLU 641 HG3 GLU 641 -9.378 -10.585 15.479 330 H CYS 642 H CYS 642 -9.744 -8.445 11.662 331 HA CYS 642 HA CYS 642 -8.102 -7.921 9.387 332 HB2 CYS 642 HB2 CYS 642 -9.294 -9.645 7.951 333 HB3 CYS 642 HB3 CYS 642 -8.141 -10.280 9.121 334 H ALA 643 H ALA 643 -9.665 -7.324 7.541 335 HA ALA 643 HA ALA 643 -11.879 -5.688 8.612 336 HB1 ALA 643 HB1 ALA 643 -10.549 -5.817 5.894 337 HB2 ALA 643 HB2 ALA 643 -11.771 -4.645 6.380 338 HB3 ALA 643 HB3 ALA 643 -10.168 -4.629 7.162 339 H LYS 644 H LYS 644 -13.800 -6.656 8.635 340 HA LYS 644 HA LYS 644 -14.587 -8.966 7.157 341 HB2 LYS 644 HB2 LYS 644 -16.924 -8.188 7.765 342 HB3 LYS 644 HB3 LYS 644 -15.785 -8.502 9.097 343 HG2 LYS 644 HG2 LYS 644 -15.541 -5.806 8.858 344 HG3 LYS 644 HG3 LYS 644 -17.207 -6.072 8.286 345 HD2 LYS 644 HD2 LYS 644 -17.748 -7.280 10.362 346 HD3 LYS 644 HD3 LYS 644 -16.060 -7.123 10.889 347 HE2 LYS 644 HE2 LYS 644 -16.764 -5.272 11.962 348 HE3 LYS 644 HE3 LYS 644 -16.558 -4.537 10.356 349 HZ1 LYS 644 HZ1 LYS 644 -18.582 -3.874 11.146 350 HZ2 LYS 644 HZ2 LYS 644 -19.129 -5.423 11.512 351 HZ3 LYS 644 HZ3 LYS 644 -18.871 -4.852 9.944 352 H VAL 645 H VAL 645 -15.107 -9.176 5.085 353 HA VAL 645 HA VAL 645 -14.865 -7.009 3.298 354 HB VAL 645 HB VAL 645 -14.569 -9.514 2.884 355 HG11 VAL 645 HG11 VAL 645 -16.383 -10.785 1.973 356 HG12 VAL 645 HG12 VAL 645 -16.896 -10.202 3.569 357 HG13 VAL 645 HG13 VAL 645 -17.506 -9.418 2.094 358 HG21 VAL 645 HG21 VAL 645 -15.034 -9.262 0.491 359 HG22 VAL 645 HG22 VAL 645 -16.009 -7.816 0.818 360 HG23 VAL 645 HG23 VAL 645 -14.272 -7.823 1.202 361 H LYS 646 H LYS 646 -17.596 -8.049 5.107 362 HA LYS 646 HA LYS 646 -19.822 -7.004 3.743 363 HB2 LYS 646 HB2 LYS 646 -19.500 -8.377 6.023 364 HB3 LYS 646 HB3 LYS 646 -19.420 -6.790 6.770 365 HG2 LYS 646 HG2 LYS 646 -21.659 -6.228 5.902 366 HG3 LYS 646 HG3 LYS 646 -21.707 -7.748 4.984 367 HD2 LYS 646 HD2 LYS 646 -21.500 -9.018 7.138 368 HD3 LYS 646 HD3 LYS 646 -21.614 -7.478 8.020 369 HE2 LYS 646 HE2 LYS 646 -23.846 -7.074 7.058 370 HE3 LYS 646 HE3 LYS 646 -23.708 -8.536 6.067 371 HZ1 LYS 646 HZ1 LYS 646 -23.778 -8.483 9.018 372 HZ2 LYS 646 HZ2 LYS 646 -23.640 -9.836 8.090 373 HZ3 LYS 646 HZ3 LYS 646 -25.015 -8.939 8.034 374 H ASP 647 H ASP 647 -17.456 -5.511 5.998 375 HA ASP 647 HA ASP 647 -18.802 -2.995 6.030 376 HB2 ASP 647 HB2 ASP 647 -16.401 -4.318 7.275 377 HB3 ASP 647 HB3 ASP 647 -16.400 -2.587 7.242 378 H ILE 648 H ILE 648 -15.969 -4.384 4.412 379 HA ILE 648 HA ILE 648 -15.058 -1.932 3.242 380 HB ILE 648 HB ILE 648 -14.728 -4.678 1.966 381 HG12 ILE 648 HG12 ILE 648 -12.949 -3.511 4.162 382 HG13 ILE 648 HG13 ILE 648 -14.090 -4.809 4.395 383 HG21 ILE 648 HG21 ILE 648 -12.939 -2.195 1.980 384 HG22 ILE 648 HG22 ILE 648 -12.642 -3.688 1.068 385 HG23 ILE 648 HG23 ILE 648 -14.012 -2.669 0.649 386 HD11 ILE 648 HD11 ILE 648 -12.910 -6.184 2.651 387 HD12 ILE 648 HD12 ILE 648 -11.630 -4.962 2.652 388 HD13 ILE 648 HD13 ILE 648 -11.993 -5.867 4.126 389 H LEU 649 H LEU 649 -17.192 -4.531 1.975 390 HA LEU 649 HA LEU 649 -17.926 -3.302 -0.462 391 HB2 LEU 649 HB2 LEU 649 -19.210 -5.294 1.424 392 HB3 LEU 649 HB3 LEU 649 -20.154 -4.677 0.090 393 HG LEU 649 HG LEU 649 -17.395 -5.850 -0.411 394 HD11 LEU 649 HD11 LEU 649 -20.040 -7.369 -0.375 395 HD12 LEU 649 HD12 LEU 649 -18.695 -7.581 0.764 396 HD13 LEU 649 HD13 LEU 649 -18.479 -7.997 -0.942 397 HD21 LEU 649 HD21 LEU 649 -19.905 -5.626 -2.139 398 HD22 LEU 649 HD22 LEU 649 -18.323 -6.220 -2.668 399 HD23 LEU 649 HD23 LEU 649 -18.538 -4.510 -2.224 400 H LYS 650 H LYS 650 -19.304 -2.891 2.836 401 HA LYS 650 HA LYS 650 -21.474 -1.220 1.971 402 HB2 LYS 650 HB2 LYS 650 -21.460 -2.279 4.181 403 HB3 LYS 650 HB3 LYS 650 -20.040 -1.340 4.662 404 HG2 LYS 650 HG2 LYS 650 -21.328 0.769 4.384 405 HG3 LYS 650 HG3 LYS 650 -22.752 -0.148 3.911 406 HD2 LYS 650 HD2 LYS 650 -21.304 -0.480 6.582 407 HD3 LYS 650 HD3 LYS 650 -22.620 0.660 6.346 408 HE2 LYS 650 HE2 LYS 650 -22.828 -2.354 5.913 409 HE3 LYS 650 HE3 LYS 650 -23.335 -1.501 7.379 410 HZ1 LYS 650 HZ1 LYS 650 -24.445 -1.036 4.687 411 HZ2 LYS 650 HZ2 LYS 650 -24.911 -0.262 6.057 412 HZ3 LYS 650 HZ3 LYS 650 -25.191 -1.877 5.892 413 H GLU 651 H GLU 651 -18.342 -0.237 3.546 414 HA GLU 651 HA GLU 651 -19.036 2.503 3.178 415 HB2 GLU 651 HB2 GLU 651 -16.316 1.267 3.770 416 HB3 GLU 651 HB3 GLU 651 -16.728 2.974 3.932 417 HG2 GLU 651 HG2 GLU 651 -17.737 0.640 5.584 418 HG3 GLU 651 HG3 GLU 651 -16.840 2.049 6.126 419 H ALA 652 H ALA 652 -17.123 0.295 1.124 420 HA ALA 652 HA ALA 652 -16.211 2.429 -0.611 421 HB1 ALA 652 HB1 ALA 652 -16.519 -0.528 -1.207 422 HB2 ALA 652 HB2 ALA 652 -15.477 0.664 -2.045 423 HB3 ALA 652 HB3 ALA 652 -15.124 0.193 -0.378 424 H GLN 653 H GLN 653 -19.159 0.222 -0.719 425 HA GLN 653 HA GLN 653 -19.982 1.426 -3.222 426 HB2 GLN 653 HB2 GLN 653 -21.512 -0.162 -1.147 427 HB3 GLN 653 HB3 GLN 653 -22.221 0.436 -2.654 428 HG2 GLN 653 HG2 GLN 653 -20.627 -0.785 -4.013 429 HG3 GLN 653 HG3 GLN 653 -19.719 -1.320 -2.609 430 HE21 GLN 653 HE21 GLN 653 -21.075 -2.500 -0.945 431 HE22 GLN 653 HE22 GLN 653 -22.228 -3.714 -1.569 432 H GLN 654 H GLN 654 -20.526 2.279 0.220 433 HA GLN 654 HA GLN 654 -22.256 4.499 -0.336 434 HB2 GLN 654 HB2 GLN 654 -20.256 4.031 1.914 435 HB3 GLN 654 HB3 GLN 654 -21.311 5.428 1.839 436 HG2 GLN 654 HG2 GLN 654 -22.206 2.524 2.041 437 HG3 GLN 654 HG3 GLN 654 -22.225 3.718 3.330 438 HE21 GLN 654 HE21 GLN 654 -23.354 5.986 1.914 439 HE22 GLN 654 HE22 GLN 654 -24.989 5.509 1.472 440 H VAL 655 H VAL 655 -18.623 4.327 -0.247 441 HA VAL 655 HA VAL 655 -18.417 7.086 -0.969 442 HB VAL 655 HB VAL 655 -16.662 5.293 0.049 443 HG11 VAL 655 HG11 VAL 655 -16.159 4.227 -2.177 444 HG12 VAL 655 HG12 VAL 655 -15.536 5.784 -2.737 445 HG13 VAL 655 HG13 VAL 655 -14.764 4.939 -1.375 446 HG21 VAL 655 HG21 VAL 655 -16.648 7.752 0.224 447 HG22 VAL 655 HG22 VAL 655 -15.049 7.060 -0.005 448 HG23 VAL 655 HG23 VAL 655 -15.881 7.849 -1.376 449 H GLY 656 H GLY 656 -19.111 4.316 -2.909 450 HA2 GLY 656 HA2 GLY 656 -20.654 5.239 -4.640 451 HA3 GLY 656 HA3 GLY 656 -19.318 6.217 -5.240 452 H ILE 657 H ILE 657 -18.387 3.027 -4.271 453 HA ILE 657 HA ILE 657 -17.965 2.283 -7.104 454 HB ILE 657 HB ILE 657 -16.895 1.268 -4.448 455 HG12 ILE 657 HG12 ILE 657 -15.246 2.586 -6.633 456 HG13 ILE 657 HG13 ILE 657 -16.154 3.595 -5.531 457 HG21 ILE 657 HG21 ILE 657 -16.218 0.357 -7.285 458 HG22 ILE 657 HG22 ILE 657 -15.170 0.048 -5.891 459 HG23 ILE 657 HG23 ILE 657 -16.778 -0.647 -5.925 460 HD11 ILE 657 HD11 ILE 657 -13.933 3.414 -4.698 461 HD12 ILE 657 HD12 ILE 657 -15.026 2.583 -3.584 462 HD13 ILE 657 HD13 ILE 657 -14.001 1.639 -4.691 463 H GLU 658 H GLU 658 -18.251 -0.504 -7.182 464 HA GLU 658 HA GLU 658 -21.030 -1.026 -6.268 465 HB2 GLU 658 HB2 GLU 658 -20.743 -0.211 -8.679 466 HB3 GLU 658 HB3 GLU 658 -19.906 -1.709 -9.021 467 HG2 GLU 658 HG2 GLU 658 -22.742 -1.561 -7.843 468 HG3 GLU 658 HG3 GLU 658 -22.435 -1.516 -9.577 469 H LYS 659 H LYS 659 -21.176 -3.098 -5.429 470 HA LYS 659 HA LYS 659 -19.254 -4.615 -4.503 471 HB2 LYS 659 HB2 LYS 659 -20.709 -6.671 -4.745 472 HB3 LYS 659 HB3 LYS 659 -21.383 -5.285 -3.925 473 HG2 LYS 659 HG2 LYS 659 -23.097 -5.099 -5.317 474 HG3 LYS 659 HG3 LYS 659 -22.071 -5.143 -6.735 475 HD2 LYS 659 HD2 LYS 659 -22.913 -7.677 -5.299 476 HD3 LYS 659 HD3 LYS 659 -23.852 -6.915 -6.591 477 HE2 LYS 659 HE2 LYS 659 -22.596 -7.859 -8.165 478 HE3 LYS 659 HE3 LYS 659 -21.220 -6.957 -7.574 479 HZ1 LYS 659 HZ1 LYS 659 -20.864 -8.819 -5.926 480 HZ2 LYS 659 HZ2 LYS 659 -20.493 -9.162 -7.387 481 HZ3 LYS 659 HZ3 LYS 659 -21.959 -9.715 -6.793 482 H SER 660 H SER 660 -20.141 -5.111 -7.977 483 HA SER 660 HA SER 660 -18.475 -7.396 -8.431 484 HB2 SER 660 HB2 SER 660 -18.512 -6.639 -10.798 485 HB3 SER 660 HB3 SER 660 -20.130 -6.641 -10.074 486 HG SER 660 HG SER 660 -20.086 -4.422 -9.795 487 H ASN 661 H ASN 661 -17.825 -3.942 -8.346 488 HA ASN 661 HA ASN 661 -15.126 -4.113 -9.426 489 HB2 ASN 661 HB2 ASN 661 -16.688 -1.850 -8.156 490 HB3 ASN 661 HB3 ASN 661 -15.005 -1.820 -8.575 491 HD21 ASN 661 HD21 ASN 661 -17.873 -3.242 -10.476 492 HD22 ASN 661 HD22 ASN 661 -17.527 -2.191 -11.828 493 H ILE 662 H ILE 662 -16.624 -4.530 -6.225 494 HA ILE 662 HA ILE 662 -14.186 -3.663 -4.796 495 HB ILE 662 HB ILE 662 -16.839 -4.875 -3.898 496 HG12 ILE 662 HG12 ILE 662 -17.138 -2.594 -4.771 497 HG13 ILE 662 HG13 ILE 662 -17.422 -2.649 -3.046 498 HG21 ILE 662 HG21 ILE 662 -15.311 -5.514 -2.242 499 HG22 ILE 662 HG22 ILE 662 -14.446 -3.965 -2.274 500 HG23 ILE 662 HG23 ILE 662 -16.080 -4.072 -1.584 501 HD11 ILE 662 HD11 ILE 662 -14.913 -1.646 -4.422 502 HD12 ILE 662 HD12 ILE 662 -16.184 -0.705 -3.622 503 HD13 ILE 662 HD13 ILE 662 -15.130 -1.760 -2.660 504 H GLU 663 H GLU 663 -15.914 -6.370 -6.029 505 HA GLU 663 HA GLU 663 -14.476 -8.468 -4.570 506 HB2 GLU 663 HB2 GLU 663 -16.239 -8.497 -7.058 507 HB3 GLU 663 HB3 GLU 663 -15.690 -9.950 -6.211 508 HG2 GLU 663 HG2 GLU 663 -16.941 -9.431 -4.261 509 HG3 GLU 663 HG3 GLU 663 -17.171 -7.795 -4.648 510 H LYS 664 H LYS 664 -14.463 -7.158 -7.860 511 HA LYS 664 HA LYS 664 -11.997 -8.096 -8.848 512 HB2 LYS 664 HB2 LYS 664 -13.380 -6.991 -10.352 513 HB3 LYS 664 HB3 LYS 664 -13.686 -5.635 -9.263 514 HG2 LYS 664 HG2 LYS 664 -11.674 -4.599 -9.663 515 HG3 LYS 664 HG3 LYS 664 -10.907 -6.109 -10.211 516 HD2 LYS 664 HD2 LYS 664 -12.264 -6.016 -12.297 517 HD3 LYS 664 HD3 LYS 664 -12.964 -4.483 -11.749 518 HE2 LYS 664 HE2 LYS 664 -11.095 -4.144 -13.348 519 HE3 LYS 664 HE3 LYS 664 -10.783 -3.407 -11.767 520 HZ1 LYS 664 HZ1 LYS 664 -9.689 -6.061 -12.489 521 HZ2 LYS 664 HZ2 LYS 664 -9.302 -5.134 -11.201 522 HZ3 LYS 664 HZ3 LYS 664 -8.858 -4.645 -12.686 523 H LEU 665 H LEU 665 -12.452 -4.906 -7.047 524 HA LEU 665 HA LEU 665 -9.685 -4.475 -7.064 525 HB2 LEU 665 HB2 LEU 665 -11.993 -3.226 -5.660 526 HB3 LEU 665 HB3 LEU 665 -10.489 -3.101 -4.800 527 HG LEU 665 HG LEU 665 -10.992 -1.167 -6.289 528 HD11 LEU 665 HD11 LEU 665 -8.705 -0.896 -7.093 529 HD12 LEU 665 HD12 LEU 665 -8.395 -2.632 -6.908 530 HD13 LEU 665 HD13 LEU 665 -8.722 -1.630 -5.479 531 HD21 LEU 665 HD21 LEU 665 -11.904 -2.321 -8.267 532 HD22 LEU 665 HD22 LEU 665 -10.308 -3.033 -8.598 533 HD23 LEU 665 HD23 LEU 665 -10.529 -1.290 -8.692 534 H LEU 666 H LEU 666 -11.615 -5.981 -4.421 535 HA LEU 666 HA LEU 666 -9.483 -6.429 -2.604 536 HB2 LEU 666 HB2 LEU 666 -11.925 -8.104 -3.296 537 HB3 LEU 666 HB3 LEU 666 -10.859 -8.484 -1.954 538 HG LEU 666 HG LEU 666 -12.209 -5.759 -2.118 539 HD11 LEU 666 HD11 LEU 666 -14.002 -6.702 -0.729 540 HD12 LEU 666 HD12 LEU 666 -13.273 -8.330 -0.885 541 HD13 LEU 666 HD13 LEU 666 -13.950 -7.511 -2.299 542 HD21 LEU 666 HD21 LEU 666 -11.160 -7.412 0.208 543 HD22 LEU 666 HD22 LEU 666 -11.963 -5.838 0.326 544 HD23 LEU 666 HD23 LEU 666 -10.392 -5.965 -0.480 545 H THR 667 H THR 667 -10.532 -8.250 -5.555 546 HA THR 667 HA THR 667 -8.668 -10.370 -5.090 547 HB THR 667 HB THR 667 -10.187 -9.461 -7.566 548 HG1 THR 667 HG1 THR 667 -11.484 -10.359 -6.177 549 HG21 THR 667 HG21 THR 667 -9.398 -11.666 -8.527 550 HG22 THR 667 HG22 THR 667 -8.152 -11.691 -7.239 551 HG23 THR 667 HG23 THR 667 -8.181 -10.392 -8.433 552 H ASP 668 H ASP 668 -8.602 -7.468 -7.163 553 HA ASP 668 HA ASP 668 -6.159 -7.828 -8.486 554 HB2 ASP 668 HB2 ASP 668 -7.729 -5.469 -7.447 555 HB3 ASP 668 HB3 ASP 668 -6.241 -5.256 -8.372 556 H MET 669 H MET 669 -6.942 -6.194 -5.416 557 HA MET 669 HA MET 669 -4.327 -5.523 -4.570 558 HB2 MET 669 HB2 MET 669 -6.885 -6.063 -2.993 559 HB3 MET 669 HB3 MET 669 -5.393 -5.412 -2.319 560 HG2 MET 669 HG2 MET 669 -5.913 -3.771 -4.531 561 HG3 MET 669 HG3 MET 669 -7.487 -4.028 -3.790 562 HE1 MET 669 HE1 MET 669 -6.061 -0.480 -2.622 563 HE2 MET 669 HE2 MET 669 -5.594 -1.343 -4.102 564 HE3 MET 669 HE3 MET 669 -7.310 -1.261 -3.622 565 H ARG 670 H ARG 670 -6.354 -8.412 -3.571 566 HA ARG 670 HA ARG 670 -4.168 -9.367 -1.980 567 HB2 ARG 670 HB2 ARG 670 -5.468 -11.226 -1.405 568 HB3 ARG 670 HB3 ARG 670 -6.532 -9.850 -1.399 569 HG2 ARG 670 HG2 ARG 670 -7.965 -10.911 -2.679 570 HG3 ARG 670 HG3 ARG 670 -6.808 -10.979 -3.990 571 HD2 ARG 670 HD2 ARG 670 -6.261 -13.158 -3.607 572 HD3 ARG 670 HD3 ARG 670 -6.401 -13.033 -1.868 573 HE ARG 670 HE ARG 670 -8.315 -14.059 -1.984 574 HH11 ARG 670 HH11 ARG 670 -8.157 -12.489 -5.115 575 HH12 ARG 670 HH12 ARG 670 -9.871 -12.485 -5.419 576 HH21 ARG 670 HH21 ARG 670 -10.472 -14.184 -2.297 577 HH22 ARG 670 HH22 ARG 670 -11.217 -13.831 -3.847 578 H LYS 671 H LYS 671 -4.992 -9.839 -5.319 579 HA LYS 671 HA LYS 671 -3.186 -12.049 -5.692 580 HB2 LYS 671 HB2 LYS 671 -5.213 -11.431 -7.151 581 HB3 LYS 671 HB3 LYS 671 -4.266 -10.075 -7.764 582 HG2 LYS 671 HG2 LYS 671 -4.084 -11.808 -9.366 583 HG3 LYS 671 HG3 LYS 671 -2.529 -11.801 -8.523 584 HD2 LYS 671 HD2 LYS 671 -3.375 -13.728 -7.091 585 HD3 LYS 671 HD3 LYS 671 -4.889 -13.679 -8.004 586 HE2 LYS 671 HE2 LYS 671 -3.581 -15.425 -8.939 587 HE3 LYS 671 HE3 LYS 671 -3.593 -14.091 -10.104 588 HZ1 LYS 671 HZ1 LYS 671 -1.374 -14.999 -9.830 589 HZ2 LYS 671 HZ2 LYS 671 -1.401 -14.712 -8.210 590 HZ3 LYS 671 HZ3 LYS 671 -1.403 -13.453 -9.262 591 H SER 672 H SER 672 -2.979 -8.471 -6.100 592 HA SER 672 HA SER 672 -0.225 -8.555 -6.971 593 HB2 SER 672 HB2 SER 672 -1.799 -6.742 -7.584 594 HB3 SER 672 HB3 SER 672 -1.907 -6.267 -5.878 595 HG SER 672 HG SER 672 0.559 -6.241 -6.143 596 H GLY 673 H GLY 673 -1.693 -8.729 -3.796 597 HA2 GLY 673 HA2 GLY 673 -0.477 -9.460 -1.898 598 HA3 GLY 673 HA3 GLY 673 1.026 -8.848 -2.600 599 H ILE 674 H ILE 674 -1.622 -6.681 -2.893 600 HA ILE 674 HA ILE 674 -0.463 -4.685 -1.114 601 HB ILE 674 HB ILE 674 -3.176 -4.839 -2.507 602 HG12 ILE 674 HG12 ILE 674 -0.551 -3.598 -3.402 603 HG13 ILE 674 HG13 ILE 674 -1.408 -4.933 -4.146 604 HG21 ILE 674 HG21 ILE 674 -3.242 -3.256 -0.631 605 HG22 ILE 674 HG22 ILE 674 -1.770 -2.458 -1.219 606 HG23 ILE 674 HG23 ILE 674 -3.290 -2.381 -2.141 607 HD11 ILE 674 HD11 ILE 674 -2.292 -2.036 -4.145 608 HD12 ILE 674 HD12 ILE 674 -1.788 -3.034 -5.516 609 HD13 ILE 674 HD13 ILE 674 -3.316 -3.392 -4.686 610 H ILE 675 H ILE 675 -3.055 -7.110 -1.028 611 HA ILE 675 HA ILE 675 -3.246 -6.816 1.868 612 HB ILE 675 HB ILE 675 -5.621 -6.754 1.950 613 HG12 ILE 675 HG12 ILE 675 -5.634 -7.226 -1.030 614 HG13 ILE 675 HG13 ILE 675 -6.244 -8.272 0.245 615 HG21 ILE 675 HG21 ILE 675 -5.075 -4.724 -0.244 616 HG22 ILE 675 HG22 ILE 675 -6.079 -4.565 1.202 617 HG23 ILE 675 HG23 ILE 675 -4.337 -4.563 1.328 618 HD11 ILE 675 HD11 ILE 675 -7.434 -5.601 -0.567 619 HD12 ILE 675 HD12 ILE 675 -8.105 -7.220 -0.834 620 HD13 ILE 675 HD13 ILE 675 -7.962 -6.584 0.820 621 H TYR 676 H TYR 676 -4.682 -8.863 2.688 622 HA TYR 676 HA TYR 676 -4.349 -11.123 0.832 623 HB2 TYR 676 HB2 TYR 676 -3.243 -12.382 2.694 624 HB3 TYR 676 HB3 TYR 676 -2.284 -11.121 1.925 625 HD1 TYR 676 HD2 TYR 676 -4.082 -12.001 5.070 626 HD2 TYR 676 HD1 TYR 676 -1.248 -9.392 3.125 627 HE1 TYR 676 HE2 TYR 676 -3.204 -11.323 7.277 628 HE2 TYR 676 HE1 TYR 676 -0.339 -8.741 5.333 629 HH TYR 676 HH TYR 676 -1.295 -10.312 8.321 630 H GLU 677 H GLU 677 -5.831 -12.949 1.401 631 HA GLU 677 HA GLU 677 -8.078 -12.231 3.047 632 HB2 GLU 677 HB2 GLU 677 -7.147 -14.570 1.427 633 HB3 GLU 677 HB3 GLU 677 -8.131 -14.979 2.827 634 HG2 GLU 677 HG2 GLU 677 -10.010 -14.086 2.053 635 HG3 GLU 677 HG3 GLU 677 -9.231 -12.708 1.336 636 H ALA 678 H ALA 678 -8.294 -12.679 5.233 637 HA ALA 678 HA ALA 678 -5.939 -13.934 6.589 638 HB1 ALA 678 HB1 ALA 678 -6.597 -12.530 8.526 639 HB2 ALA 678 HB2 ALA 678 -6.201 -11.550 7.092 640 HB3 ALA 678 HB3 ALA 678 -7.902 -11.826 7.544 641 H LYS 679 H LYS 679 -9.503 -13.659 6.492 642 HA LYS 679 HA LYS 679 -9.731 -16.402 7.441 643 HB2 LYS 679 HB2 LYS 679 -11.161 -14.046 8.790 644 HB3 LYS 679 HB3 LYS 679 -11.687 -15.707 8.953 645 HG2 LYS 679 HG2 LYS 679 -9.376 -16.277 9.839 646 HG3 LYS 679 HG3 LYS 679 -9.029 -14.537 9.852 647 HD2 LYS 679 HD2 LYS 679 -10.942 -14.179 11.404 648 HD3 LYS 679 HD3 LYS 679 -11.229 -15.939 11.425 649 HE2 LYS 679 HE2 LYS 679 -8.867 -16.269 12.229 650 HE3 LYS 679 HE3 LYS 679 -8.662 -14.511 12.251 651 HZ1 LYS 679 HZ1 LYS 679 -9.167 -15.056 14.414 652 HZ2 LYS 679 HZ2 LYS 679 -10.459 -16.064 14.017 653 HZ3 LYS 679 HZ3 LYS 679 -10.457 -14.389 13.899 654 HA PRO 680 HA PRO 680 -12.750 -16.368 4.134 655 HB2 PRO 680 HB2 PRO 680 -15.113 -17.328 5.318 656 HB3 PRO 680 HB3 PRO 680 -13.796 -18.318 4.622 657 HG2 PRO 680 HG2 PRO 680 -14.235 -17.539 7.510 658 HG3 PRO 680 HG3 PRO 680 -13.750 -19.134 6.849 659 HD2 PRO 680 HD2 PRO 680 -11.903 -17.498 7.915 660 HD3 PRO 680 HD3 PRO 680 -11.527 -18.354 6.403 661 H GLU 681 H GLU 681 -14.178 -14.902 3.294 662 HA GLU 681 HA GLU 681 -14.821 -12.772 2.989 663 HB2 GLU 681 HB2 GLU 681 -16.573 -13.812 5.237 664 HB3 GLU 681 HB3 GLU 681 -16.914 -12.325 4.368 665 HG2 GLU 681 HG2 GLU 681 -18.198 -14.081 3.364 666 HG3 GLU 681 HG3 GLU 681 -16.985 -13.523 2.219 667 H CYS 682 H CYS 682 -12.459 -12.931 4.904 668 HA CYS 682 HA CYS 682 -12.729 -10.182 5.978 669 HB2 CYS 682 HB2 CYS 682 -13.147 -12.203 7.599 670 HB3 CYS 682 HB3 CYS 682 -11.400 -12.382 7.524 671 H TYR 683 H TYR 683 -11.297 -9.082 4.833 672 HA TYR 683 HA TYR 683 -8.761 -10.366 3.891 673 HB2 TYR 683 HB2 TYR 683 -10.165 -7.801 3.036 674 HB3 TYR 683 HB3 TYR 683 -8.559 -8.281 2.498 675 HD1 TYR 683 HD2 TYR 683 -12.141 -9.304 2.475 676 HD2 TYR 683 HD1 TYR 683 -8.261 -9.859 0.638 677 HE1 TYR 683 HE2 TYR 683 -13.159 -10.802 0.789 678 HE2 TYR 683 HE1 TYR 683 -9.304 -11.333 -1.037 679 HH TYR 683 HH TYR 683 -11.292 -12.958 -0.885 680 H LYS 684 H LYS 684 -6.719 -9.159 4.334 681 HA LYS 684 HA LYS 684 -7.031 -6.917 6.240 682 HB2 LYS 684 HB2 LYS 684 -6.749 -9.021 7.538 683 HB3 LYS 684 HB3 LYS 684 -5.217 -9.316 6.743 684 HG2 LYS 684 HG2 LYS 684 -5.482 -6.583 7.940 685 HG3 LYS 684 HG3 LYS 684 -5.589 -7.894 9.123 686 HD2 LYS 684 HD2 LYS 684 -3.469 -8.764 8.566 687 HD3 LYS 684 HD3 LYS 684 -3.411 -7.889 7.033 688 HE2 LYS 684 HE2 LYS 684 -3.370 -5.734 8.487 689 HE3 LYS 684 HE3 LYS 684 -2.954 -6.822 9.826 690 HZ1 LYS 684 HZ1 LYS 684 -1.460 -6.253 7.332 691 HZ2 LYS 684 HZ2 LYS 684 -1.138 -7.625 8.186 692 HZ3 LYS 684 HZ3 LYS 684 -0.908 -6.097 8.818 693 H LYS 685 H LYS 685 -5.713 -5.289 5.617 694 HA LYS 685 HA LYS 685 -4.190 -5.724 3.190 695 HB2 LYS 685 HB2 LYS 685 -3.813 -3.336 3.141 696 HB3 LYS 685 HB3 LYS 685 -5.503 -3.742 3.303 697 HG2 LYS 685 HG2 LYS 685 -5.186 -1.917 4.703 698 HG3 LYS 685 HG3 LYS 685 -5.338 -3.302 5.786 699 HD2 LYS 685 HD2 LYS 685 -3.589 -1.865 6.523 700 HD3 LYS 685 HD3 LYS 685 -2.838 -3.342 6.021 701 HE2 LYS 685 HE2 LYS 685 -2.037 -2.403 3.980 702 HE3 LYS 685 HE3 LYS 685 -3.065 -0.970 4.154 703 HZ1 LYS 685 HZ1 LYS 685 -0.745 -1.860 5.735 704 HZ2 LYS 685 HZ2 LYS 685 -1.762 -0.589 6.276 705 HZ3 LYS 685 HZ3 LYS 685 -0.846 -0.443 4.889 706 H VAL 686 H VAL 686 -1.834 -4.977 3.019 707 HA VAL 686 HA VAL 686 -0.573 -6.636 4.994 708 HB VAL 686 HB VAL 686 0.013 -6.606 2.609 709 HG11 VAL 686 HG11 VAL 686 1.537 -5.019 1.675 710 HG12 VAL 686 HG12 VAL 686 0.118 -4.139 2.259 711 HG13 VAL 686 HG13 VAL 686 1.614 -4.103 3.201 712 HG21 VAL 686 HG21 VAL 686 2.301 -6.208 4.559 713 HG22 VAL 686 HG22 VAL 686 1.420 -7.718 4.254 714 HG23 VAL 686 HG23 VAL 686 2.403 -7.001 2.972 Start of MODEL 3 1 H1 GLY 600 H1 GLY 600 14.633 2.103 3.314 2 H2 GLY 600 H2 GLY 600 15.507 3.504 3.565 3 H3 GLY 600 H3 GLY 600 16.259 2.082 3.246 4 HA2 GLY 600 HA2 GLY 600 14.800 2.755 5.702 5 HA3 GLY 600 HA3 GLY 600 15.462 1.147 5.317 6 H SER 601 H SER 601 17.062 1.178 7.097 7 HA SER 601 HA SER 601 19.068 3.177 7.311 8 HB2 SER 601 HB2 SER 601 19.300 0.213 7.962 9 HB3 SER 601 HB3 SER 601 20.164 1.562 8.725 10 HG SER 601 HG SER 601 18.243 2.228 9.651 11 H HIS 602 H HIS 602 18.572 0.644 5.016 12 HA HIS 602 HA HIS 602 20.935 1.501 3.509 13 HB2 HIS 602 HB2 HIS 602 19.720 -1.278 3.286 14 HB3 HIS 602 HB3 HIS 602 21.195 -0.685 2.530 15 HD1 HIS 602 HD1 HIS 602 20.548 -3.158 4.851 16 HD2 HIS 602 HD2 HIS 602 22.776 0.411 5.099 17 HE1 HIS 602 HE1 HIS 602 22.183 -3.442 6.796 18 H MET 603 H MET 603 20.209 1.181 1.010 19 HA MET 603 HA MET 603 17.284 1.432 0.776 20 HB2 MET 603 HB2 MET 603 17.445 3.431 -0.581 21 HB3 MET 603 HB3 MET 603 18.103 3.728 1.031 22 HG2 MET 603 HG2 MET 603 20.400 3.491 0.114 23 HG3 MET 603 HG3 MET 603 19.709 3.241 -1.498 24 HE1 MET 603 HE1 MET 603 21.182 6.774 -1.909 25 HE2 MET 603 HE2 MET 603 21.862 5.353 -1.071 26 HE3 MET 603 HE3 MET 603 20.988 5.146 -2.611 27 H GLY 604 H GLY 604 16.480 0.964 -1.198 28 HA2 GLY 604 HA2 GLY 604 17.303 0.429 -3.684 29 HA3 GLY 604 HA3 GLY 604 18.129 -0.900 -2.805 30 H GLU 605 H GLU 605 15.030 0.121 -1.568 31 HA GLU 605 HA GLU 605 14.287 -2.588 -1.720 32 HB2 GLU 605 HB2 GLU 605 12.547 -0.252 -0.831 33 HB3 GLU 605 HB3 GLU 605 12.490 -1.974 -0.454 34 HG2 GLU 605 HG2 GLU 605 13.401 -1.235 1.476 35 HG3 GLU 605 HG3 GLU 605 14.871 -1.605 0.585 36 H SER 606 H SER 606 13.987 -3.246 -3.905 37 HA SER 606 HA SER 606 12.479 -2.165 -5.864 38 HB2 SER 606 HB2 SER 606 12.505 -5.125 -5.175 39 HB3 SER 606 HB3 SER 606 12.370 -4.386 -6.786 40 HG SER 606 HG SER 606 14.506 -5.063 -6.374 41 H GLY 607 H GLY 607 11.111 -3.213 -2.899 42 HA2 GLY 607 HA2 GLY 607 8.385 -3.697 -3.867 43 HA3 GLY 607 HA3 GLY 607 8.924 -3.581 -2.188 44 H LYS 608 H LYS 608 10.231 -0.840 -3.627 45 HA LYS 608 HA LYS 608 8.271 0.935 -2.541 46 HB2 LYS 608 HB2 LYS 608 10.729 1.381 -2.800 47 HB3 LYS 608 HB3 LYS 608 10.495 1.557 -4.532 48 HG2 LYS 608 HG2 LYS 608 8.559 3.235 -3.128 49 HG3 LYS 608 HG3 LYS 608 10.130 3.465 -2.385 50 HD2 LYS 608 HD2 LYS 608 9.762 5.129 -4.096 51 HD3 LYS 608 HD3 LYS 608 11.105 4.076 -4.592 52 HE2 LYS 608 HE2 LYS 608 9.694 2.889 -6.159 53 HE3 LYS 608 HE3 LYS 608 8.232 3.582 -5.453 54 HZ1 LYS 608 HZ1 LYS 608 10.196 5.145 -7.020 55 HZ2 LYS 608 HZ2 LYS 608 8.761 5.688 -6.295 56 HZ3 LYS 608 HZ3 LYS 608 8.630 4.660 -7.442 57 H ILE 609 H ILE 609 6.282 0.441 -3.412 58 HA ILE 609 HA ILE 609 5.622 1.026 -6.218 59 HB ILE 609 HB ILE 609 4.167 0.285 -3.674 60 HG12 ILE 609 HG12 ILE 609 3.035 -1.339 -5.197 61 HG13 ILE 609 HG13 ILE 609 3.946 -0.699 -6.560 62 HG21 ILE 609 HG21 ILE 609 1.950 0.601 -4.652 63 HG22 ILE 609 HG22 ILE 609 2.754 2.138 -4.391 64 HG23 ILE 609 HG23 ILE 609 2.652 1.453 -6.037 65 HD11 ILE 609 HD11 ILE 609 6.036 -1.569 -5.586 66 HD12 ILE 609 HD12 ILE 609 5.143 -2.087 -4.127 67 HD13 ILE 609 HD13 ILE 609 4.819 -2.846 -5.694 68 H ASP 610 H ASP 610 3.948 3.002 -6.449 69 HA ASP 610 HA ASP 610 4.708 5.278 -4.742 70 HB2 ASP 610 HB2 ASP 610 4.444 5.470 -7.775 71 HB3 ASP 610 HB3 ASP 610 4.673 6.811 -6.658 72 H ILE 611 H ILE 611 3.072 7.061 -5.219 73 HA ILE 611 HA ILE 611 0.309 6.093 -5.707 74 HB ILE 611 HB ILE 611 1.500 8.820 -5.080 75 HG12 ILE 611 HG12 ILE 611 -0.399 7.564 -3.137 76 HG13 ILE 611 HG13 ILE 611 1.135 6.724 -3.277 77 HG21 ILE 611 HG21 ILE 611 -1.420 8.015 -5.375 78 HG22 ILE 611 HG22 ILE 611 -0.858 9.551 -4.660 79 HG23 ILE 611 HG23 ILE 611 -0.515 9.191 -6.353 80 HD11 ILE 611 HD11 ILE 611 0.850 9.697 -2.708 81 HD12 ILE 611 HD12 ILE 611 1.239 8.425 -1.525 82 HD13 ILE 611 HD13 ILE 611 2.379 8.792 -2.835 83 H ASP 612 H ASP 612 3.004 7.887 -7.186 84 HA ASP 612 HA ASP 612 1.692 9.186 -9.295 85 HB2 ASP 612 HB2 ASP 612 4.010 9.681 -8.666 86 HB3 ASP 612 HB3 ASP 612 4.524 8.076 -9.219 87 H THR 613 H THR 613 3.250 6.025 -9.168 88 HA THR 613 HA THR 613 3.022 5.199 -11.796 89 HB THR 613 HB THR 613 4.204 4.214 -9.721 90 HG1 THR 613 HG1 THR 613 4.568 2.391 -10.827 91 HG21 THR 613 HG21 THR 613 3.310 2.364 -8.588 92 HG22 THR 613 HG22 THR 613 1.839 2.356 -9.583 93 HG23 THR 613 HG23 THR 613 2.138 3.684 -8.442 94 H ILE 614 H ILE 614 0.461 5.514 -9.514 95 HA ILE 614 HA ILE 614 -1.431 3.918 -11.140 96 HB ILE 614 HB ILE 614 -1.717 5.294 -8.436 97 HG12 ILE 614 HG12 ILE 614 -1.892 2.303 -8.735 98 HG13 ILE 614 HG13 ILE 614 -0.292 3.006 -8.824 99 HG21 ILE 614 HG21 ILE 614 -3.860 4.063 -8.227 100 HG22 ILE 614 HG22 ILE 614 -3.892 5.227 -9.555 101 HG23 ILE 614 HG23 ILE 614 -3.694 3.494 -9.901 102 HD11 ILE 614 HD11 ILE 614 -0.728 2.374 -6.551 103 HD12 ILE 614 HD12 ILE 614 -0.584 4.135 -6.674 104 HD13 ILE 614 HD13 ILE 614 -2.193 3.387 -6.501 105 H MET 615 H MET 615 -1.199 7.206 -9.624 106 HA MET 615 HA MET 615 -3.547 8.016 -11.069 107 HB2 MET 615 HB2 MET 615 -3.344 10.089 -9.886 108 HB3 MET 615 HB3 MET 615 -2.871 8.787 -8.791 109 HG2 MET 615 HG2 MET 615 -1.170 10.247 -8.352 110 HG3 MET 615 HG3 MET 615 -0.432 9.354 -9.675 111 HE1 MET 615 HE1 MET 615 1.105 10.782 -11.051 112 HE2 MET 615 HE2 MET 615 1.082 12.553 -10.972 113 HE3 MET 615 HE3 MET 615 1.232 11.603 -9.476 114 H THR 616 H THR 616 -0.214 8.026 -11.980 115 HA THR 616 HA THR 616 -0.298 10.174 -13.876 116 HB THR 616 HB THR 616 1.685 9.076 -12.727 117 HG1 THR 616 HG1 THR 616 2.979 9.740 -14.178 118 HG21 THR 616 HG21 THR 616 2.779 7.193 -13.727 119 HG22 THR 616 HG22 THR 616 1.613 7.124 -15.068 120 HG23 THR 616 HG23 THR 616 1.112 6.682 -13.425 121 H GLY 617 H GLY 617 -1.521 6.893 -13.933 122 HA2 GLY 617 HA2 GLY 617 -2.261 7.193 -16.827 123 HA3 GLY 617 HA3 GLY 617 -1.578 5.697 -16.190 124 H LYS 618 H LYS 618 -3.486 6.833 -13.690 125 HA LYS 618 HA LYS 618 -6.026 5.706 -14.730 126 HB2 LYS 618 HB2 LYS 618 -4.632 5.165 -12.053 127 HB3 LYS 618 HB3 LYS 618 -6.318 4.878 -12.327 128 HG2 LYS 618 HG2 LYS 618 -5.499 2.776 -12.706 129 HG3 LYS 618 HG3 LYS 618 -5.543 3.394 -14.360 130 HD2 LYS 618 HD2 LYS 618 -3.088 3.962 -14.129 131 HD3 LYS 618 HD3 LYS 618 -3.104 3.253 -12.523 132 HE2 LYS 618 HE2 LYS 618 -3.793 1.793 -15.111 133 HE3 LYS 618 HE3 LYS 618 -2.192 1.792 -14.360 134 HZ1 LYS 618 HZ1 LYS 618 -3.136 0.741 -12.428 135 HZ2 LYS 618 HZ2 LYS 618 -3.447 -0.162 -13.766 136 HZ3 LYS 618 HZ3 LYS 618 -4.643 0.750 -13.096 137 HA PRO 619 HA PRO 619 -7.543 9.536 -13.243 138 HB2 PRO 619 HB2 PRO 619 -10.094 8.989 -12.334 139 HB3 PRO 619 HB3 PRO 619 -9.631 9.033 -14.063 140 HG2 PRO 619 HG2 PRO 619 -9.898 6.623 -12.247 141 HG3 PRO 619 HG3 PRO 619 -10.502 6.815 -13.923 142 HD2 PRO 619 HD2 PRO 619 -8.182 5.508 -13.328 143 HD3 PRO 619 HD3 PRO 619 -8.330 6.467 -14.823 144 H LYS 620 H LYS 620 -8.179 10.758 -11.339 145 HA LYS 620 HA LYS 620 -6.925 10.116 -8.922 146 HB2 LYS 620 HB2 LYS 620 -9.326 11.922 -9.464 147 HB3 LYS 620 HB3 LYS 620 -8.500 11.830 -7.905 148 HG2 LYS 620 HG2 LYS 620 -6.373 12.530 -8.947 149 HG3 LYS 620 HG3 LYS 620 -7.165 12.625 -10.533 150 HD2 LYS 620 HD2 LYS 620 -8.660 14.410 -9.714 151 HD3 LYS 620 HD3 LYS 620 -7.993 14.247 -8.086 152 HE2 LYS 620 HE2 LYS 620 -7.002 16.183 -9.120 153 HE3 LYS 620 HE3 LYS 620 -5.762 14.943 -8.899 154 HZ1 LYS 620 HZ1 LYS 620 -5.990 14.390 -11.235 155 HZ2 LYS 620 HZ2 LYS 620 -5.617 15.979 -11.058 156 HZ3 LYS 620 HZ3 LYS 620 -7.155 15.540 -11.437 157 H SER 621 H SER 621 -10.316 9.353 -9.928 158 HA SER 621 HA SER 621 -11.421 8.348 -7.699 159 HB2 SER 621 HB2 SER 621 -11.580 6.924 -10.368 160 HB3 SER 621 HB3 SER 621 -12.859 7.196 -9.168 161 HG SER 621 HG SER 621 -13.138 8.679 -10.816 162 H ALA 622 H ALA 622 -8.742 6.761 -9.518 163 HA ALA 622 HA ALA 622 -9.092 4.119 -8.490 164 HB1 ALA 622 HB1 ALA 622 -6.725 3.824 -9.142 165 HB2 ALA 622 HB2 ALA 622 -7.666 4.620 -10.421 166 HB3 ALA 622 HB3 ALA 622 -6.565 5.573 -9.404 167 H ARG 623 H ARG 623 -6.777 6.682 -7.431 168 HA ARG 623 HA ARG 623 -6.255 5.371 -4.897 169 HB2 ARG 623 HB2 ARG 623 -5.236 7.523 -4.207 170 HB3 ARG 623 HB3 ARG 623 -4.580 6.921 -5.726 171 HG2 ARG 623 HG2 ARG 623 -5.693 8.562 -6.979 172 HG3 ARG 623 HG3 ARG 623 -6.845 8.884 -5.689 173 HD2 ARG 623 HD2 ARG 623 -3.955 9.598 -5.314 174 HD3 ARG 623 HD3 ARG 623 -5.067 10.665 -6.179 175 HE ARG 623 HE ARG 623 -4.993 10.193 -3.318 176 HH11 ARG 623 HH11 ARG 623 -7.112 11.207 -5.973 177 HH12 ARG 623 HH12 ARG 623 -8.464 11.620 -4.953 178 HH21 ARG 623 HH21 ARG 623 -6.841 10.775 -1.922 179 HH22 ARG 623 HH22 ARG 623 -8.340 11.183 -2.721 180 H GLU 624 H GLU 624 -8.735 7.701 -5.992 181 HA GLU 624 HA GLU 624 -9.586 8.494 -3.432 182 HB2 GLU 624 HB2 GLU 624 -10.324 9.159 -5.964 183 HB3 GLU 624 HB3 GLU 624 -11.683 8.112 -5.552 184 HG2 GLU 624 HG2 GLU 624 -12.289 10.372 -5.081 185 HG3 GLU 624 HG3 GLU 624 -12.057 9.555 -3.537 186 H LYS 625 H LYS 625 -10.219 5.556 -5.202 187 HA LYS 625 HA LYS 625 -12.152 4.552 -3.188 188 HB2 LYS 625 HB2 LYS 625 -11.074 3.388 -5.782 189 HB3 LYS 625 HB3 LYS 625 -12.264 2.580 -4.753 190 HG2 LYS 625 HG2 LYS 625 -13.969 4.149 -5.218 191 HG3 LYS 625 HG3 LYS 625 -12.843 5.411 -5.663 192 HD2 LYS 625 HD2 LYS 625 -13.618 4.913 -7.735 193 HD3 LYS 625 HD3 LYS 625 -12.201 3.883 -7.680 194 HE2 LYS 625 HE2 LYS 625 -13.847 2.496 -8.566 195 HE3 LYS 625 HE3 LYS 625 -13.787 2.003 -6.866 196 HZ1 LYS 625 HZ1 LYS 625 -15.765 3.290 -6.478 197 HZ2 LYS 625 HZ2 LYS 625 -16.015 2.297 -7.788 198 HZ3 LYS 625 HZ3 LYS 625 -15.748 3.899 -8.014 199 H MET 626 H MET 626 -8.862 3.640 -4.482 200 HA MET 626 HA MET 626 -8.600 1.377 -2.759 201 HB2 MET 626 HB2 MET 626 -6.522 3.073 -4.207 202 HB3 MET 626 HB3 MET 626 -6.150 1.587 -3.326 203 HG2 MET 626 HG2 MET 626 -7.843 0.406 -4.793 204 HG3 MET 626 HG3 MET 626 -7.917 1.870 -5.770 205 HE1 MET 626 HE1 MET 626 -5.920 -1.337 -4.812 206 HE2 MET 626 HE2 MET 626 -6.988 -1.423 -6.229 207 HE3 MET 626 HE3 MET 626 -5.232 -1.605 -6.420 208 H MET 627 H MET 627 -7.541 4.808 -2.433 209 HA MET 627 HA MET 627 -6.048 4.302 -0.064 210 HB2 MET 627 HB2 MET 627 -7.113 6.957 -1.095 211 HB3 MET 627 HB3 MET 627 -5.902 6.744 0.154 212 HG2 MET 627 HG2 MET 627 -5.569 5.877 -2.740 213 HG3 MET 627 HG3 MET 627 -4.922 7.346 -2.033 214 HE1 MET 627 HE1 MET 627 -3.318 5.121 -3.731 215 HE2 MET 627 HE2 MET 627 -2.625 6.649 -3.137 216 HE3 MET 627 HE3 MET 627 -1.789 5.112 -2.824 217 H LYS 628 H LYS 628 -9.428 5.034 -0.713 218 HA LYS 628 HA LYS 628 -10.084 5.515 2.116 219 HB2 LYS 628 HB2 LYS 628 -11.811 4.775 -0.285 220 HB3 LYS 628 HB3 LYS 628 -12.394 4.664 1.376 221 HG2 LYS 628 HG2 LYS 628 -11.642 7.118 1.649 222 HG3 LYS 628 HG3 LYS 628 -11.592 7.160 -0.107 223 HD2 LYS 628 HD2 LYS 628 -13.969 6.742 1.747 224 HD3 LYS 628 HD3 LYS 628 -13.721 7.992 0.530 225 HE2 LYS 628 HE2 LYS 628 -15.251 6.740 -0.573 226 HE3 LYS 628 HE3 LYS 628 -13.782 5.939 -1.150 227 HZ1 LYS 628 HZ1 LYS 628 -15.445 4.323 -0.355 228 HZ2 LYS 628 HZ2 LYS 628 -15.532 4.985 1.119 229 HZ3 LYS 628 HZ3 LYS 628 -14.177 4.261 0.648 230 H ILE 629 H ILE 629 -10.379 2.684 -0.111 231 HA ILE 629 HA ILE 629 -11.429 0.923 1.738 232 HB ILE 629 HB ILE 629 -9.636 0.384 -0.644 233 HG12 ILE 629 HG12 ILE 629 -12.614 -0.213 -0.337 234 HG13 ILE 629 HG13 ILE 629 -12.074 1.392 -0.792 235 HG21 ILE 629 HG21 ILE 629 -9.421 -1.583 0.837 236 HG22 ILE 629 HG22 ILE 629 -11.186 -1.674 1.007 237 HG23 ILE 629 HG23 ILE 629 -10.405 -1.991 -0.558 238 HD11 ILE 629 HD11 ILE 629 -10.824 0.403 -2.735 239 HD12 ILE 629 HD12 ILE 629 -11.570 -1.164 -2.345 240 HD13 ILE 629 HD13 ILE 629 -12.587 0.216 -2.799 241 H ILE 630 H ILE 630 -7.877 1.138 1.028 242 HA ILE 630 HA ILE 630 -7.066 -0.587 3.057 243 HB ILE 630 HB ILE 630 -4.963 0.827 3.218 244 HG12 ILE 630 HG12 ILE 630 -5.151 2.238 0.736 245 HG13 ILE 630 HG13 ILE 630 -6.519 2.755 1.708 246 HG21 ILE 630 HG21 ILE 630 -4.148 0.047 1.050 247 HG22 ILE 630 HG22 ILE 630 -5.216 -1.160 1.797 248 HG23 ILE 630 HG23 ILE 630 -5.817 -0.141 0.472 249 HD11 ILE 630 HD11 ILE 630 -3.613 2.835 2.562 250 HD12 ILE 630 HD12 ILE 630 -4.621 4.211 2.065 251 HD13 ILE 630 HD13 ILE 630 -5.001 3.340 3.564 252 H GLU 631 H GLU 631 -7.927 2.894 3.440 253 HA GLU 631 HA GLU 631 -6.879 3.077 6.110 254 HB2 GLU 631 HB2 GLU 631 -7.614 4.904 4.258 255 HB3 GLU 631 HB3 GLU 631 -9.129 4.849 5.139 256 HG2 GLU 631 HG2 GLU 631 -7.873 5.307 7.258 257 HG3 GLU 631 HG3 GLU 631 -6.369 5.370 6.329 258 H ILE 632 H ILE 632 -10.054 2.405 4.680 259 HA ILE 632 HA ILE 632 -11.515 2.193 7.160 260 HB ILE 632 HB ILE 632 -12.041 0.985 4.419 261 HG12 ILE 632 HG12 ILE 632 -13.626 3.315 5.510 262 HG13 ILE 632 HG13 ILE 632 -12.019 3.669 4.891 263 HG21 ILE 632 HG21 ILE 632 -14.439 0.837 5.193 264 HG22 ILE 632 HG22 ILE 632 -13.348 -0.240 6.054 265 HG23 ILE 632 HG23 ILE 632 -13.898 1.261 6.829 266 HD11 ILE 632 HD11 ILE 632 -12.552 2.721 2.726 267 HD12 ILE 632 HD12 ILE 632 -14.098 2.162 3.303 268 HD13 ILE 632 HD13 ILE 632 -13.773 3.920 3.183 269 H ILE 633 H ILE 633 -9.570 -0.150 5.194 270 HA ILE 633 HA ILE 633 -10.295 -2.397 6.811 271 HB ILE 633 HB ILE 633 -7.839 -2.009 5.063 272 HG12 ILE 633 HG12 ILE 633 -10.655 -2.497 4.413 273 HG13 ILE 633 HG13 ILE 633 -9.284 -2.078 3.388 274 HG21 ILE 633 HG21 ILE 633 -8.912 -4.598 6.226 275 HG22 ILE 633 HG22 ILE 633 -7.543 -4.418 5.108 276 HG23 ILE 633 HG23 ILE 633 -7.441 -3.749 6.728 277 HD11 ILE 633 HD11 ILE 633 -10.331 -4.058 2.580 278 HD12 ILE 633 HD12 ILE 633 -8.694 -4.398 3.119 279 HD13 ILE 633 HD13 ILE 633 -10.069 -4.892 4.130 280 H ASP 634 H ASP 634 -7.572 -0.057 6.925 281 HA ASP 634 HA ASP 634 -6.148 -1.215 9.064 282 HB2 ASP 634 HB2 ASP 634 -6.433 1.706 8.224 283 HB3 ASP 634 HB3 ASP 634 -5.302 1.140 9.444 284 H SER 635 H SER 635 -8.722 1.226 8.957 285 HA SER 635 HA SER 635 -8.841 1.759 11.714 286 HB2 SER 635 HB2 SER 635 -11.065 2.048 9.641 287 HB3 SER 635 HB3 SER 635 -10.972 2.875 11.207 288 HG SER 635 HG SER 635 -9.291 3.168 8.918 289 H LEU 636 H LEU 636 -10.855 -0.434 9.663 290 HA LEU 636 HA LEU 636 -12.487 -1.339 11.837 291 HB2 LEU 636 HB2 LEU 636 -11.842 -2.539 9.141 292 HB3 LEU 636 HB3 LEU 636 -13.015 -3.224 10.281 293 HG LEU 636 HG LEU 636 -13.292 -0.410 9.151 294 HD11 LEU 636 HD11 LEU 636 -13.337 -2.084 7.350 295 HD12 LEU 636 HD12 LEU 636 -14.962 -1.439 7.629 296 HD13 LEU 636 HD13 LEU 636 -14.515 -3.053 8.243 297 HD21 LEU 636 HD21 LEU 636 -14.511 -0.727 11.245 298 HD22 LEU 636 HD22 LEU 636 -15.215 -2.239 10.636 299 HD23 LEU 636 HD23 LEU 636 -15.641 -0.687 9.892 300 H ALA 637 H ALA 637 -9.298 -2.384 10.646 301 HA ALA 637 HA ALA 637 -9.190 -4.752 12.342 302 HB1 ALA 637 HB1 ALA 637 -7.947 -4.576 10.215 303 HB2 ALA 637 HB2 ALA 637 -7.009 -3.211 10.873 304 HB3 ALA 637 HB3 ALA 637 -6.859 -4.825 11.599 305 H VAL 638 H VAL 638 -9.252 -1.523 13.198 306 HA VAL 638 HA VAL 638 -7.736 -2.148 15.681 307 HB VAL 638 HB VAL 638 -7.284 -0.039 13.865 308 HG11 VAL 638 HG11 VAL 638 -8.487 1.157 16.392 309 HG12 VAL 638 HG12 VAL 638 -7.601 2.015 15.118 310 HG13 VAL 638 HG13 VAL 638 -9.164 1.286 14.749 311 HG21 VAL 638 HG21 VAL 638 -5.608 0.650 15.516 312 HG22 VAL 638 HG22 VAL 638 -6.411 -0.328 16.767 313 HG23 VAL 638 HG23 VAL 638 -5.659 -1.112 15.359 314 H SER 639 H SER 639 -10.693 -0.714 14.325 315 HA SER 639 HA SER 639 -12.040 -0.436 16.865 316 HB2 SER 639 HB2 SER 639 -12.442 0.770 14.630 317 HB3 SER 639 HB3 SER 639 -13.270 -0.702 14.092 318 HG SER 639 HG SER 639 -14.667 0.900 15.011 319 H SER 640 H SER 640 -11.334 -3.177 14.834 320 HA SER 640 HA SER 640 -12.734 -5.009 16.552 321 HB2 SER 640 HB2 SER 640 -13.663 -6.143 14.345 322 HB3 SER 640 HB3 SER 640 -14.582 -4.897 15.184 323 HG SER 640 HG SER 640 -12.825 -4.065 13.139 324 H GLU 641 H GLU 641 -12.090 -7.374 15.545 325 HA GLU 641 HA GLU 641 -9.266 -7.506 15.558 326 HB2 GLU 641 HB2 GLU 641 -11.307 -9.468 14.421 327 HB3 GLU 641 HB3 GLU 641 -9.619 -9.845 14.768 328 HG2 GLU 641 HG2 GLU 641 -10.020 -9.450 17.183 329 HG3 GLU 641 HG3 GLU 641 -11.726 -9.099 16.838 330 H CYS 642 H CYS 642 -11.563 -7.228 12.856 331 HA CYS 642 HA CYS 642 -9.498 -6.834 10.876 332 HB2 CYS 642 HB2 CYS 642 -10.438 -8.837 9.529 333 HB3 CYS 642 HB3 CYS 642 -9.295 -9.153 10.813 334 H ALA 643 H ALA 643 -10.497 -6.508 8.778 335 HA ALA 643 HA ALA 643 -12.864 -4.809 8.950 336 HB1 ALA 643 HB1 ALA 643 -10.751 -4.198 7.755 337 HB2 ALA 643 HB2 ALA 643 -11.084 -5.482 6.577 338 HB3 ALA 643 HB3 ALA 643 -12.207 -4.113 6.734 339 H LYS 644 H LYS 644 -14.613 -6.025 9.221 340 HA LYS 644 HA LYS 644 -15.345 -8.347 7.719 341 HB2 LYS 644 HB2 LYS 644 -17.173 -6.189 8.805 342 HB3 LYS 644 HB3 LYS 644 -17.669 -7.781 8.256 343 HG2 LYS 644 HG2 LYS 644 -17.266 -8.719 10.231 344 HG3 LYS 644 HG3 LYS 644 -15.604 -8.126 10.276 345 HD2 LYS 644 HD2 LYS 644 -17.995 -6.387 10.933 346 HD3 LYS 644 HD3 LYS 644 -17.109 -7.358 12.144 347 HE2 LYS 644 HE2 LYS 644 -15.010 -6.202 11.592 348 HE3 LYS 644 HE3 LYS 644 -15.841 -5.271 10.324 349 HZ1 LYS 644 HZ1 LYS 644 -16.870 -3.967 11.770 350 HZ2 LYS 644 HZ2 LYS 644 -15.433 -4.239 12.602 351 HZ3 LYS 644 HZ3 LYS 644 -16.806 -5.034 13.048 352 H VAL 645 H VAL 645 -16.081 -8.524 5.779 353 HA VAL 645 HA VAL 645 -15.840 -6.450 3.826 354 HB VAL 645 HB VAL 645 -15.653 -8.944 3.458 355 HG11 VAL 645 HG11 VAL 645 -17.815 -9.624 4.508 356 HG12 VAL 645 HG12 VAL 645 -18.687 -8.852 3.163 357 HG13 VAL 645 HG13 VAL 645 -17.622 -10.231 2.861 358 HG21 VAL 645 HG21 VAL 645 -16.414 -8.830 1.136 359 HG22 VAL 645 HG22 VAL 645 -17.364 -7.372 1.501 360 HG23 VAL 645 HG23 VAL 645 -15.594 -7.349 1.649 361 H LYS 646 H LYS 646 -18.534 -7.530 5.786 362 HA LYS 646 HA LYS 646 -20.751 -6.139 4.729 363 HB2 LYS 646 HB2 LYS 646 -19.825 -7.012 7.480 364 HB3 LYS 646 HB3 LYS 646 -21.013 -5.732 7.433 365 HG2 LYS 646 HG2 LYS 646 -22.196 -7.785 7.635 366 HG3 LYS 646 HG3 LYS 646 -22.522 -7.110 6.031 367 HD2 LYS 646 HD2 LYS 646 -20.849 -8.660 5.050 368 HD3 LYS 646 HD3 LYS 646 -20.522 -9.313 6.675 369 HE2 LYS 646 HE2 LYS 646 -22.989 -9.901 6.840 370 HE3 LYS 646 HE3 LYS 646 -23.185 -9.362 5.166 371 HZ1 LYS 646 HZ1 LYS 646 -21.443 -11.135 4.620 372 HZ2 LYS 646 HZ2 LYS 646 -22.895 -11.735 5.177 373 HZ3 LYS 646 HZ3 LYS 646 -21.505 -11.652 6.073 374 H ASP 647 H ASP 647 -18.016 -4.948 6.771 375 HA ASP 647 HA ASP 647 -19.500 -2.583 7.283 376 HB2 ASP 647 HB2 ASP 647 -16.657 -3.439 7.915 377 HB3 ASP 647 HB3 ASP 647 -17.282 -1.857 8.381 378 H ILE 648 H ILE 648 -16.927 -3.608 5.161 379 HA ILE 648 HA ILE 648 -16.225 -1.040 4.022 380 HB ILE 648 HB ILE 648 -15.907 -3.804 2.751 381 HG12 ILE 648 HG12 ILE 648 -13.927 -2.414 4.623 382 HG13 ILE 648 HG13 ILE 648 -14.919 -3.776 5.072 383 HG21 ILE 648 HG21 ILE 648 -14.075 -2.747 1.499 384 HG22 ILE 648 HG22 ILE 648 -15.530 -1.781 1.290 385 HG23 ILE 648 HG23 ILE 648 -14.275 -1.236 2.415 386 HD11 ILE 648 HD11 ILE 648 -13.878 -5.193 3.328 387 HD12 ILE 648 HD12 ILE 648 -12.750 -3.863 2.961 388 HD13 ILE 648 HD13 ILE 648 -12.748 -4.625 4.557 389 H LEU 649 H LEU 649 -18.297 -3.798 2.904 390 HA LEU 649 HA LEU 649 -19.386 -2.571 0.621 391 HB2 LEU 649 HB2 LEU 649 -20.444 -4.642 2.571 392 HB3 LEU 649 HB3 LEU 649 -21.417 -4.114 1.218 393 HG LEU 649 HG LEU 649 -18.622 -5.237 0.798 394 HD11 LEU 649 HD11 LEU 649 -19.993 -6.934 1.966 395 HD12 LEU 649 HD12 LEU 649 -19.714 -7.394 0.279 396 HD13 LEU 649 HD13 LEU 649 -21.288 -6.730 0.766 397 HD21 LEU 649 HD21 LEU 649 -19.492 -5.689 -1.480 398 HD22 LEU 649 HD22 LEU 649 -19.581 -3.969 -1.106 399 HD23 LEU 649 HD23 LEU 649 -21.049 -4.959 -1.042 400 H LYS 650 H LYS 650 -20.404 -2.303 4.039 401 HA LYS 650 HA LYS 650 -22.700 -0.679 3.630 402 HB2 LYS 650 HB2 LYS 650 -22.221 -1.734 5.776 403 HB3 LYS 650 HB3 LYS 650 -20.721 -0.849 5.918 404 HG2 LYS 650 HG2 LYS 650 -22.347 1.297 5.810 405 HG3 LYS 650 HG3 LYS 650 -23.536 0.100 6.303 406 HD2 LYS 650 HD2 LYS 650 -22.771 1.039 8.291 407 HD3 LYS 650 HD3 LYS 650 -21.904 -0.491 8.240 408 HE2 LYS 650 HE2 LYS 650 -20.654 2.056 7.118 409 HE3 LYS 650 HE3 LYS 650 -20.729 1.815 8.862 410 HZ1 LYS 650 HZ1 LYS 650 -19.297 0.044 6.963 411 HZ2 LYS 650 HZ2 LYS 650 -19.488 -0.238 8.583 412 HZ3 LYS 650 HZ3 LYS 650 -18.650 1.068 8.052 413 H GLU 651 H GLU 651 -19.315 0.460 4.494 414 HA GLU 651 HA GLU 651 -20.173 3.174 4.247 415 HB2 GLU 651 HB2 GLU 651 -18.029 3.839 4.744 416 HB3 GLU 651 HB3 GLU 651 -18.096 2.252 5.445 417 HG2 GLU 651 HG2 GLU 651 -15.988 2.540 4.499 418 HG3 GLU 651 HG3 GLU 651 -16.814 1.366 3.492 419 H ALA 652 H ALA 652 -18.621 0.978 1.907 420 HA ALA 652 HA ALA 652 -18.147 2.994 0.010 421 HB1 ALA 652 HB1 ALA 652 -17.640 1.090 -1.472 422 HB2 ALA 652 HB2 ALA 652 -16.881 0.935 0.112 423 HB3 ALA 652 HB3 ALA 652 -18.326 -0.009 -0.230 424 H GLN 653 H GLN 653 -20.920 0.606 0.291 425 HA GLN 653 HA GLN 653 -22.204 1.538 -2.125 426 HB2 GLN 653 HB2 GLN 653 -23.302 0.133 0.318 427 HB3 GLN 653 HB3 GLN 653 -24.288 0.575 -1.075 428 HG2 GLN 653 HG2 GLN 653 -23.006 -0.782 -2.594 429 HG3 GLN 653 HG3 GLN 653 -21.777 -1.126 -1.373 430 HE21 GLN 653 HE21 GLN 653 -22.764 -2.031 0.731 431 HE22 GLN 653 HE22 GLN 653 -23.926 -3.366 0.538 432 H GLN 654 H GLN 654 -22.282 2.647 1.303 433 HA GLN 654 HA GLN 654 -24.407 4.544 0.811 434 HB2 GLN 654 HB2 GLN 654 -22.326 4.322 3.020 435 HB3 GLN 654 HB3 GLN 654 -23.558 5.575 2.987 436 HG2 GLN 654 HG2 GLN 654 -24.102 2.576 3.072 437 HG3 GLN 654 HG3 GLN 654 -24.218 3.685 4.433 438 HE21 GLN 654 HE21 GLN 654 -25.667 5.883 3.319 439 HE22 GLN 654 HE22 GLN 654 -27.230 5.244 2.829 440 H VAL 655 H VAL 655 -20.790 4.882 0.704 441 HA VAL 655 HA VAL 655 -21.025 7.705 0.179 442 HB VAL 655 HB VAL 655 -19.166 6.423 1.362 443 HG11 VAL 655 HG11 VAL 655 -17.768 6.220 -1.303 444 HG12 VAL 655 HG12 VAL 655 -17.457 5.403 0.257 445 HG13 VAL 655 HG13 VAL 655 -18.805 4.905 -0.751 446 HG21 VAL 655 HG21 VAL 655 -17.445 8.027 0.768 447 HG22 VAL 655 HG22 VAL 655 -18.356 8.501 -0.687 448 HG23 VAL 655 HG23 VAL 655 -19.027 8.810 0.932 449 H GLY 656 H GLY 656 -21.103 4.876 -1.897 450 HA2 GLY 656 HA2 GLY 656 -22.611 5.420 -3.773 451 HA3 GLY 656 HA3 GLY 656 -21.565 6.779 -4.179 452 H ILE 657 H ILE 657 -21.038 3.258 -3.472 453 HA ILE 657 HA ILE 657 -19.653 2.961 -6.082 454 HB ILE 657 HB ILE 657 -18.741 1.957 -3.346 455 HG12 ILE 657 HG12 ILE 657 -17.456 4.040 -5.176 456 HG13 ILE 657 HG13 ILE 657 -18.280 4.379 -3.653 457 HG21 ILE 657 HG21 ILE 657 -17.543 1.548 -6.108 458 HG22 ILE 657 HG22 ILE 657 -16.759 1.075 -4.575 459 HG23 ILE 657 HG23 ILE 657 -18.261 0.325 -5.037 460 HD11 ILE 657 HD11 ILE 657 -15.966 4.451 -3.217 461 HD12 ILE 657 HD12 ILE 657 -16.617 2.989 -2.439 462 HD13 ILE 657 HD13 ILE 657 -15.680 2.869 -3.954 463 H GLU 658 H GLU 658 -19.820 0.666 -6.915 464 HA GLU 658 HA GLU 658 -22.404 -0.465 -6.053 465 HB2 GLU 658 HB2 GLU 658 -21.722 0.075 -8.481 466 HB3 GLU 658 HB3 GLU 658 -20.635 -1.310 -8.384 467 HG2 GLU 658 HG2 GLU 658 -23.437 -1.875 -7.509 468 HG3 GLU 658 HG3 GLU 658 -23.318 -1.316 -9.172 469 H LYS 659 H LYS 659 -22.524 -2.659 -5.298 470 HA LYS 659 HA LYS 659 -20.502 -3.588 -3.625 471 HB2 LYS 659 HB2 LYS 659 -21.656 -5.694 -3.491 472 HB3 LYS 659 HB3 LYS 659 -22.704 -4.297 -3.323 473 HG2 LYS 659 HG2 LYS 659 -23.362 -4.650 -5.792 474 HG3 LYS 659 HG3 LYS 659 -22.472 -6.182 -5.707 475 HD2 LYS 659 HD2 LYS 659 -24.743 -6.725 -5.288 476 HD3 LYS 659 HD3 LYS 659 -23.970 -6.742 -3.689 477 HE2 LYS 659 HE2 LYS 659 -24.724 -4.304 -3.437 478 HE3 LYS 659 HE3 LYS 659 -25.616 -4.485 -4.949 479 HZ1 LYS 659 HZ1 LYS 659 -26.984 -4.811 -2.998 480 HZ2 LYS 659 HZ2 LYS 659 -26.051 -6.065 -2.495 481 HZ3 LYS 659 HZ3 LYS 659 -26.928 -6.202 -3.888 482 H SER 660 H SER 660 -21.029 -4.633 -7.040 483 HA SER 660 HA SER 660 -18.997 -6.550 -7.194 484 HB2 SER 660 HB2 SER 660 -20.725 -5.983 -8.917 485 HB3 SER 660 HB3 SER 660 -19.807 -4.519 -9.312 486 HG SER 660 HG SER 660 -19.521 -6.515 -10.587 487 H ASN 661 H ASN 661 -18.726 -2.979 -7.214 488 HA ASN 661 HA ASN 661 -16.074 -2.815 -8.243 489 HB2 ASN 661 HB2 ASN 661 -17.925 -0.907 -7.395 490 HB3 ASN 661 HB3 ASN 661 -16.738 -0.840 -6.158 491 HD21 ASN 661 HD21 ASN 661 -14.353 -1.503 -7.573 492 HD22 ASN 661 HD22 ASN 661 -14.033 -0.194 -8.713 493 H ILE 662 H ILE 662 -17.470 -3.322 -4.994 494 HA ILE 662 HA ILE 662 -15.037 -2.553 -3.545 495 HB ILE 662 HB ILE 662 -17.789 -3.669 -2.822 496 HG12 ILE 662 HG12 ILE 662 -16.803 -1.061 -1.779 497 HG13 ILE 662 HG13 ILE 662 -17.065 -1.097 -3.503 498 HG21 ILE 662 HG21 ILE 662 -15.493 -3.060 -0.939 499 HG22 ILE 662 HG22 ILE 662 -17.186 -3.236 -0.422 500 HG23 ILE 662 HG23 ILE 662 -16.354 -4.599 -1.161 501 HD11 ILE 662 HD11 ILE 662 -19.181 -1.758 -1.430 502 HD12 ILE 662 HD12 ILE 662 -19.124 -0.345 -2.509 503 HD13 ILE 662 HD13 ILE 662 -19.370 -1.941 -3.184 504 H GLU 663 H GLU 663 -16.948 -5.285 -4.583 505 HA GLU 663 HA GLU 663 -15.523 -7.324 -3.113 506 HB2 GLU 663 HB2 GLU 663 -17.344 -7.448 -5.559 507 HB3 GLU 663 HB3 GLU 663 -16.749 -8.869 -4.677 508 HG2 GLU 663 HG2 GLU 663 -17.797 -8.021 -2.597 509 HG3 GLU 663 HG3 GLU 663 -18.374 -6.616 -3.383 510 H LYS 664 H LYS 664 -15.328 -6.157 -6.525 511 HA LYS 664 HA LYS 664 -13.088 -7.893 -7.040 512 HB2 LYS 664 HB2 LYS 664 -13.013 -7.071 -9.210 513 HB3 LYS 664 HB3 LYS 664 -14.709 -7.153 -8.752 514 HG2 LYS 664 HG2 LYS 664 -14.306 -4.566 -8.169 515 HG3 LYS 664 HG3 LYS 664 -12.971 -4.748 -9.307 516 HD2 LYS 664 HD2 LYS 664 -15.935 -5.276 -9.800 517 HD3 LYS 664 HD3 LYS 664 -14.993 -3.928 -10.437 518 HE2 LYS 664 HE2 LYS 664 -13.720 -5.419 -11.877 519 HE3 LYS 664 HE3 LYS 664 -14.415 -6.847 -11.089 520 HZ1 LYS 664 HZ1 LYS 664 -15.526 -6.411 -13.153 521 HZ2 LYS 664 HZ2 LYS 664 -15.937 -4.887 -12.680 522 HZ3 LYS 664 HZ3 LYS 664 -16.576 -6.189 -11.903 523 H LEU 665 H LEU 665 -13.300 -4.462 -5.935 524 HA LEU 665 HA LEU 665 -10.475 -4.026 -6.231 525 HB2 LEU 665 HB2 LEU 665 -12.604 -2.681 -4.541 526 HB3 LEU 665 HB3 LEU 665 -10.907 -2.290 -4.328 527 HG LEU 665 HG LEU 665 -12.280 -2.076 -7.039 528 HD11 LEU 665 HD11 LEU 665 -12.388 0.333 -6.646 529 HD12 LEU 665 HD12 LEU 665 -11.674 0.138 -5.039 530 HD13 LEU 665 HD13 LEU 665 -13.295 -0.514 -5.375 531 HD21 LEU 665 HD21 LEU 665 -9.618 -1.017 -5.984 532 HD22 LEU 665 HD22 LEU 665 -10.328 -0.598 -7.557 533 HD23 LEU 665 HD23 LEU 665 -9.837 -2.257 -7.233 534 H LEU 666 H LEU 666 -12.375 -5.027 -3.259 535 HA LEU 666 HA LEU 666 -9.876 -5.330 -1.868 536 HB2 LEU 666 HB2 LEU 666 -11.046 -6.194 -0.009 537 HB3 LEU 666 HB3 LEU 666 -11.830 -4.782 -0.676 538 HG LEU 666 HG LEU 666 -13.340 -6.651 -1.914 539 HD11 LEU 666 HD11 LEU 666 -13.797 -8.545 -0.431 540 HD12 LEU 666 HD12 LEU 666 -12.512 -8.014 0.673 541 HD13 LEU 666 HD13 LEU 666 -12.108 -8.594 -0.957 542 HD21 LEU 666 HD21 LEU 666 -14.982 -6.311 -0.204 543 HD22 LEU 666 HD22 LEU 666 -14.058 -4.820 -0.382 544 HD23 LEU 666 HD23 LEU 666 -13.730 -5.885 0.999 545 H THR 667 H THR 667 -11.678 -7.529 -3.968 546 HA THR 667 HA THR 667 -10.066 -9.836 -3.474 547 HB THR 667 HB THR 667 -11.413 -8.837 -5.995 548 HG1 THR 667 HG1 THR 667 -12.886 -9.370 -4.616 549 HG21 THR 667 HG21 THR 667 -11.147 -11.309 -6.691 550 HG22 THR 667 HG22 THR 667 -9.800 -11.351 -5.524 551 HG23 THR 667 HG23 THR 667 -9.750 -10.232 -6.872 552 H ASP 668 H ASP 668 -9.532 -7.091 -5.854 553 HA ASP 668 HA ASP 668 -7.003 -8.002 -6.742 554 HB2 ASP 668 HB2 ASP 668 -8.168 -6.274 -7.941 555 HB3 ASP 668 HB3 ASP 668 -8.189 -5.211 -6.534 556 H MET 669 H MET 669 -7.913 -5.912 -3.988 557 HA MET 669 HA MET 669 -5.334 -5.349 -3.134 558 HB2 MET 669 HB2 MET 669 -7.845 -5.668 -1.452 559 HB3 MET 669 HB3 MET 669 -6.355 -4.975 -0.873 560 HG2 MET 669 HG2 MET 669 -6.729 -3.521 -3.172 561 HG3 MET 669 HG3 MET 669 -8.376 -3.758 -2.633 562 HE1 MET 669 HE1 MET 669 -6.678 -0.131 -1.615 563 HE2 MET 669 HE2 MET 669 -5.707 -1.265 -2.573 564 HE3 MET 669 HE3 MET 669 -7.416 -0.984 -2.992 565 H ARG 670 H ARG 670 -7.355 -8.109 -1.960 566 HA ARG 670 HA ARG 670 -5.170 -9.211 -0.446 567 HB2 ARG 670 HB2 ARG 670 -6.515 -11.105 0.006 568 HB3 ARG 670 HB3 ARG 670 -7.565 -9.700 0.072 569 HG2 ARG 670 HG2 ARG 670 -8.734 -10.274 -1.815 570 HG3 ARG 670 HG3 ARG 670 -7.460 -11.266 -2.506 571 HD2 ARG 670 HD2 ARG 670 -8.150 -13.147 -1.493 572 HD3 ARG 670 HD3 ARG 670 -8.385 -12.346 0.061 573 HE ARG 670 HE ARG 670 -10.615 -12.089 -0.349 574 HH11 ARG 670 HH11 ARG 670 -9.208 -13.135 -3.399 575 HH12 ARG 670 HH12 ARG 670 -10.629 -12.743 -4.331 576 HH21 ARG 670 HH21 ARG 670 -12.371 -11.432 -1.551 577 HH22 ARG 670 HH22 ARG 670 -12.311 -11.418 -3.306 578 H LYS 671 H LYS 671 -5.853 -9.291 -3.815 579 HA LYS 671 HA LYS 671 -4.371 -11.803 -4.232 580 HB2 LYS 671 HB2 LYS 671 -6.463 -11.056 -5.512 581 HB3 LYS 671 HB3 LYS 671 -5.435 -9.861 -6.324 582 HG2 LYS 671 HG2 LYS 671 -3.979 -11.833 -7.059 583 HG3 LYS 671 HG3 LYS 671 -5.213 -12.901 -6.355 584 HD2 LYS 671 HD2 LYS 671 -6.923 -11.881 -7.868 585 HD3 LYS 671 HD3 LYS 671 -5.657 -10.846 -8.572 586 HE2 LYS 671 HE2 LYS 671 -4.396 -12.913 -9.224 587 HE3 LYS 671 HE3 LYS 671 -5.738 -13.896 -8.614 588 HZ1 LYS 671 HZ1 LYS 671 -5.909 -11.929 -10.812 589 HZ2 LYS 671 HZ2 LYS 671 -7.164 -12.836 -10.249 590 HZ3 LYS 671 HZ3 LYS 671 -5.886 -13.564 -10.988 591 H SER 672 H SER 672 -3.946 -8.322 -4.725 592 HA SER 672 HA SER 672 -1.367 -8.494 -6.026 593 HB2 SER 672 HB2 SER 672 -3.155 -6.749 -6.391 594 HB3 SER 672 HB3 SER 672 -2.833 -6.131 -4.764 595 HG SER 672 HG SER 672 -1.745 -5.079 -6.556 596 H GLY 673 H GLY 673 -2.571 -8.070 -2.667 597 HA2 GLY 673 HA2 GLY 673 -1.170 -8.932 -0.890 598 HA3 GLY 673 HA3 GLY 673 0.268 -8.339 -1.733 599 H ILE 674 H ILE 674 -2.658 -6.392 -1.554 600 HA ILE 674 HA ILE 674 -1.374 -4.283 0.031 601 HB ILE 674 HB ILE 674 -4.296 -4.635 -0.589 602 HG12 ILE 674 HG12 ILE 674 -3.225 -4.850 -2.781 603 HG13 ILE 674 HG13 ILE 674 -4.381 -3.544 -2.575 604 HG21 ILE 674 HG21 ILE 674 -3.756 -2.877 1.007 605 HG22 ILE 674 HG22 ILE 674 -2.632 -2.137 -0.145 606 HG23 ILE 674 HG23 ILE 674 -4.375 -2.171 -0.492 607 HD11 ILE 674 HD11 ILE 674 -2.548 -2.928 -3.986 608 HD12 ILE 674 HD12 ILE 674 -2.685 -1.888 -2.561 609 HD13 ILE 674 HD13 ILE 674 -1.410 -3.156 -2.626 610 H ILE 675 H ILE 675 -3.835 -6.890 0.342 611 HA ILE 675 HA ILE 675 -3.816 -6.675 3.297 612 HB ILE 675 HB ILE 675 -6.247 -6.614 3.363 613 HG12 ILE 675 HG12 ILE 675 -6.228 -6.833 0.375 614 HG13 ILE 675 HG13 ILE 675 -6.736 -8.081 1.507 615 HG21 ILE 675 HG21 ILE 675 -5.627 -4.518 1.279 616 HG22 ILE 675 HG22 ILE 675 -6.643 -4.400 2.713 617 HG23 ILE 675 HG23 ILE 675 -4.907 -4.435 2.882 618 HD11 ILE 675 HD11 ILE 675 -8.688 -7.063 0.585 619 HD12 ILE 675 HD12 ILE 675 -8.571 -6.620 2.297 620 HD13 ILE 675 HD13 ILE 675 -8.138 -5.439 1.030 621 H TYR 676 H TYR 676 -5.318 -8.665 4.079 622 HA TYR 676 HA TYR 676 -5.337 -10.881 2.181 623 HB2 TYR 676 HB2 TYR 676 -4.606 -12.419 4.154 624 HB3 TYR 676 HB3 TYR 676 -3.430 -11.637 3.117 625 HD1 TYR 676 HD1 TYR 676 -5.174 -10.991 6.428 626 HD2 TYR 676 HD2 TYR 676 -1.553 -10.749 4.093 627 HE1 TYR 676 HE1 TYR 676 -3.944 -10.160 8.413 628 HE2 TYR 676 HE2 TYR 676 -0.333 -9.906 6.070 629 HH TYR 676 HH TYR 676 -0.720 -8.693 8.028 630 H GLU 677 H GLU 677 -6.664 -12.718 3.173 631 HA GLU 677 HA GLU 677 -9.011 -11.722 4.609 632 HB2 GLU 677 HB2 GLU 677 -8.356 -14.077 3.020 633 HB3 GLU 677 HB3 GLU 677 -8.948 -14.585 4.595 634 HG2 GLU 677 HG2 GLU 677 -10.328 -12.533 2.841 635 HG3 GLU 677 HG3 GLU 677 -10.692 -14.263 2.817 636 H ALA 678 H ALA 678 -9.566 -12.933 6.671 637 HA ALA 678 HA ALA 678 -7.290 -14.156 8.026 638 HB1 ALA 678 HB1 ALA 678 -8.648 -11.745 9.318 639 HB2 ALA 678 HB2 ALA 678 -7.408 -12.773 10.067 640 HB3 ALA 678 HB3 ALA 678 -6.995 -11.773 8.659 641 H LYS 679 H LYS 679 -10.781 -13.439 8.001 642 HA LYS 679 HA LYS 679 -11.249 -16.082 9.130 643 HB2 LYS 679 HB2 LYS 679 -12.569 -13.651 10.446 644 HB3 LYS 679 HB3 LYS 679 -12.925 -15.344 10.766 645 HG2 LYS 679 HG2 LYS 679 -10.601 -15.616 11.685 646 HG3 LYS 679 HG3 LYS 679 -10.339 -13.875 11.427 647 HD2 LYS 679 HD2 LYS 679 -12.330 -13.409 12.897 648 HD3 LYS 679 HD3 LYS 679 -12.424 -15.150 13.247 649 HE2 LYS 679 HE2 LYS 679 -10.054 -15.039 14.109 650 HE3 LYS 679 HE3 LYS 679 -10.071 -13.294 13.810 651 HZ1 LYS 679 HZ1 LYS 679 -11.940 -13.117 15.388 652 HZ2 LYS 679 HZ2 LYS 679 -10.611 -13.521 16.058 653 HZ3 LYS 679 HZ3 LYS 679 -11.745 -14.728 15.789 654 HA PRO 680 HA PRO 680 -13.200 -15.287 5.339 655 HB2 PRO 680 HB2 PRO 680 -15.255 -17.201 5.196 656 HB3 PRO 680 HB3 PRO 680 -13.527 -17.442 4.803 657 HG2 PRO 680 HG2 PRO 680 -14.962 -18.028 7.399 658 HG3 PRO 680 HG3 PRO 680 -13.754 -19.039 6.542 659 HD2 PRO 680 HD2 PRO 680 -13.034 -17.526 8.658 660 HD3 PRO 680 HD3 PRO 680 -11.962 -17.612 7.222 661 H GLU 681 H GLU 681 -13.963 -13.505 5.069 662 HA GLU 681 HA GLU 681 -15.690 -12.091 4.409 663 HB2 GLU 681 HB2 GLU 681 -17.065 -12.881 7.003 664 HB3 GLU 681 HB3 GLU 681 -17.407 -11.403 6.142 665 HG2 GLU 681 HG2 GLU 681 -17.691 -13.014 4.037 666 HG3 GLU 681 HG3 GLU 681 -18.098 -14.183 5.297 667 H CYS 682 H CYS 682 -13.328 -12.327 6.790 668 HA CYS 682 HA CYS 682 -13.520 -9.454 7.536 669 HB2 CYS 682 HB2 CYS 682 -14.394 -11.255 9.147 670 HB3 CYS 682 HB3 CYS 682 -12.716 -11.717 9.366 671 H TYR 683 H TYR 683 -11.960 -8.649 6.328 672 HA TYR 683 HA TYR 683 -9.447 -10.062 5.729 673 HB2 TYR 683 HB2 TYR 683 -10.720 -7.450 4.790 674 HB3 TYR 683 HB3 TYR 683 -9.142 -7.999 4.274 675 HD1 TYR 683 HD2 TYR 683 -12.704 -9.378 4.441 676 HD2 TYR 683 HD1 TYR 683 -9.002 -9.045 2.235 677 HE1 TYR 683 HE2 TYR 683 -13.649 -10.762 2.682 678 HE2 TYR 683 HE1 TYR 683 -10.011 -10.251 0.369 679 HH TYR 683 HH TYR 683 -13.204 -11.879 0.746 680 H LYS 684 H LYS 684 -7.325 -8.845 5.948 681 HA LYS 684 HA LYS 684 -7.522 -6.473 7.704 682 HB2 LYS 684 HB2 LYS 684 -6.773 -8.760 8.976 683 HB3 LYS 684 HB3 LYS 684 -5.235 -8.338 8.232 684 HG2 LYS 684 HG2 LYS 684 -6.099 -5.908 9.360 685 HG3 LYS 684 HG3 LYS 684 -6.700 -7.114 10.486 686 HD2 LYS 684 HD2 LYS 684 -4.581 -6.705 11.380 687 HD3 LYS 684 HD3 LYS 684 -4.221 -8.085 10.335 688 HE2 LYS 684 HE2 LYS 684 -3.917 -6.012 8.571 689 HE3 LYS 684 HE3 LYS 684 -3.494 -5.168 10.057 690 HZ1 LYS 684 HZ1 LYS 684 -1.706 -6.796 10.354 691 HZ2 LYS 684 HZ2 LYS 684 -1.599 -6.152 8.824 692 HZ3 LYS 684 HZ3 LYS 684 -2.207 -7.629 9.009 693 H LYS 685 H LYS 685 -5.705 -5.051 7.346 694 HA LYS 685 HA LYS 685 -4.441 -4.915 4.838 695 HB2 LYS 685 HB2 LYS 685 -4.650 -3.219 6.841 696 HB3 LYS 685 HB3 LYS 685 -3.243 -4.044 7.489 697 HG2 LYS 685 HG2 LYS 685 -2.381 -2.194 6.452 698 HG3 LYS 685 HG3 LYS 685 -2.053 -3.443 5.267 699 HD2 LYS 685 HD2 LYS 685 -3.797 -2.692 3.814 700 HD3 LYS 685 HD3 LYS 685 -4.557 -1.697 5.073 701 HE2 LYS 685 HE2 LYS 685 -1.758 -1.236 3.995 702 HE3 LYS 685 HE3 LYS 685 -3.185 -0.412 3.350 703 HZ1 LYS 685 HZ1 LYS 685 -3.526 0.715 5.400 704 HZ2 LYS 685 HZ2 LYS 685 -1.873 0.763 5.236 705 HZ3 LYS 685 HZ3 LYS 685 -2.717 -0.288 6.242 706 H VAL 686 H VAL 686 -2.022 -5.417 4.309 707 HA VAL 686 HA VAL 686 -1.075 -7.851 5.308 708 HB VAL 686 HB VAL 686 1.222 -6.993 4.845 709 HG11 VAL 686 HG11 VAL 686 -0.050 -8.344 3.284 710 HG12 VAL 686 HG12 VAL 686 -0.846 -6.901 2.637 711 HG13 VAL 686 HG13 VAL 686 0.901 -7.125 2.425 712 HG21 VAL 686 HG21 VAL 686 0.775 -4.556 5.151 713 HG22 VAL 686 HG22 VAL 686 1.511 -4.941 3.584 714 HG23 VAL 686 HG23 VAL 686 -0.217 -4.575 3.677 Start of MODEL 4 1 H1 GLY 600 H1 GLY 600 -4.632 7.222 5.319 2 H2 GLY 600 H2 GLY 600 -3.420 7.335 4.223 3 H3 GLY 600 H3 GLY 600 -3.332 6.189 5.393 4 HA2 GLY 600 HA2 GLY 600 -3.308 9.078 5.902 5 HA3 GLY 600 HA3 GLY 600 -3.027 7.790 7.096 6 H SER 601 H SER 601 -1.098 9.860 6.693 7 HA SER 601 HA SER 601 0.779 9.454 4.729 8 HB2 SER 601 HB2 SER 601 1.290 10.497 7.543 9 HB3 SER 601 HB3 SER 601 2.113 10.970 6.044 10 HG SER 601 HG SER 601 0.530 12.496 6.608 11 H HIS 602 H HIS 602 3.009 8.729 4.849 12 HA HIS 602 HA HIS 602 3.910 7.037 7.029 13 HB2 HIS 602 HB2 HIS 602 3.939 6.213 4.081 14 HB3 HIS 602 HB3 HIS 602 4.996 5.518 5.298 15 HD1 HIS 602 HD1 HIS 602 1.640 5.818 6.836 16 HD2 HIS 602 HD2 HIS 602 3.684 3.237 4.205 17 HE1 HIS 602 HE1 HIS 602 0.389 3.576 6.869 18 H MET 603 H MET 603 6.417 6.927 6.772 19 HA MET 603 HA MET 603 7.570 8.990 5.049 20 HB2 MET 603 HB2 MET 603 7.892 8.994 8.099 21 HB3 MET 603 HB3 MET 603 8.848 9.943 6.959 22 HG2 MET 603 HG2 MET 603 7.399 11.486 7.684 23 HG3 MET 603 HG3 MET 603 6.586 10.964 6.212 24 HE1 MET 603 HE1 MET 603 4.789 12.534 7.543 25 HE2 MET 603 HE2 MET 603 4.019 12.062 9.087 26 HE3 MET 603 HE3 MET 603 5.741 12.524 9.049 27 H GLY 604 H GLY 604 9.861 8.702 4.859 28 HA2 GLY 604 HA2 GLY 604 11.899 7.635 4.978 29 HA3 GLY 604 HA3 GLY 604 11.229 6.442 6.109 30 H GLU 605 H GLU 605 12.902 5.784 3.863 31 HA GLU 605 HA GLU 605 11.159 4.605 1.834 32 HB2 GLU 605 HB2 GLU 605 13.429 5.636 1.389 33 HB3 GLU 605 HB3 GLU 605 14.165 4.249 2.194 34 HG2 GLU 605 HG2 GLU 605 13.051 2.738 0.519 35 HG3 GLU 605 HG3 GLU 605 12.317 4.146 -0.244 36 H SER 606 H SER 606 10.053 3.644 3.938 37 HA SER 606 HA SER 606 11.174 1.242 5.093 38 HB2 SER 606 HB2 SER 606 8.715 0.890 5.706 39 HB3 SER 606 HB3 SER 606 9.472 2.385 6.288 40 HG SER 606 HG SER 606 7.573 3.011 5.408 41 H GLY 607 H GLY 607 9.470 2.027 2.142 42 HA2 GLY 607 HA2 GLY 607 10.586 -0.262 0.895 43 HA3 GLY 607 HA3 GLY 607 8.798 -0.263 0.818 44 H LYS 608 H LYS 608 10.341 0.136 -1.547 45 HA LYS 608 HA LYS 608 10.556 3.039 -1.971 46 HB2 LYS 608 HB2 LYS 608 11.046 0.867 -4.020 47 HB3 LYS 608 HB3 LYS 608 11.598 2.547 -4.013 48 HG2 LYS 608 HG2 LYS 608 12.867 1.828 -1.812 49 HG3 LYS 608 HG3 LYS 608 12.654 0.195 -2.452 50 HD2 LYS 608 HD2 LYS 608 14.116 2.548 -3.704 51 HD3 LYS 608 HD3 LYS 608 14.780 0.976 -3.238 52 HE2 LYS 608 HE2 LYS 608 13.285 -0.084 -5.006 53 HE3 LYS 608 HE3 LYS 608 12.784 1.533 -5.493 54 HZ1 LYS 608 HZ1 LYS 608 15.563 0.534 -5.577 55 HZ2 LYS 608 HZ2 LYS 608 15.079 2.043 -6.015 56 HZ3 LYS 608 HZ3 LYS 608 14.575 0.738 -6.881 57 H ILE 609 H ILE 609 7.828 1.247 -2.031 58 HA ILE 609 HA ILE 609 6.969 1.677 -4.765 59 HB ILE 609 HB ILE 609 5.265 1.103 -2.325 60 HG12 ILE 609 HG12 ILE 609 6.872 -0.736 -2.607 61 HG13 ILE 609 HG13 ILE 609 5.214 -1.232 -2.875 62 HG21 ILE 609 HG21 ILE 609 4.625 0.950 -5.292 63 HG22 ILE 609 HG22 ILE 609 3.596 0.249 -4.015 64 HG23 ILE 609 HG23 ILE 609 3.881 1.988 -4.069 65 HD11 ILE 609 HD11 ILE 609 7.238 -0.682 -5.089 66 HD12 ILE 609 HD12 ILE 609 6.746 -2.277 -4.486 67 HD13 ILE 609 HD13 ILE 609 5.566 -1.257 -5.316 68 H ASP 610 H ASP 610 6.937 3.784 -5.357 69 HA ASP 610 HA ASP 610 6.053 5.925 -3.683 70 HB2 ASP 610 HB2 ASP 610 5.849 6.120 -6.678 71 HB3 ASP 610 HB3 ASP 610 6.400 7.320 -5.524 72 H ILE 611 H ILE 611 4.191 7.350 -4.403 73 HA ILE 611 HA ILE 611 1.743 5.902 -5.265 74 HB ILE 611 HB ILE 611 2.359 8.814 -4.637 75 HG12 ILE 611 HG12 ILE 611 0.385 7.306 -2.951 76 HG13 ILE 611 HG13 ILE 611 2.042 6.757 -2.789 77 HG21 ILE 611 HG21 ILE 611 -0.321 7.535 -5.323 78 HG22 ILE 611 HG22 ILE 611 -0.118 9.171 -4.638 79 HG23 ILE 611 HG23 ILE 611 0.540 8.798 -6.232 80 HD11 ILE 611 HD11 ILE 611 1.563 8.496 -1.149 81 HD12 ILE 611 HD12 ILE 611 2.817 9.029 -2.286 82 HD13 ILE 611 HD13 ILE 611 1.153 9.642 -2.451 83 H ASP 612 H ASP 612 4.240 8.169 -6.385 84 HA ASP 612 HA ASP 612 3.156 9.111 -8.680 85 HB2 ASP 612 HB2 ASP 612 6.060 8.539 -8.004 86 HB3 ASP 612 HB3 ASP 612 5.489 9.662 -9.255 87 H THR 613 H THR 613 5.147 6.233 -8.260 88 HA THR 613 HA THR 613 5.384 5.377 -10.960 89 HB THR 613 HB THR 613 6.660 4.804 -8.824 90 HG1 THR 613 HG1 THR 613 7.458 3.064 -9.743 91 HG21 THR 613 HG21 THR 613 4.732 3.925 -7.513 92 HG22 THR 613 HG22 THR 613 6.134 2.851 -7.577 93 HG23 THR 613 HG23 THR 613 4.710 2.504 -8.581 94 H ILE 614 H ILE 614 2.652 5.394 -8.917 95 HA ILE 614 HA ILE 614 1.267 3.260 -10.405 96 HB ILE 614 HB ILE 614 0.232 4.863 -8.039 97 HG12 ILE 614 HG12 ILE 614 2.271 3.811 -7.276 98 HG13 ILE 614 HG13 ILE 614 0.869 3.071 -6.542 99 HG21 ILE 614 HG21 ILE 614 -1.527 3.786 -9.294 100 HG22 ILE 614 HG22 ILE 614 -0.685 2.223 -9.213 101 HG23 ILE 614 HG23 ILE 614 -1.310 2.981 -7.736 102 HD11 ILE 614 HD11 ILE 614 2.555 1.424 -7.214 103 HD12 ILE 614 HD12 ILE 614 1.029 1.164 -8.094 104 HD13 ILE 614 HD13 ILE 614 2.412 1.935 -8.909 105 H MET 615 H MET 615 0.768 6.616 -9.324 106 HA MET 615 HA MET 615 -1.507 6.947 -11.056 107 HB2 MET 615 HB2 MET 615 -1.599 9.232 -10.250 108 HB3 MET 615 HB3 MET 615 -1.173 8.165 -8.914 109 HG2 MET 615 HG2 MET 615 0.296 9.903 -8.563 110 HG3 MET 615 HG3 MET 615 1.293 8.799 -9.502 111 HE1 MET 615 HE1 MET 615 2.446 11.495 -9.159 112 HE2 MET 615 HE2 MET 615 3.119 10.466 -10.449 113 HE3 MET 615 HE3 MET 615 2.725 12.162 -10.783 114 H THR 616 H THR 616 1.941 7.373 -11.685 115 HA THR 616 HA THR 616 1.624 9.080 -13.912 116 HB THR 616 HB THR 616 3.783 8.647 -12.751 117 HG1 THR 616 HG1 THR 616 3.476 8.346 -15.524 118 HG21 THR 616 HG21 THR 616 3.580 6.091 -12.673 119 HG22 THR 616 HG22 THR 616 5.131 6.713 -13.259 120 HG23 THR 616 HG23 THR 616 3.935 6.078 -14.405 121 H GLY 617 H GLY 617 0.684 5.792 -13.574 122 HA2 GLY 617 HA2 GLY 617 0.173 5.598 -16.508 123 HA3 GLY 617 HA3 GLY 617 1.060 4.304 -15.701 124 H LYS 618 H LYS 618 -1.148 5.407 -13.410 125 HA LYS 618 HA LYS 618 -3.381 3.717 -14.395 126 HB2 LYS 618 HB2 LYS 618 -2.254 3.995 -11.569 127 HB3 LYS 618 HB3 LYS 618 -3.804 3.320 -11.922 128 HG2 LYS 618 HG2 LYS 618 -2.510 1.400 -11.715 129 HG3 LYS 618 HG3 LYS 618 -2.513 1.612 -13.472 130 HD2 LYS 618 HD2 LYS 618 -0.271 2.673 -13.329 131 HD3 LYS 618 HD3 LYS 618 -0.367 2.582 -11.567 132 HE2 LYS 618 HE2 LYS 618 -0.227 0.166 -11.631 133 HE3 LYS 618 HE3 LYS 618 -0.209 0.191 -13.405 134 HZ1 LYS 618 HZ1 LYS 618 1.855 1.406 -13.333 135 HZ2 LYS 618 HZ2 LYS 618 2.029 0.044 -12.432 136 HZ3 LYS 618 HZ3 LYS 618 1.846 1.510 -11.708 137 HA PRO 619 HA PRO 619 -5.577 7.483 -13.944 138 HB2 PRO 619 HB2 PRO 619 -8.147 6.685 -13.338 139 HB3 PRO 619 HB3 PRO 619 -7.394 6.444 -14.945 140 HG2 PRO 619 HG2 PRO 619 -7.578 4.454 -12.656 141 HG3 PRO 619 HG3 PRO 619 -7.987 4.191 -14.385 142 HD2 PRO 619 HD2 PRO 619 -5.599 3.441 -13.355 143 HD3 PRO 619 HD3 PRO 619 -5.695 4.137 -14.999 144 H LYS 620 H LYS 620 -6.242 9.007 -12.381 145 HA LYS 620 HA LYS 620 -5.503 8.645 -9.693 146 HB2 LYS 620 HB2 LYS 620 -7.455 10.636 -10.928 147 HB3 LYS 620 HB3 LYS 620 -6.881 10.711 -9.258 148 HG2 LYS 620 HG2 LYS 620 -4.533 10.914 -10.050 149 HG3 LYS 620 HG3 LYS 620 -5.090 10.826 -11.724 150 HD2 LYS 620 HD2 LYS 620 -4.671 13.121 -11.213 151 HD3 LYS 620 HD3 LYS 620 -6.421 12.915 -11.376 152 HE2 LYS 620 HE2 LYS 620 -6.640 12.845 -8.899 153 HE3 LYS 620 HE3 LYS 620 -4.882 12.994 -8.736 154 HZ1 LYS 620 HZ1 LYS 620 -5.031 15.158 -9.783 155 HZ2 LYS 620 HZ2 LYS 620 -5.985 15.105 -8.445 156 HZ3 LYS 620 HZ3 LYS 620 -6.665 15.020 -9.939 157 H SER 621 H SER 621 -8.495 7.766 -11.252 158 HA SER 621 HA SER 621 -10.233 7.456 -9.041 159 HB2 SER 621 HB2 SER 621 -10.800 7.411 -11.486 160 HB3 SER 621 HB3 SER 621 -10.086 5.792 -11.587 161 HG SER 621 HG SER 621 -12.403 5.904 -11.272 162 H ALA 622 H ALA 622 -7.510 5.404 -10.173 163 HA ALA 622 HA ALA 622 -8.297 2.958 -8.969 164 HB1 ALA 622 HB1 ALA 622 -6.508 3.117 -10.659 165 HB2 ALA 622 HB2 ALA 622 -5.499 4.056 -9.541 166 HB3 ALA 622 HB3 ALA 622 -5.902 2.369 -9.167 167 H ARG 623 H ARG 623 -5.835 5.299 -7.775 168 HA ARG 623 HA ARG 623 -5.933 4.338 -5.067 169 HB2 ARG 623 HB2 ARG 623 -4.845 6.523 -4.475 170 HB3 ARG 623 HB3 ARG 623 -3.997 5.653 -5.750 171 HG2 ARG 623 HG2 ARG 623 -4.654 7.165 -7.377 172 HG3 ARG 623 HG3 ARG 623 -6.078 7.629 -6.503 173 HD2 ARG 623 HD2 ARG 623 -3.374 8.498 -5.544 174 HD3 ARG 623 HD3 ARG 623 -4.300 9.405 -6.747 175 HE ARG 623 HE ARG 623 -4.707 9.431 -3.944 176 HH11 ARG 623 HH11 ARG 623 -6.874 9.306 -6.898 177 HH12 ARG 623 HH12 ARG 623 -8.064 10.242 -6.000 178 HH21 ARG 623 HH21 ARG 623 -6.582 10.597 -3.005 179 HH22 ARG 623 HH22 ARG 623 -7.979 10.773 -4.074 180 H GLU 624 H GLU 624 -8.003 6.785 -6.769 181 HA GLU 624 HA GLU 624 -8.980 7.938 -4.452 182 HB2 GLU 624 HB2 GLU 624 -9.426 8.660 -6.866 183 HB3 GLU 624 HB3 GLU 624 -10.673 7.420 -6.927 184 HG2 GLU 624 HG2 GLU 624 -11.618 9.630 -6.538 185 HG3 GLU 624 HG3 GLU 624 -11.930 8.557 -5.178 186 H LYS 625 H LYS 625 -9.898 4.924 -5.996 187 HA LYS 625 HA LYS 625 -12.008 4.250 -4.027 188 HB2 LYS 625 HB2 LYS 625 -10.711 2.709 -6.320 189 HB3 LYS 625 HB3 LYS 625 -12.007 2.071 -5.301 190 HG2 LYS 625 HG2 LYS 625 -13.584 3.697 -6.093 191 HG3 LYS 625 HG3 LYS 625 -12.327 4.644 -6.904 192 HD2 LYS 625 HD2 LYS 625 -11.863 2.789 -8.444 193 HD3 LYS 625 HD3 LYS 625 -13.124 1.804 -7.683 194 HE2 LYS 625 HE2 LYS 625 -13.630 4.535 -8.947 195 HE3 LYS 625 HE3 LYS 625 -13.734 3.019 -9.854 196 HZ1 LYS 625 HZ1 LYS 625 -15.365 3.616 -7.474 197 HZ2 LYS 625 HZ2 LYS 625 -15.457 2.258 -8.418 198 HZ3 LYS 625 HZ3 LYS 625 -15.888 3.721 -9.033 199 H MET 626 H MET 626 -8.702 3.008 -4.932 200 HA MET 626 HA MET 626 -8.858 0.858 -3.081 201 HB2 MET 626 HB2 MET 626 -6.524 2.105 -4.587 202 HB3 MET 626 HB3 MET 626 -6.402 0.622 -3.636 203 HG2 MET 626 HG2 MET 626 -8.086 -0.464 -5.037 204 HG3 MET 626 HG3 MET 626 -8.339 1.010 -5.950 205 HE1 MET 626 HE1 MET 626 -6.291 -2.244 -5.573 206 HE2 MET 626 HE2 MET 626 -4.769 -1.890 -6.399 207 HE3 MET 626 HE3 MET 626 -5.108 -1.137 -4.826 208 H MET 627 H MET 627 -7.524 4.170 -2.797 209 HA MET 627 HA MET 627 -6.054 3.730 -0.421 210 HB2 MET 627 HB2 MET 627 -7.355 6.243 -1.529 211 HB3 MET 627 HB3 MET 627 -6.321 6.230 -0.114 212 HG2 MET 627 HG2 MET 627 -5.403 5.216 -2.827 213 HG3 MET 627 HG3 MET 627 -5.181 6.869 -2.282 214 HE1 MET 627 HE1 MET 627 -1.554 5.372 -2.179 215 HE2 MET 627 HE2 MET 627 -2.840 4.987 -3.345 216 HE3 MET 627 HE3 MET 627 -2.593 6.668 -2.810 217 H LYS 628 H LYS 628 -9.379 4.566 -1.087 218 HA LYS 628 HA LYS 628 -10.210 5.026 1.684 219 HB2 LYS 628 HB2 LYS 628 -11.901 4.268 -0.752 220 HB3 LYS 628 HB3 LYS 628 -12.552 4.609 0.853 221 HG2 LYS 628 HG2 LYS 628 -11.668 6.885 0.795 222 HG3 LYS 628 HG3 LYS 628 -10.872 6.544 -0.756 223 HD2 LYS 628 HD2 LYS 628 -13.117 6.162 -1.793 224 HD3 LYS 628 HD3 LYS 628 -13.888 6.552 -0.250 225 HE2 LYS 628 HE2 LYS 628 -13.852 8.442 -1.916 226 HE3 LYS 628 HE3 LYS 628 -13.128 8.846 -0.347 227 HZ1 LYS 628 HZ1 LYS 628 -11.798 9.482 -2.470 228 HZ2 LYS 628 HZ2 LYS 628 -11.498 7.879 -2.594 229 HZ3 LYS 628 HZ3 LYS 628 -10.998 8.694 -1.264 230 H ILE 629 H ILE 629 -10.382 2.223 -0.573 231 HA ILE 629 HA ILE 629 -11.504 0.456 1.314 232 HB ILE 629 HB ILE 629 -9.663 -0.192 -1.015 233 HG12 ILE 629 HG12 ILE 629 -12.698 -0.501 -0.757 234 HG13 ILE 629 HG13 ILE 629 -11.942 0.915 -1.472 235 HG21 ILE 629 HG21 ILE 629 -11.385 -2.054 0.699 236 HG22 ILE 629 HG22 ILE 629 -10.556 -2.526 -0.799 237 HG23 ILE 629 HG23 ILE 629 -9.614 -2.058 0.604 238 HD11 ILE 629 HD11 ILE 629 -11.813 -1.917 -2.546 239 HD12 ILE 629 HD12 ILE 629 -12.587 -0.496 -3.260 240 HD13 ILE 629 HD13 ILE 629 -10.815 -0.573 -3.151 241 H ILE 630 H ILE 630 -7.923 0.745 0.617 242 HA ILE 630 HA ILE 630 -7.245 -0.876 2.818 243 HB ILE 630 HB ILE 630 -4.978 0.049 2.730 244 HG12 ILE 630 HG12 ILE 630 -4.666 1.506 0.470 245 HG13 ILE 630 HG13 ILE 630 -6.243 2.088 0.943 246 HG21 ILE 630 HG21 ILE 630 -5.746 -1.810 1.291 247 HG22 ILE 630 HG22 ILE 630 -6.148 -0.636 0.017 248 HG23 ILE 630 HG23 ILE 630 -4.467 -0.839 0.542 249 HD11 ILE 630 HD11 ILE 630 -3.694 2.220 2.577 250 HD12 ILE 630 HD12 ILE 630 -4.551 3.570 1.793 251 HD13 ILE 630 HD13 ILE 630 -5.286 2.738 3.174 252 H GLU 631 H GLU 631 -8.122 2.651 2.993 253 HA GLU 631 HA GLU 631 -7.206 2.879 5.702 254 HB2 GLU 631 HB2 GLU 631 -8.923 4.434 3.739 255 HB3 GLU 631 HB3 GLU 631 -8.954 4.846 5.433 256 HG2 GLU 631 HG2 GLU 631 -6.459 5.043 5.454 257 HG3 GLU 631 HG3 GLU 631 -6.414 4.643 3.743 258 H ILE 632 H ILE 632 -10.292 1.938 4.148 259 HA ILE 632 HA ILE 632 -11.750 1.636 6.635 260 HB ILE 632 HB ILE 632 -12.164 0.524 3.846 261 HG12 ILE 632 HG12 ILE 632 -13.879 2.585 5.294 262 HG13 ILE 632 HG13 ILE 632 -12.429 3.092 4.448 263 HG21 ILE 632 HG21 ILE 632 -14.509 -0.024 4.671 264 HG22 ILE 632 HG22 ILE 632 -13.232 -1.030 5.347 265 HG23 ILE 632 HG23 ILE 632 -13.928 0.282 6.322 266 HD11 ILE 632 HD11 ILE 632 -14.298 3.378 2.974 267 HD12 ILE 632 HD12 ILE 632 -13.269 2.083 2.340 268 HD13 ILE 632 HD13 ILE 632 -14.792 1.682 3.165 269 H ILE 633 H ILE 633 -9.639 -0.505 4.658 270 HA ILE 633 HA ILE 633 -10.160 -2.882 6.095 271 HB ILE 633 HB ILE 633 -7.591 -2.099 4.698 272 HG12 ILE 633 HG12 ILE 633 -9.974 -2.387 3.412 273 HG13 ILE 633 HG13 ILE 633 -8.407 -2.749 2.702 274 HG21 ILE 633 HG21 ILE 633 -8.497 -4.841 5.633 275 HG22 ILE 633 HG22 ILE 633 -7.085 -4.499 4.598 276 HG23 ILE 633 HG23 ILE 633 -7.147 -3.890 6.255 277 HD11 ILE 633 HD11 ILE 633 -10.312 -4.740 3.951 278 HD12 ILE 633 HD12 ILE 633 -10.105 -4.397 2.218 279 HD13 ILE 633 HD13 ILE 633 -8.778 -5.125 3.124 280 H ASP 634 H ASP 634 -7.691 -0.293 6.492 281 HA ASP 634 HA ASP 634 -6.329 -1.498 8.646 282 HB2 ASP 634 HB2 ASP 634 -5.323 0.236 7.271 283 HB3 ASP 634 HB3 ASP 634 -6.564 1.402 7.746 284 H SER 635 H SER 635 -8.882 1.016 8.555 285 HA SER 635 HA SER 635 -8.870 1.349 11.369 286 HB2 SER 635 HB2 SER 635 -10.978 2.698 10.943 287 HB3 SER 635 HB3 SER 635 -9.518 3.208 10.081 288 HG SER 635 HG SER 635 -10.264 2.323 8.201 289 H LEU 636 H LEU 636 -10.861 -0.718 9.217 290 HA LEU 636 HA LEU 636 -12.501 -1.637 11.429 291 HB2 LEU 636 HB2 LEU 636 -11.935 -2.836 8.720 292 HB3 LEU 636 HB3 LEU 636 -13.064 -3.518 9.904 293 HG LEU 636 HG LEU 636 -13.393 -0.736 8.709 294 HD11 LEU 636 HD11 LEU 636 -13.512 -2.504 6.990 295 HD12 LEU 636 HD12 LEU 636 -15.096 -1.783 7.274 296 HD13 LEU 636 HD13 LEU 636 -14.710 -3.386 7.951 297 HD21 LEU 636 HD21 LEU 636 -15.711 -0.965 9.542 298 HD22 LEU 636 HD22 LEU 636 -14.548 -1.001 10.866 299 HD23 LEU 636 HD23 LEU 636 -15.296 -2.515 10.302 300 H ALA 637 H ALA 637 -9.453 -2.847 9.869 301 HA ALA 637 HA ALA 637 -9.282 -5.192 11.465 302 HB1 ALA 637 HB1 ALA 637 -6.886 -5.153 10.871 303 HB2 ALA 637 HB2 ALA 637 -7.923 -4.890 9.455 304 HB3 ALA 637 HB3 ALA 637 -7.068 -3.520 10.209 305 H VAL 638 H VAL 638 -8.185 -1.805 12.125 306 HA VAL 638 HA VAL 638 -6.974 -2.608 14.618 307 HB VAL 638 HB VAL 638 -6.650 -0.440 13.107 308 HG11 VAL 638 HG11 VAL 638 -8.444 0.684 15.295 309 HG12 VAL 638 HG12 VAL 638 -7.508 1.588 14.086 310 HG13 VAL 638 HG13 VAL 638 -8.857 0.579 13.574 311 HG21 VAL 638 HG21 VAL 638 -5.202 -1.174 14.954 312 HG22 VAL 638 HG22 VAL 638 -5.457 0.576 15.007 313 HG23 VAL 638 HG23 VAL 638 -6.334 -0.482 16.138 314 H SER 639 H SER 639 -10.206 -2.504 13.719 315 HA SER 639 HA SER 639 -11.201 -2.085 16.482 316 HB2 SER 639 HB2 SER 639 -12.706 -2.003 13.837 317 HB3 SER 639 HB3 SER 639 -13.302 -1.531 15.433 318 HG SER 639 HG SER 639 -11.474 -0.197 13.717 319 H SER 640 H SER 640 -10.550 -4.616 14.246 320 HA SER 640 HA SER 640 -11.909 -6.633 15.898 321 HB2 SER 640 HB2 SER 640 -12.840 -5.979 13.040 322 HB3 SER 640 HB3 SER 640 -13.331 -7.430 13.924 323 HG SER 640 HG SER 640 -13.713 -5.088 15.316 324 H GLU 641 H GLU 641 -9.184 -5.947 14.387 325 HA GLU 641 HA GLU 641 -7.452 -7.036 13.701 326 HB2 GLU 641 HB2 GLU 641 -8.994 -9.247 15.036 327 HB3 GLU 641 HB3 GLU 641 -7.631 -9.717 14.036 328 HG2 GLU 641 HG2 GLU 641 -7.467 -7.456 16.077 329 HG3 GLU 641 HG3 GLU 641 -7.291 -9.147 16.456 330 H CYS 642 H CYS 642 -10.328 -7.834 12.323 331 HA CYS 642 HA CYS 642 -8.928 -7.436 9.768 332 HB2 CYS 642 HB2 CYS 642 -9.910 -9.246 8.550 333 HB3 CYS 642 HB3 CYS 642 -9.009 -9.880 9.894 334 H ALA 643 H ALA 643 -10.242 -6.816 8.057 335 HA ALA 643 HA ALA 643 -12.558 -5.193 8.777 336 HB1 ALA 643 HB1 ALA 643 -12.230 -4.308 6.512 337 HB2 ALA 643 HB2 ALA 643 -10.700 -4.346 7.424 338 HB3 ALA 643 HB3 ALA 643 -11.018 -5.565 6.177 339 H LYS 644 H LYS 644 -14.308 -6.363 9.030 340 HA LYS 644 HA LYS 644 -15.101 -8.746 7.742 341 HB2 LYS 644 HB2 LYS 644 -17.153 -6.709 8.672 342 HB3 LYS 644 HB3 LYS 644 -17.188 -8.458 8.745 343 HG2 LYS 644 HG2 LYS 644 -16.893 -7.910 10.964 344 HG3 LYS 644 HG3 LYS 644 -15.230 -8.217 10.477 345 HD2 LYS 644 HD2 LYS 644 -14.668 -6.126 11.183 346 HD3 LYS 644 HD3 LYS 644 -15.720 -5.442 9.943 347 HE2 LYS 644 HE2 LYS 644 -16.490 -4.467 11.908 348 HE3 LYS 644 HE3 LYS 644 -17.670 -5.704 11.503 349 HZ1 LYS 644 HZ1 LYS 644 -16.579 -7.142 13.155 350 HZ2 LYS 644 HZ2 LYS 644 -17.148 -5.753 13.831 351 HZ3 LYS 644 HZ3 LYS 644 -15.540 -5.927 13.574 352 H VAL 645 H VAL 645 -15.706 -9.089 5.613 353 HA VAL 645 HA VAL 645 -15.696 -6.995 3.721 354 HB VAL 645 HB VAL 645 -16.799 -9.826 3.632 355 HG11 VAL 645 HG11 VAL 645 -16.721 -9.634 1.139 356 HG12 VAL 645 HG12 VAL 645 -17.988 -8.642 1.857 357 HG13 VAL 645 HG13 VAL 645 -16.482 -7.879 1.300 358 HG21 VAL 645 HG21 VAL 645 -14.734 -10.272 2.397 359 HG22 VAL 645 HG22 VAL 645 -14.336 -8.535 2.391 360 HG23 VAL 645 HG23 VAL 645 -14.298 -9.450 3.899 361 H LYS 646 H LYS 646 -18.292 -8.087 5.776 362 HA LYS 646 HA LYS 646 -20.530 -6.963 4.380 363 HB2 LYS 646 HB2 LYS 646 -19.848 -7.665 7.262 364 HB3 LYS 646 HB3 LYS 646 -21.270 -6.692 6.975 365 HG2 LYS 646 HG2 LYS 646 -20.929 -9.292 5.440 366 HG3 LYS 646 HG3 LYS 646 -21.454 -9.300 7.124 367 HD2 LYS 646 HD2 LYS 646 -23.421 -9.346 5.828 368 HD3 LYS 646 HD3 LYS 646 -23.319 -7.736 6.556 369 HE2 LYS 646 HE2 LYS 646 -22.562 -6.781 4.433 370 HE3 LYS 646 HE3 LYS 646 -22.485 -8.394 3.695 371 HZ1 LYS 646 HZ1 LYS 646 -24.938 -7.077 4.678 372 HZ2 LYS 646 HZ2 LYS 646 -24.866 -8.567 3.982 373 HZ3 LYS 646 HZ3 LYS 646 -24.499 -7.229 3.099 374 H ASP 647 H ASP 647 -18.124 -5.579 6.668 375 HA ASP 647 HA ASP 647 -19.593 -3.105 6.862 376 HB2 ASP 647 HB2 ASP 647 -16.939 -4.132 7.900 377 HB3 ASP 647 HB3 ASP 647 -17.231 -2.397 7.851 378 H ILE 648 H ILE 648 -16.842 -4.420 5.026 379 HA ILE 648 HA ILE 648 -16.028 -1.891 3.944 380 HB ILE 648 HB ILE 648 -15.642 -4.583 2.563 381 HG12 ILE 648 HG12 ILE 648 -13.808 -3.334 4.662 382 HG13 ILE 648 HG13 ILE 648 -14.839 -4.710 4.939 383 HG21 ILE 648 HG21 ILE 648 -13.970 -2.017 2.502 384 HG22 ILE 648 HG22 ILE 648 -13.697 -3.474 1.526 385 HG23 ILE 648 HG23 ILE 648 -15.122 -2.496 1.245 386 HD11 ILE 648 HD11 ILE 648 -12.500 -4.634 3.023 387 HD12 ILE 648 HD12 ILE 648 -12.670 -5.596 4.493 388 HD13 ILE 648 HD13 ILE 648 -13.676 -5.966 3.088 389 H LEU 649 H LEU 649 -18.099 -4.509 2.622 390 HA LEU 649 HA LEU 649 -18.926 -3.245 0.251 391 HB2 LEU 649 HB2 LEU 649 -20.241 -5.172 2.178 392 HB3 LEU 649 HB3 LEU 649 -21.126 -4.580 0.783 393 HG LEU 649 HG LEU 649 -18.417 -5.952 0.535 394 HD11 LEU 649 HD11 LEU 649 -21.225 -7.136 0.242 395 HD12 LEU 649 HD12 LEU 649 -20.089 -7.478 1.567 396 HD13 LEU 649 HD13 LEU 649 -19.696 -7.983 -0.084 397 HD21 LEU 649 HD21 LEU 649 -19.008 -4.613 -1.436 398 HD22 LEU 649 HD22 LEU 649 -20.615 -5.350 -1.498 399 HD23 LEU 649 HD23 LEU 649 -19.159 -6.323 -1.824 400 H LYS 650 H LYS 650 -20.250 -2.977 3.552 401 HA LYS 650 HA LYS 650 -22.425 -1.257 2.851 402 HB2 LYS 650 HB2 LYS 650 -22.472 -2.562 4.830 403 HB3 LYS 650 HB3 LYS 650 -20.972 -1.885 5.418 404 HG2 LYS 650 HG2 LYS 650 -23.158 0.113 4.997 405 HG3 LYS 650 HG3 LYS 650 -23.531 -1.135 6.178 406 HD2 LYS 650 HD2 LYS 650 -21.085 0.656 6.270 407 HD3 LYS 650 HD3 LYS 650 -22.544 0.858 7.249 408 HE2 LYS 650 HE2 LYS 650 -22.140 -1.483 8.186 409 HE3 LYS 650 HE3 LYS 650 -20.617 -1.503 7.294 410 HZ1 LYS 650 HZ1 LYS 650 -19.990 -0.919 9.319 411 HZ2 LYS 650 HZ2 LYS 650 -21.261 0.123 9.613 412 HZ3 LYS 650 HZ3 LYS 650 -20.079 0.593 8.580 413 H GLU 651 H GLU 651 -19.218 -0.337 4.378 414 HA GLU 651 HA GLU 651 -19.894 2.448 4.191 415 HB2 GLU 651 HB2 GLU 651 -17.151 1.148 4.447 416 HB3 GLU 651 HB3 GLU 651 -17.489 2.858 4.689 417 HG2 GLU 651 HG2 GLU 651 -18.468 0.551 6.406 418 HG3 GLU 651 HG3 GLU 651 -17.242 1.736 6.821 419 H ALA 652 H ALA 652 -18.163 0.287 1.925 420 HA ALA 652 HA ALA 652 -17.311 2.407 0.202 421 HB1 ALA 652 HB1 ALA 652 -17.883 -0.506 -0.352 422 HB2 ALA 652 HB2 ALA 652 -16.979 0.599 -1.424 423 HB3 ALA 652 HB3 ALA 652 -16.332 0.177 0.168 424 H GLN 653 H GLN 653 -20.316 0.332 0.239 425 HA GLN 653 HA GLN 653 -21.523 1.706 -1.977 426 HB2 GLN 653 HB2 GLN 653 -22.651 0.022 0.281 427 HB3 GLN 653 HB3 GLN 653 -23.660 0.745 -0.982 428 HG2 GLN 653 HG2 GLN 653 -22.519 -0.427 -2.737 429 HG3 GLN 653 HG3 GLN 653 -21.241 -0.975 -1.661 430 HE21 GLN 653 HE21 GLN 653 -24.813 -1.111 -1.044 431 HE22 GLN 653 HE22 GLN 653 -24.836 -2.869 -0.995 432 H GLN 654 H GLN 654 -21.456 2.443 1.522 433 HA GLN 654 HA GLN 654 -23.230 4.680 1.341 434 HB2 GLN 654 HB2 GLN 654 -20.886 4.389 3.275 435 HB3 GLN 654 HB3 GLN 654 -22.146 5.608 3.326 436 HG2 GLN 654 HG2 GLN 654 -23.751 3.454 3.345 437 HG3 GLN 654 HG3 GLN 654 -22.320 2.715 4.067 438 HE21 GLN 654 HE21 GLN 654 -21.298 3.991 6.103 439 HE22 GLN 654 HE22 GLN 654 -22.547 4.764 7.060 440 H VAL 655 H VAL 655 -19.591 4.587 0.699 441 HA VAL 655 HA VAL 655 -19.718 7.417 0.104 442 HB VAL 655 HB VAL 655 -17.780 6.098 1.145 443 HG11 VAL 655 HG11 VAL 655 -17.057 5.580 -1.762 444 HG12 VAL 655 HG12 VAL 655 -16.028 5.308 -0.336 445 HG13 VAL 655 HG13 VAL 655 -17.494 4.363 -0.541 446 HG21 VAL 655 HG21 VAL 655 -17.725 8.476 0.526 447 HG22 VAL 655 HG22 VAL 655 -16.161 7.684 0.288 448 HG23 VAL 655 HG23 VAL 655 -17.201 8.040 -1.115 449 H GLY 656 H GLY 656 -20.485 4.582 -1.651 450 HA2 GLY 656 HA2 GLY 656 -22.069 5.079 -3.415 451 HA3 GLY 656 HA3 GLY 656 -21.009 6.356 -4.013 452 H ILE 657 H ILE 657 -19.387 3.445 -3.046 453 HA ILE 657 HA ILE 657 -18.619 2.826 -5.806 454 HB ILE 657 HB ILE 657 -18.088 1.322 -3.221 455 HG12 ILE 657 HG12 ILE 657 -17.168 3.323 -2.610 456 HG13 ILE 657 HG13 ILE 657 -15.817 2.375 -3.177 457 HG21 ILE 657 HG21 ILE 657 -16.033 0.537 -4.445 458 HG22 ILE 657 HG22 ILE 657 -17.567 0.039 -5.148 459 HG23 ILE 657 HG23 ILE 657 -16.641 1.364 -5.899 460 HD11 ILE 657 HD11 ILE 657 -15.542 4.641 -3.889 461 HD12 ILE 657 HD12 ILE 657 -15.904 3.672 -5.338 462 HD13 ILE 657 HD13 ILE 657 -17.164 4.700 -4.597 463 H GLU 658 H GLU 658 -19.171 0.605 -6.804 464 HA GLU 658 HA GLU 658 -21.811 -0.333 -5.817 465 HB2 GLU 658 HB2 GLU 658 -21.446 0.145 -8.291 466 HB3 GLU 658 HB3 GLU 658 -20.316 -1.210 -8.309 467 HG2 GLU 658 HG2 GLU 658 -22.688 -2.237 -7.074 468 HG3 GLU 658 HG3 GLU 658 -23.276 -1.207 -8.339 469 H LYS 659 H LYS 659 -22.064 -2.417 -5.170 470 HA LYS 659 HA LYS 659 -20.562 -4.042 -3.697 471 HB2 LYS 659 HB2 LYS 659 -22.913 -4.229 -4.287 472 HB3 LYS 659 HB3 LYS 659 -22.532 -4.760 -5.908 473 HG2 LYS 659 HG2 LYS 659 -21.588 -6.319 -3.484 474 HG3 LYS 659 HG3 LYS 659 -23.263 -6.439 -4.031 475 HD2 LYS 659 HD2 LYS 659 -20.841 -7.118 -5.712 476 HD3 LYS 659 HD3 LYS 659 -21.830 -8.284 -4.863 477 HE2 LYS 659 HE2 LYS 659 -22.920 -6.406 -7.014 478 HE3 LYS 659 HE3 LYS 659 -22.271 -8.013 -7.346 479 HZ1 LYS 659 HZ1 LYS 659 -24.651 -8.080 -7.082 480 HZ2 LYS 659 HZ2 LYS 659 -24.550 -7.459 -5.558 481 HZ3 LYS 659 HZ3 LYS 659 -23.922 -8.947 -5.886 482 H SER 660 H SER 660 -20.677 -4.639 -7.311 483 HA SER 660 HA SER 660 -18.661 -6.648 -7.072 484 HB2 SER 660 HB2 SER 660 -18.719 -6.709 -9.504 485 HB3 SER 660 HB3 SER 660 -20.345 -6.731 -8.801 486 HG SER 660 HG SER 660 -20.615 -4.532 -9.291 487 H ASN 661 H ASN 661 -18.371 -3.165 -7.307 488 HA ASN 661 HA ASN 661 -15.770 -3.053 -8.509 489 HB2 ASN 661 HB2 ASN 661 -17.460 -1.091 -7.533 490 HB3 ASN 661 HB3 ASN 661 -16.293 -1.196 -6.277 491 HD21 ASN 661 HD21 ASN 661 -13.931 -1.893 -7.712 492 HD22 ASN 661 HD22 ASN 661 -13.493 -0.498 -8.693 493 H ILE 662 H ILE 662 -17.070 -3.629 -5.246 494 HA ILE 662 HA ILE 662 -14.491 -3.299 -3.896 495 HB ILE 662 HB ILE 662 -17.247 -4.225 -2.956 496 HG12 ILE 662 HG12 ILE 662 -16.260 -1.522 -2.146 497 HG13 ILE 662 HG13 ILE 662 -16.669 -1.669 -3.834 498 HG21 ILE 662 HG21 ILE 662 -14.842 -3.395 -1.296 499 HG22 ILE 662 HG22 ILE 662 -16.490 -3.624 -0.662 500 HG23 ILE 662 HG23 ILE 662 -15.626 -4.989 -1.370 501 HD11 ILE 662 HD11 ILE 662 -18.904 -2.601 -3.245 502 HD12 ILE 662 HD12 ILE 662 -18.549 -2.276 -1.548 503 HD13 ILE 662 HD13 ILE 662 -18.652 -0.936 -2.704 504 H GLU 663 H GLU 663 -16.692 -5.750 -5.143 505 HA GLU 663 HA GLU 663 -15.375 -8.049 -3.909 506 HB2 GLU 663 HB2 GLU 663 -16.882 -7.941 -6.558 507 HB3 GLU 663 HB3 GLU 663 -16.399 -9.406 -5.697 508 HG2 GLU 663 HG2 GLU 663 -17.778 -8.632 -3.725 509 HG3 GLU 663 HG3 GLU 663 -18.359 -7.309 -4.699 510 H LYS 664 H LYS 664 -15.012 -6.470 -7.125 511 HA LYS 664 HA LYS 664 -12.802 -8.196 -7.736 512 HB2 LYS 664 HB2 LYS 664 -12.655 -7.170 -9.844 513 HB3 LYS 664 HB3 LYS 664 -14.356 -7.335 -9.428 514 HG2 LYS 664 HG2 LYS 664 -14.071 -4.815 -8.614 515 HG3 LYS 664 HG3 LYS 664 -12.673 -4.835 -9.687 516 HD2 LYS 664 HD2 LYS 664 -15.579 -5.440 -10.403 517 HD3 LYS 664 HD3 LYS 664 -14.681 -3.977 -10.823 518 HE2 LYS 664 HE2 LYS 664 -13.175 -5.279 -12.274 519 HE3 LYS 664 HE3 LYS 664 -13.966 -6.784 -11.780 520 HZ1 LYS 664 HZ1 LYS 664 -15.272 -4.586 -13.252 521 HZ2 LYS 664 HZ2 LYS 664 -16.007 -5.975 -12.765 522 HZ3 LYS 664 HZ3 LYS 664 -14.805 -6.032 -13.887 523 H LEU 665 H LEU 665 -12.949 -4.834 -6.432 524 HA LEU 665 HA LEU 665 -10.090 -4.527 -6.617 525 HB2 LEU 665 HB2 LEU 665 -12.170 -3.086 -4.940 526 HB3 LEU 665 HB3 LEU 665 -10.450 -2.781 -4.759 527 HG LEU 665 HG LEU 665 -11.961 -2.451 -7.385 528 HD11 LEU 665 HD11 LEU 665 -12.589 -0.762 -5.682 529 HD12 LEU 665 HD12 LEU 665 -11.663 -0.042 -7.011 530 HD13 LEU 665 HD13 LEU 665 -10.868 -0.356 -5.461 531 HD21 LEU 665 HD21 LEU 665 -9.868 -1.196 -8.065 532 HD22 LEU 665 HD22 LEU 665 -9.672 -2.938 -7.932 533 HD23 LEU 665 HD23 LEU 665 -9.069 -1.889 -6.635 534 H LEU 666 H LEU 666 -12.174 -5.699 -3.838 535 HA LEU 666 HA LEU 666 -9.941 -6.124 -2.124 536 HB2 LEU 666 HB2 LEU 666 -12.580 -7.621 -2.349 537 HB3 LEU 666 HB3 LEU 666 -11.395 -7.923 -1.087 538 HG LEU 666 HG LEU 666 -12.703 -5.196 -1.515 539 HD11 LEU 666 HD11 LEU 666 -14.361 -6.932 -0.866 540 HD12 LEU 666 HD12 LEU 666 -14.098 -5.739 0.420 541 HD13 LEU 666 HD13 LEU 666 -13.360 -7.345 0.538 542 HD21 LEU 666 HD21 LEU 666 -11.065 -6.303 0.799 543 HD22 LEU 666 HD22 LEU 666 -11.876 -4.722 0.739 544 HD23 LEU 666 HD23 LEU 666 -10.538 -5.053 -0.351 545 H THR 667 H THR 667 -11.363 -8.172 -4.703 546 HA THR 667 HA THR 667 -9.606 -10.361 -4.324 547 HB THR 667 HB THR 667 -10.989 -9.369 -6.845 548 HG1 THR 667 HG1 THR 667 -12.479 -9.902 -5.388 549 HG21 THR 667 HG21 THR 667 -9.211 -10.844 -7.544 550 HG22 THR 667 HG22 THR 667 -10.723 -11.775 -7.576 551 HG23 THR 667 HG23 THR 667 -9.553 -11.997 -6.261 552 H ASP 668 H ASP 668 -9.196 -7.388 -6.390 553 HA ASP 668 HA ASP 668 -6.692 -8.152 -7.490 554 HB2 ASP 668 HB2 ASP 668 -7.827 -6.339 -8.484 555 HB3 ASP 668 HB3 ASP 668 -7.965 -5.462 -6.953 556 H MET 669 H MET 669 -7.362 -6.026 -4.609 557 HA MET 669 HA MET 669 -4.564 -5.883 -4.103 558 HB2 MET 669 HB2 MET 669 -5.440 -5.199 -1.676 559 HB3 MET 669 HB3 MET 669 -5.355 -4.143 -3.088 560 HG2 MET 669 HG2 MET 669 -7.682 -4.344 -3.466 561 HG3 MET 669 HG3 MET 669 -7.847 -5.548 -2.165 562 HE1 MET 669 HE1 MET 669 -7.264 -0.977 -1.889 563 HE2 MET 669 HE2 MET 669 -5.940 -1.995 -2.492 564 HE3 MET 669 HE3 MET 669 -7.495 -1.959 -3.351 565 H ARG 670 H ARG 670 -6.885 -8.320 -2.923 566 HA ARG 670 HA ARG 670 -4.863 -9.527 -1.227 567 HB2 ARG 670 HB2 ARG 670 -6.422 -11.026 -0.520 568 HB3 ARG 670 HB3 ARG 670 -7.405 -9.634 -0.841 569 HG2 ARG 670 HG2 ARG 670 -8.770 -10.984 -1.916 570 HG3 ARG 670 HG3 ARG 670 -7.625 -10.987 -3.240 571 HD2 ARG 670 HD2 ARG 670 -6.926 -13.151 -2.822 572 HD3 ARG 670 HD3 ARG 670 -7.004 -12.957 -1.094 573 HE ARG 670 HE ARG 670 -8.914 -14.063 -1.052 574 HH11 ARG 670 HH11 ARG 670 -8.978 -12.537 -4.232 575 HH12 ARG 670 HH12 ARG 670 -10.693 -12.746 -4.453 576 HH21 ARG 670 HH21 ARG 670 -11.090 -14.194 -1.250 577 HH22 ARG 670 HH22 ARG 670 -11.886 -14.017 -2.797 578 H LYS 671 H LYS 671 -5.538 -9.743 -4.637 579 HA LYS 671 HA LYS 671 -3.833 -12.143 -4.869 580 HB2 LYS 671 HB2 LYS 671 -5.346 -10.354 -6.818 581 HB3 LYS 671 HB3 LYS 671 -4.148 -11.472 -7.408 582 HG2 LYS 671 HG2 LYS 671 -6.641 -12.227 -5.812 583 HG3 LYS 671 HG3 LYS 671 -6.410 -12.426 -7.546 584 HD2 LYS 671 HD2 LYS 671 -4.964 -13.919 -5.318 585 HD3 LYS 671 HD3 LYS 671 -6.159 -14.559 -6.443 586 HE2 LYS 671 HE2 LYS 671 -4.637 -14.144 -8.346 587 HE3 LYS 671 HE3 LYS 671 -3.431 -13.455 -7.245 588 HZ1 LYS 671 HZ1 LYS 671 -2.926 -15.729 -7.757 589 HZ2 LYS 671 HZ2 LYS 671 -4.381 -16.247 -7.190 590 HZ3 LYS 671 HZ3 LYS 671 -3.275 -15.592 -6.158 591 H SER 672 H SER 672 -3.609 -8.672 -5.285 592 HA SER 672 HA SER 672 -1.129 -8.646 -6.697 593 HB2 SER 672 HB2 SER 672 -2.983 -6.980 -6.859 594 HB3 SER 672 HB3 SER 672 -2.624 -6.433 -5.212 595 HG SER 672 HG SER 672 -1.707 -5.242 -7.038 596 H GLY 673 H GLY 673 -2.012 -8.063 -3.236 597 HA2 GLY 673 HA2 GLY 673 -0.319 -8.878 -1.592 598 HA3 GLY 673 HA3 GLY 673 0.931 -8.130 -2.592 599 H ILE 674 H ILE 674 -2.279 -6.895 -1.654 600 HA ILE 674 HA ILE 674 -0.979 -4.582 -0.256 601 HB ILE 674 HB ILE 674 -3.360 -4.772 -2.088 602 HG12 ILE 674 HG12 ILE 674 -0.923 -2.998 -2.336 603 HG13 ILE 674 HG13 ILE 674 -1.121 -4.544 -3.156 604 HG21 ILE 674 HG21 ILE 674 -3.830 -2.372 -1.661 605 HG22 ILE 674 HG22 ILE 674 -4.028 -3.318 -0.209 606 HG23 ILE 674 HG23 ILE 674 -2.557 -2.352 -0.420 607 HD11 ILE 674 HD11 ILE 674 -3.165 -3.689 -4.300 608 HD12 ILE 674 HD12 ILE 674 -2.837 -2.078 -3.612 609 HD13 ILE 674 HD13 ILE 674 -1.681 -2.818 -4.721 610 H ILE 675 H ILE 675 -3.646 -7.009 -0.298 611 HA ILE 675 HA ILE 675 -3.819 -6.688 2.609 612 HB ILE 675 HB ILE 675 -6.221 -6.795 2.654 613 HG12 ILE 675 HG12 ILE 675 -6.157 -6.934 -0.375 614 HG13 ILE 675 HG13 ILE 675 -6.626 -8.220 0.738 615 HG21 ILE 675 HG21 ILE 675 -6.832 -4.603 1.921 616 HG22 ILE 675 HG22 ILE 675 -5.127 -4.506 2.327 617 HG23 ILE 675 HG23 ILE 675 -5.623 -4.610 0.635 618 HD11 ILE 675 HD11 ILE 675 -8.616 -7.278 -0.164 619 HD12 ILE 675 HD12 ILE 675 -8.504 -6.781 1.534 620 HD13 ILE 675 HD13 ILE 675 -8.110 -5.627 0.257 621 H TYR 676 H TYR 676 -5.098 -8.751 3.443 622 HA TYR 676 HA TYR 676 -5.001 -11.054 1.601 623 HB2 TYR 676 HB2 TYR 676 -3.849 -12.417 3.337 624 HB3 TYR 676 HB3 TYR 676 -2.829 -11.182 2.613 625 HD1 TYR 676 HD2 TYR 676 -4.884 -11.922 5.658 626 HD2 TYR 676 HD1 TYR 676 -1.661 -9.621 3.982 627 HE1 TYR 676 HE2 TYR 676 -4.202 -11.250 7.936 628 HE2 TYR 676 HE1 TYR 676 -0.999 -8.888 6.271 629 HH TYR 676 HH TYR 676 -2.504 -10.238 9.195 630 H GLU 677 H GLU 677 -6.466 -12.857 2.415 631 HA GLU 677 HA GLU 677 -8.674 -11.871 3.767 632 HB2 GLU 677 HB2 GLU 677 -7.822 -14.138 2.198 633 HB3 GLU 677 HB3 GLU 677 -8.599 -14.797 3.622 634 HG2 GLU 677 HG2 GLU 677 -10.614 -14.111 3.089 635 HG3 GLU 677 HG3 GLU 677 -10.121 -12.567 2.448 636 H ALA 678 H ALA 678 -6.725 -14.645 4.766 637 HA ALA 678 HA ALA 678 -6.188 -15.638 6.647 638 HB1 ALA 678 HB1 ALA 678 -5.412 -14.212 8.531 639 HB2 ALA 678 HB2 ALA 678 -4.766 -13.742 6.945 640 HB3 ALA 678 HB3 ALA 678 -6.088 -12.799 7.694 641 H LYS 679 H LYS 679 -9.143 -13.805 6.932 642 HA LYS 679 HA LYS 679 -10.101 -15.822 8.887 643 HB2 LYS 679 HB2 LYS 679 -10.303 -12.798 9.050 644 HB3 LYS 679 HB3 LYS 679 -11.577 -13.801 9.737 645 HG2 LYS 679 HG2 LYS 679 -10.019 -14.886 11.267 646 HG3 LYS 679 HG3 LYS 679 -8.640 -14.029 10.542 647 HD2 LYS 679 HD2 LYS 679 -9.484 -11.896 11.243 648 HD3 LYS 679 HD3 LYS 679 -11.021 -12.612 11.794 649 HE2 LYS 679 HE2 LYS 679 -9.788 -13.808 13.579 650 HE3 LYS 679 HE3 LYS 679 -8.280 -13.046 13.035 651 HZ1 LYS 679 HZ1 LYS 679 -9.279 -11.826 14.861 652 HZ2 LYS 679 HZ2 LYS 679 -10.667 -11.584 14.008 653 HZ3 LYS 679 HZ3 LYS 679 -9.270 -10.894 13.511 654 HA PRO 680 HA PRO 680 -13.188 -16.247 5.774 655 HB2 PRO 680 HB2 PRO 680 -15.514 -16.775 7.156 656 HB3 PRO 680 HB3 PRO 680 -14.168 -17.943 6.988 657 HG2 PRO 680 HG2 PRO 680 -14.730 -16.064 9.303 658 HG3 PRO 680 HG3 PRO 680 -14.341 -17.814 9.368 659 HD2 PRO 680 HD2 PRO 680 -12.439 -15.926 9.772 660 HD3 PRO 680 HD3 PRO 680 -12.058 -17.413 8.852 661 H GLU 681 H GLU 681 -14.611 -15.021 4.624 662 HA GLU 681 HA GLU 681 -15.262 -13.004 3.793 663 HB2 GLU 681 HB2 GLU 681 -17.059 -13.543 6.181 664 HB3 GLU 681 HB3 GLU 681 -17.417 -12.361 4.920 665 HG2 GLU 681 HG2 GLU 681 -18.602 -14.371 4.390 666 HG3 GLU 681 HG3 GLU 681 -17.342 -14.120 3.189 667 H CYS 682 H CYS 682 -12.900 -12.498 5.154 668 HA CYS 682 HA CYS 682 -13.293 -9.740 6.103 669 HB2 CYS 682 HB2 CYS 682 -12.831 -11.985 7.799 670 HB3 CYS 682 HB3 CYS 682 -11.260 -11.247 7.577 671 H TYR 683 H TYR 683 -11.223 -8.546 6.108 672 HA TYR 683 HA TYR 683 -8.938 -9.919 4.825 673 HB2 TYR 683 HB2 TYR 683 -10.154 -7.291 3.899 674 HB3 TYR 683 HB3 TYR 683 -8.520 -7.816 3.488 675 HD1 TYR 683 HD1 TYR 683 -8.141 -9.837 2.083 676 HD2 TYR 683 HD2 TYR 683 -12.064 -8.199 2.727 677 HE1 TYR 683 HE1 TYR 683 -9.035 -11.314 0.312 678 HE2 TYR 683 HE2 TYR 683 -12.952 -9.639 0.871 679 HH TYR 683 HH TYR 683 -11.419 -12.376 -0.118 680 H LYS 684 H LYS 684 -6.874 -8.810 5.199 681 HA LYS 684 HA LYS 684 -6.971 -6.535 7.101 682 HB2 LYS 684 HB2 LYS 684 -6.207 -9.095 7.987 683 HB3 LYS 684 HB3 LYS 684 -4.671 -8.327 7.560 684 HG2 LYS 684 HG2 LYS 684 -5.547 -6.295 8.927 685 HG3 LYS 684 HG3 LYS 684 -6.772 -7.384 9.519 686 HD2 LYS 684 HD2 LYS 684 -5.028 -8.911 10.412 687 HD3 LYS 684 HD3 LYS 684 -3.754 -7.836 9.789 688 HE2 LYS 684 HE2 LYS 684 -4.380 -6.062 11.295 689 HE3 LYS 684 HE3 LYS 684 -5.883 -6.880 11.725 690 HZ1 LYS 684 HZ1 LYS 684 -3.184 -7.805 12.512 691 HZ2 LYS 684 HZ2 LYS 684 -4.611 -8.578 12.899 692 HZ3 LYS 684 HZ3 LYS 684 -4.360 -7.170 13.507 693 H LYS 685 H LYS 685 -5.211 -5.074 6.832 694 HA LYS 685 HA LYS 685 -4.148 -5.027 4.136 695 HB2 LYS 685 HB2 LYS 685 -5.048 -3.084 5.633 696 HB3 LYS 685 HB3 LYS 685 -3.473 -3.099 6.409 697 HG2 LYS 685 HG2 LYS 685 -3.754 -2.903 3.385 698 HG3 LYS 685 HG3 LYS 685 -4.044 -1.486 4.386 699 HD2 LYS 685 HD2 LYS 685 -1.849 -1.254 5.040 700 HD3 LYS 685 HD3 LYS 685 -1.496 -2.972 4.881 701 HE2 LYS 685 HE2 LYS 685 -1.700 -2.770 2.396 702 HE3 LYS 685 HE3 LYS 685 -1.916 -1.027 2.571 703 HZ1 LYS 685 HZ1 LYS 685 0.399 -2.636 3.486 704 HZ2 LYS 685 HZ2 LYS 685 0.305 -1.000 3.643 705 HZ3 LYS 685 HZ3 LYS 685 0.418 -1.693 2.137 706 H VAL 686 H VAL 686 -1.918 -5.267 3.504 707 HA VAL 686 HA VAL 686 -0.359 -6.832 5.465 708 HB VAL 686 HB VAL 686 -0.885 -7.639 3.088 709 HG11 VAL 686 HG11 VAL 686 1.496 -5.912 2.317 710 HG12 VAL 686 HG12 VAL 686 0.578 -7.028 1.290 711 HG13 VAL 686 HG13 VAL 686 -0.171 -5.534 1.887 712 HG21 VAL 686 HG21 VAL 686 0.722 -8.747 4.591 713 HG22 VAL 686 HG22 VAL 686 1.281 -8.796 2.912 714 HG23 VAL 686 HG23 VAL 686 2.000 -7.642 4.059 Start of MODEL 5 1 H1 GLY 600 H1 GLY 600 6.806 13.519 -3.239 2 H2 GLY 600 H2 GLY 600 5.892 14.499 -2.259 3 H3 GLY 600 H3 GLY 600 6.337 13.018 -1.730 4 HA2 GLY 600 HA2 GLY 600 4.550 13.522 -4.012 5 HA3 GLY 600 HA3 GLY 600 4.967 11.928 -3.333 6 H SER 601 H SER 601 2.948 11.273 -2.400 7 HA SER 601 HA SER 601 1.229 12.922 -0.890 8 HB2 SER 601 HB2 SER 601 1.803 9.984 -0.357 9 HB3 SER 601 HB3 SER 601 0.303 10.869 -0.047 10 HG SER 601 HG SER 601 1.059 9.545 -2.215 11 H HIS 602 H HIS 602 4.345 11.535 -0.088 12 HA HIS 602 HA HIS 602 4.550 13.212 2.212 13 HB2 HIS 602 HB2 HIS 602 3.766 11.040 3.200 14 HB3 HIS 602 HB3 HIS 602 5.123 10.216 2.426 15 HD1 HIS 602 HD1 HIS 602 7.367 10.216 3.771 16 HD2 HIS 602 HD2 HIS 602 4.512 13.043 5.085 17 HE1 HIS 602 HE1 HIS 602 8.325 11.326 5.870 18 H MET 603 H MET 603 7.109 12.870 2.838 19 HA MET 603 HA MET 603 8.691 12.688 0.319 20 HB2 MET 603 HB2 MET 603 8.670 14.822 2.470 21 HB3 MET 603 HB3 MET 603 10.170 14.416 1.638 22 HG2 MET 603 HG2 MET 603 9.145 16.306 0.601 23 HG3 MET 603 HG3 MET 603 9.215 14.960 -0.524 24 HE1 MET 603 HE1 MET 603 7.306 17.882 0.411 25 HE2 MET 603 HE2 MET 603 7.645 17.441 -1.280 26 HE3 MET 603 HE3 MET 603 5.960 17.596 -0.715 27 H GLY 604 H GLY 604 9.717 10.814 0.543 28 HA2 GLY 604 HA2 GLY 604 11.183 9.232 1.559 29 HA3 GLY 604 HA3 GLY 604 10.824 9.924 3.156 30 H GLU 605 H GLU 605 10.445 7.154 1.927 31 HA GLU 605 HA GLU 605 7.497 6.896 1.938 32 HB2 GLU 605 HB2 GLU 605 7.866 5.040 0.441 33 HB3 GLU 605 HB3 GLU 605 8.587 6.503 -0.197 34 HG2 GLU 605 HG2 GLU 605 10.250 4.390 1.257 35 HG3 GLU 605 HG3 GLU 605 9.854 4.284 -0.448 36 H SER 606 H SER 606 6.497 4.915 2.738 37 HA SER 606 HA SER 606 7.599 3.933 5.214 38 HB2 SER 606 HB2 SER 606 5.432 2.538 5.018 39 HB3 SER 606 HB3 SER 606 5.273 4.299 5.111 40 HG SER 606 HG SER 606 4.830 2.605 2.930 41 H GLY 607 H GLY 607 7.974 3.036 1.921 42 HA2 GLY 607 HA2 GLY 607 9.805 0.998 2.259 43 HA3 GLY 607 HA3 GLY 607 8.210 0.232 1.995 44 H LYS 608 H LYS 608 10.310 0.141 -0.003 45 HA LYS 608 HA LYS 608 10.208 2.426 -1.649 46 HB2 LYS 608 HB2 LYS 608 12.131 0.866 -1.275 47 HB3 LYS 608 HB3 LYS 608 11.365 -0.287 -2.360 48 HG2 LYS 608 HG2 LYS 608 13.218 1.026 -3.342 49 HG3 LYS 608 HG3 LYS 608 11.747 1.163 -4.270 50 HD2 LYS 608 HD2 LYS 608 12.486 3.286 -2.217 51 HD3 LYS 608 HD3 LYS 608 13.241 3.266 -3.815 52 HE2 LYS 608 HE2 LYS 608 11.047 3.444 -4.927 53 HE3 LYS 608 HE3 LYS 608 10.230 3.385 -3.380 54 HZ1 LYS 608 HZ1 LYS 608 10.342 5.599 -3.997 55 HZ2 LYS 608 HZ2 LYS 608 11.973 5.561 -4.302 56 HZ3 LYS 608 HZ3 LYS 608 11.398 5.431 -2.752 57 H ILE 609 H ILE 609 7.589 0.808 -1.433 58 HA ILE 609 HA ILE 609 6.888 0.969 -4.321 59 HB ILE 609 HB ILE 609 5.207 -0.013 -2.022 60 HG12 ILE 609 HG12 ILE 609 5.070 -2.157 -3.463 61 HG13 ILE 609 HG13 ILE 609 6.462 -1.549 -4.350 62 HG21 ILE 609 HG21 ILE 609 4.570 0.273 -4.988 63 HG22 ILE 609 HG22 ILE 609 3.510 -0.514 -3.794 64 HG23 ILE 609 HG23 ILE 609 3.860 1.201 -3.654 65 HD11 ILE 609 HD11 ILE 609 6.433 -2.072 -1.339 66 HD12 ILE 609 HD12 ILE 609 6.935 -3.263 -2.554 67 HD13 ILE 609 HD13 ILE 609 7.864 -1.779 -2.362 68 H ASP 610 H ASP 610 7.105 3.100 -4.466 69 HA ASP 610 HA ASP 610 6.070 5.071 -2.620 70 HB2 ASP 610 HB2 ASP 610 6.232 5.516 -5.611 71 HB3 ASP 610 HB3 ASP 610 6.378 6.696 -4.319 72 H ILE 611 H ILE 611 4.267 6.542 -3.323 73 HA ILE 611 HA ILE 611 1.904 5.098 -4.395 74 HB ILE 611 HB ILE 611 2.113 8.052 -3.721 75 HG12 ILE 611 HG12 ILE 611 2.709 7.092 -1.658 76 HG13 ILE 611 HG13 ILE 611 1.014 7.535 -1.545 77 HG21 ILE 611 HG21 ILE 611 0.191 7.528 -5.075 78 HG22 ILE 611 HG22 ILE 611 -0.220 6.133 -4.064 79 HG23 ILE 611 HG23 ILE 611 -0.375 7.775 -3.414 80 HD11 ILE 611 HD11 ILE 611 1.319 5.391 -0.516 81 HD12 ILE 611 HD12 ILE 611 0.421 5.127 -2.033 82 HD13 ILE 611 HD13 ILE 611 2.153 4.742 -1.938 83 H ASP 612 H ASP 612 4.318 7.473 -5.265 84 HA ASP 612 HA ASP 612 3.084 8.635 -7.539 85 HB2 ASP 612 HB2 ASP 612 4.991 9.582 -6.228 86 HB3 ASP 612 HB3 ASP 612 6.060 8.391 -6.983 87 H THR 613 H THR 613 5.262 5.910 -7.158 88 HA THR 613 HA THR 613 5.790 5.260 -9.847 89 HB THR 613 HB THR 613 6.780 4.526 -7.521 90 HG1 THR 613 HG1 THR 613 7.908 3.016 -8.561 91 HG21 THR 613 HG21 THR 613 6.282 2.368 -6.725 92 HG22 THR 613 HG22 THR 613 5.138 2.052 -8.052 93 HG23 THR 613 HG23 THR 613 4.757 3.260 -6.807 94 H ILE 614 H ILE 614 2.827 4.972 -8.119 95 HA ILE 614 HA ILE 614 1.743 2.934 -10.002 96 HB ILE 614 HB ILE 614 0.693 4.020 -7.364 97 HG12 ILE 614 HG12 ILE 614 1.421 1.115 -7.838 98 HG13 ILE 614 HG13 ILE 614 2.720 2.246 -7.526 99 HG21 ILE 614 HG21 ILE 614 -0.463 1.872 -9.177 100 HG22 ILE 614 HG22 ILE 614 -1.041 2.248 -7.539 101 HG23 ILE 614 HG23 ILE 614 -1.193 3.456 -8.818 102 HD11 ILE 614 HD11 ILE 614 2.081 1.282 -5.446 103 HD12 ILE 614 HD12 ILE 614 1.630 2.994 -5.441 104 HD13 ILE 614 HD13 ILE 614 0.381 1.750 -5.674 105 H MET 615 H MET 615 1.025 6.221 -8.588 106 HA MET 615 HA MET 615 -1.156 6.590 -10.461 107 HB2 MET 615 HB2 MET 615 -1.130 8.965 -9.718 108 HB3 MET 615 HB3 MET 615 -1.334 7.783 -8.425 109 HG2 MET 615 HG2 MET 615 0.844 8.108 -7.607 110 HG3 MET 615 HG3 MET 615 1.395 8.935 -9.062 111 HE1 MET 615 HE1 MET 615 0.337 11.294 -9.827 112 HE2 MET 615 HE2 MET 615 0.673 12.527 -8.588 113 HE3 MET 615 HE3 MET 615 1.906 11.313 -8.990 114 H THR 616 H THR 616 2.340 7.087 -10.798 115 HA THR 616 HA THR 616 2.106 8.751 -13.087 116 HB THR 616 HB THR 616 4.224 8.365 -11.835 117 HG1 THR 616 HG1 THR 616 4.008 7.984 -14.613 118 HG21 THR 616 HG21 THR 616 4.461 5.764 -13.424 119 HG22 THR 616 HG22 THR 616 4.066 5.830 -11.700 120 HG23 THR 616 HG23 THR 616 5.621 6.452 -12.273 121 H GLY 617 H GLY 617 1.100 5.481 -12.707 122 HA2 GLY 617 HA2 GLY 617 0.861 5.165 -15.671 123 HA3 GLY 617 HA3 GLY 617 1.406 3.853 -14.625 124 H LYS 618 H LYS 618 -0.849 5.356 -12.710 125 HA LYS 618 HA LYS 618 -3.199 4.033 -13.970 126 HB2 LYS 618 HB2 LYS 618 -2.361 4.012 -11.029 127 HB3 LYS 618 HB3 LYS 618 -3.876 3.383 -11.658 128 HG2 LYS 618 HG2 LYS 618 -2.393 1.909 -13.227 129 HG3 LYS 618 HG3 LYS 618 -1.057 2.359 -12.152 130 HD2 LYS 618 HD2 LYS 618 -2.531 1.460 -10.229 131 HD3 LYS 618 HD3 LYS 618 -3.566 0.770 -11.482 132 HE2 LYS 618 HE2 LYS 618 -0.593 0.221 -11.040 133 HE3 LYS 618 HE3 LYS 618 -1.921 -0.887 -10.671 134 HZ1 LYS 618 HZ1 LYS 618 -2.407 -0.986 -13.033 135 HZ2 LYS 618 HZ2 LYS 618 -0.843 -1.423 -12.757 136 HZ3 LYS 618 HZ3 LYS 618 -1.185 0.064 -13.369 137 HA PRO 619 HA PRO 619 -5.063 7.957 -13.431 138 HB2 PRO 619 HB2 PRO 619 -7.744 7.390 -13.139 139 HB3 PRO 619 HB3 PRO 619 -6.856 7.169 -14.678 140 HG2 PRO 619 HG2 PRO 619 -7.442 5.074 -12.553 141 HG3 PRO 619 HG3 PRO 619 -7.731 4.961 -14.321 142 HD2 PRO 619 HD2 PRO 619 -5.513 3.905 -13.199 143 HD3 PRO 619 HD3 PRO 619 -5.409 4.753 -14.772 144 H LYS 620 H LYS 620 -5.901 9.407 -11.866 145 HA LYS 620 HA LYS 620 -5.277 8.945 -9.187 146 HB2 LYS 620 HB2 LYS 620 -5.563 11.116 -10.442 147 HB3 LYS 620 HB3 LYS 620 -7.302 10.977 -10.237 148 HG2 LYS 620 HG2 LYS 620 -5.498 10.851 -7.793 149 HG3 LYS 620 HG3 LYS 620 -5.707 12.387 -8.628 150 HD2 LYS 620 HD2 LYS 620 -8.206 12.149 -8.373 151 HD3 LYS 620 HD3 LYS 620 -7.907 10.753 -7.311 152 HE2 LYS 620 HE2 LYS 620 -6.562 12.151 -5.806 153 HE3 LYS 620 HE3 LYS 620 -6.709 13.536 -6.905 154 HZ1 LYS 620 HZ1 LYS 620 -8.264 13.653 -5.045 155 HZ2 LYS 620 HZ2 LYS 620 -8.943 12.224 -5.482 156 HZ3 LYS 620 HZ3 LYS 620 -9.093 13.525 -6.470 157 H SER 621 H SER 621 -8.391 8.373 -10.861 158 HA SER 621 HA SER 621 -10.114 7.833 -8.838 159 HB2 SER 621 HB2 SER 621 -9.844 6.138 -11.333 160 HB3 SER 621 HB3 SER 621 -11.322 6.617 -10.470 161 HG SER 621 HG SER 621 -11.092 7.945 -12.257 162 H ALA 622 H ALA 622 -7.363 5.793 -9.901 163 HA ALA 622 HA ALA 622 -8.210 3.337 -8.714 164 HB1 ALA 622 HB1 ALA 622 -6.407 3.475 -10.407 165 HB2 ALA 622 HB2 ALA 622 -5.379 4.353 -9.255 166 HB3 ALA 622 HB3 ALA 622 -5.858 2.680 -8.918 167 H ARG 623 H ARG 623 -5.779 5.750 -7.507 168 HA ARG 623 HA ARG 623 -5.898 4.692 -4.826 169 HB2 ARG 623 HB2 ARG 623 -4.672 6.643 -4.109 170 HB3 ARG 623 HB3 ARG 623 -3.962 5.989 -5.576 171 HG2 ARG 623 HG2 ARG 623 -5.044 7.787 -6.894 172 HG3 ARG 623 HG3 ARG 623 -5.725 8.479 -5.410 173 HD2 ARG 623 HD2 ARG 623 -2.756 8.143 -6.039 174 HD3 ARG 623 HD3 ARG 623 -3.680 9.639 -6.235 175 HE ARG 623 HE ARG 623 -4.008 8.783 -3.573 176 HH11 ARG 623 HH11 ARG 623 -1.404 10.088 -5.652 177 HH12 ARG 623 HH12 ARG 623 -0.508 10.729 -4.322 178 HH21 ARG 623 HH21 ARG 623 -2.723 9.662 -1.806 179 HH22 ARG 623 HH22 ARG 623 -1.175 10.367 -2.175 180 H GLU 624 H GLU 624 -7.891 7.190 -6.455 181 HA GLU 624 HA GLU 624 -9.145 8.211 -4.216 182 HB2 GLU 624 HB2 GLU 624 -9.483 8.858 -6.679 183 HB3 GLU 624 HB3 GLU 624 -10.650 7.538 -6.762 184 HG2 GLU 624 HG2 GLU 624 -11.799 9.633 -6.433 185 HG3 GLU 624 HG3 GLU 624 -12.032 8.585 -5.034 186 H LYS 625 H LYS 625 -9.931 5.111 -5.850 187 HA LYS 625 HA LYS 625 -11.870 4.565 -3.628 188 HB2 LYS 625 HB2 LYS 625 -12.697 2.705 -4.828 189 HB3 LYS 625 HB3 LYS 625 -12.720 4.147 -5.841 190 HG2 LYS 625 HG2 LYS 625 -10.764 3.292 -7.105 191 HG3 LYS 625 HG3 LYS 625 -10.641 1.917 -6.010 192 HD2 LYS 625 HD2 LYS 625 -11.707 1.180 -8.025 193 HD3 LYS 625 HD3 LYS 625 -12.893 1.142 -6.711 194 HE2 LYS 625 HE2 LYS 625 -13.832 3.306 -7.506 195 HE3 LYS 625 HE3 LYS 625 -12.635 3.344 -8.809 196 HZ1 LYS 625 HZ1 LYS 625 -14.726 1.277 -8.467 197 HZ2 LYS 625 HZ2 LYS 625 -13.621 1.315 -9.681 198 HZ3 LYS 625 HZ3 LYS 625 -14.757 2.496 -9.565 199 H MET 626 H MET 626 -8.723 3.313 -4.802 200 HA MET 626 HA MET 626 -8.825 0.936 -3.204 201 HB2 MET 626 HB2 MET 626 -6.503 2.451 -4.459 202 HB3 MET 626 HB3 MET 626 -6.331 0.914 -3.615 203 HG2 MET 626 HG2 MET 626 -7.881 -0.162 -5.199 204 HG3 MET 626 HG3 MET 626 -8.120 1.359 -6.038 205 HE1 MET 626 HE1 MET 626 -5.816 -1.746 -5.503 206 HE2 MET 626 HE2 MET 626 -4.263 -1.207 -6.175 207 HE3 MET 626 HE3 MET 626 -4.859 -0.503 -4.659 208 H MET 627 H MET 627 -7.567 4.258 -2.614 209 HA MET 627 HA MET 627 -6.311 3.705 -0.131 210 HB2 MET 627 HB2 MET 627 -7.618 6.229 -1.207 211 HB3 MET 627 HB3 MET 627 -6.714 6.161 0.297 212 HG2 MET 627 HG2 MET 627 -5.531 5.364 -2.382 213 HG3 MET 627 HG3 MET 627 -5.396 6.977 -1.683 214 HE1 MET 627 HE1 MET 627 -2.778 6.707 -2.180 215 HE2 MET 627 HE2 MET 627 -1.778 5.416 -1.479 216 HE3 MET 627 HE3 MET 627 -2.991 5.021 -2.717 217 H LYS 628 H LYS 628 -9.586 4.461 -1.058 218 HA LYS 628 HA LYS 628 -10.578 4.924 1.649 219 HB2 LYS 628 HB2 LYS 628 -12.080 4.364 -0.938 220 HB3 LYS 628 HB3 LYS 628 -12.893 4.575 0.624 221 HG2 LYS 628 HG2 LYS 628 -11.912 6.802 0.909 222 HG3 LYS 628 HG3 LYS 628 -10.982 6.593 -0.586 223 HD2 LYS 628 HD2 LYS 628 -13.162 6.370 -1.843 224 HD3 LYS 628 HD3 LYS 628 -14.030 6.686 -0.334 225 HE2 LYS 628 HE2 LYS 628 -13.806 8.657 -1.863 226 HE3 LYS 628 HE3 LYS 628 -13.199 8.939 -0.219 227 HZ1 LYS 628 HZ1 LYS 628 -11.018 8.870 -0.979 228 HZ2 LYS 628 HZ2 LYS 628 -11.749 9.629 -2.269 229 HZ3 LYS 628 HZ3 LYS 628 -11.398 8.036 -2.345 230 H ILE 629 H ILE 629 -10.614 2.108 -0.547 231 HA ILE 629 HA ILE 629 -11.828 0.296 1.257 232 HB ILE 629 HB ILE 629 -9.778 -0.121 -0.942 233 HG12 ILE 629 HG12 ILE 629 -12.655 -1.131 -0.867 234 HG13 ILE 629 HG13 ILE 629 -12.301 0.530 -1.369 235 HG21 ILE 629 HG21 ILE 629 -10.264 -2.582 -0.766 236 HG22 ILE 629 HG22 ILE 629 -9.413 -1.965 0.637 237 HG23 ILE 629 HG23 ILE 629 -11.164 -2.265 0.729 238 HD11 ILE 629 HD11 ILE 629 -10.876 -0.251 -3.164 239 HD12 ILE 629 HD12 ILE 629 -11.172 -1.941 -2.677 240 HD13 ILE 629 HD13 ILE 629 -12.517 -0.938 -3.252 241 H ILE 630 H ILE 630 -8.208 0.720 0.803 242 HA ILE 630 HA ILE 630 -7.702 -0.849 3.106 243 HB ILE 630 HB ILE 630 -5.412 0.138 3.146 244 HG12 ILE 630 HG12 ILE 630 -4.950 1.343 0.763 245 HG13 ILE 630 HG13 ILE 630 -6.562 1.924 1.029 246 HG21 ILE 630 HG21 ILE 630 -4.714 -1.017 1.150 247 HG22 ILE 630 HG22 ILE 630 -5.999 -1.909 1.970 248 HG23 ILE 630 HG23 ILE 630 -6.374 -0.972 0.503 249 HD11 ILE 630 HD11 ILE 630 -4.885 3.512 1.868 250 HD12 ILE 630 HD12 ILE 630 -5.869 2.924 3.205 251 HD13 ILE 630 HD13 ILE 630 -4.239 2.274 2.968 252 H GLU 631 H GLU 631 -8.581 2.602 3.021 253 HA GLU 631 HA GLU 631 -7.647 3.286 5.615 254 HB2 GLU 631 HB2 GLU 631 -9.646 4.300 3.589 255 HB3 GLU 631 HB3 GLU 631 -9.714 4.913 5.217 256 HG2 GLU 631 HG2 GLU 631 -7.463 5.762 5.110 257 HG3 GLU 631 HG3 GLU 631 -7.170 4.974 3.564 258 H ILE 632 H ILE 632 -10.797 2.018 4.339 259 HA ILE 632 HA ILE 632 -12.016 1.801 6.926 260 HB ILE 632 HB ILE 632 -12.530 0.156 4.415 261 HG12 ILE 632 HG12 ILE 632 -14.377 2.347 5.374 262 HG13 ILE 632 HG13 ILE 632 -12.961 2.805 4.449 263 HG21 ILE 632 HG21 ILE 632 -13.433 -1.057 6.253 264 HG22 ILE 632 HG22 ILE 632 -14.037 0.399 7.057 265 HG23 ILE 632 HG23 ILE 632 -14.817 -0.202 5.586 266 HD11 ILE 632 HD11 ILE 632 -15.054 0.806 3.491 267 HD12 ILE 632 HD12 ILE 632 -14.911 2.503 2.984 268 HD13 ILE 632 HD13 ILE 632 -13.630 1.344 2.586 269 H ILE 633 H ILE 633 -9.971 -0.483 5.002 270 HA ILE 633 HA ILE 633 -10.464 -2.668 6.788 271 HB ILE 633 HB ILE 633 -8.060 -2.381 4.952 272 HG12 ILE 633 HG12 ILE 633 -10.908 -3.187 4.361 273 HG13 ILE 633 HG13 ILE 633 -9.870 -2.055 3.533 274 HG21 ILE 633 HG21 ILE 633 -8.090 -4.290 6.694 275 HG22 ILE 633 HG22 ILE 633 -9.508 -4.900 5.830 276 HG23 ILE 633 HG23 ILE 633 -7.994 -4.804 4.997 277 HD11 ILE 633 HD11 ILE 633 -9.597 -5.041 3.326 278 HD12 ILE 633 HD12 ILE 633 -10.110 -3.879 2.097 279 HD13 ILE 633 HD13 ILE 633 -8.453 -3.825 2.676 280 H ASP 634 H ASP 634 -7.832 -0.203 6.607 281 HA ASP 634 HA ASP 634 -6.312 -1.329 8.714 282 HB2 ASP 634 HB2 ASP 634 -5.637 0.396 6.904 283 HB3 ASP 634 HB3 ASP 634 -6.332 1.619 7.963 284 H SER 635 H SER 635 -8.858 1.194 8.585 285 HA SER 635 HA SER 635 -8.794 1.896 11.337 286 HB2 SER 635 HB2 SER 635 -11.173 2.038 9.443 287 HB3 SER 635 HB3 SER 635 -10.941 2.961 10.940 288 HG SER 635 HG SER 635 -9.559 3.130 8.468 289 H LEU 636 H LEU 636 -10.347 -0.798 9.672 290 HA LEU 636 HA LEU 636 -11.857 -1.597 12.042 291 HB2 LEU 636 HB2 LEU 636 -11.317 -2.845 9.354 292 HB3 LEU 636 HB3 LEU 636 -12.129 -3.748 10.636 293 HG LEU 636 HG LEU 636 -13.171 -1.025 9.750 294 HD11 LEU 636 HD11 LEU 636 -14.603 -2.019 8.198 295 HD12 LEU 636 HD12 LEU 636 -14.085 -3.675 8.617 296 HD13 LEU 636 HD13 LEU 636 -12.972 -2.547 7.796 297 HD21 LEU 636 HD21 LEU 636 -15.289 -1.867 10.636 298 HD22 LEU 636 HD22 LEU 636 -14.047 -1.892 11.890 299 HD23 LEU 636 HD23 LEU 636 -14.517 -3.406 11.086 300 H ALA 637 H ALA 637 -8.973 -2.824 10.257 301 HA ALA 637 HA ALA 637 -8.427 -5.010 11.959 302 HB1 ALA 637 HB1 ALA 637 -6.530 -3.411 10.193 303 HB2 ALA 637 HB2 ALA 637 -6.231 -5.035 10.851 304 HB3 ALA 637 HB3 ALA 637 -7.537 -4.785 9.673 305 H VAL 638 H VAL 638 -7.493 -1.574 12.291 306 HA VAL 638 HA VAL 638 -5.499 -1.989 14.275 307 HB VAL 638 HB VAL 638 -6.019 0.092 12.884 308 HG11 VAL 638 HG11 VAL 638 -7.489 1.773 13.758 309 HG12 VAL 638 HG12 VAL 638 -8.417 0.278 13.574 310 HG13 VAL 638 HG13 VAL 638 -7.886 0.792 15.186 311 HG21 VAL 638 HG21 VAL 638 -5.058 1.623 14.503 312 HG22 VAL 638 HG22 VAL 638 -5.451 0.521 15.840 313 HG23 VAL 638 HG23 VAL 638 -4.267 0.043 14.603 314 H SER 639 H SER 639 -8.862 -2.594 14.505 315 HA SER 639 HA SER 639 -8.682 -2.807 17.464 316 HB2 SER 639 HB2 SER 639 -10.006 -0.818 16.823 317 HB3 SER 639 HB3 SER 639 -11.032 -1.835 15.788 318 HG SER 639 HG SER 639 -11.355 -3.103 17.761 319 H SER 640 H SER 640 -8.365 -4.838 15.028 320 HA SER 640 HA SER 640 -10.304 -6.820 16.036 321 HB2 SER 640 HB2 SER 640 -11.475 -5.454 14.273 322 HB3 SER 640 HB3 SER 640 -10.204 -5.910 13.128 323 HG SER 640 HG SER 640 -11.592 -7.442 12.731 324 H GLU 641 H GLU 641 -9.993 -8.897 14.752 325 HA GLU 641 HA GLU 641 -7.176 -9.679 14.427 326 HB2 GLU 641 HB2 GLU 641 -9.762 -11.051 13.553 327 HB3 GLU 641 HB3 GLU 641 -8.157 -11.785 13.581 328 HG2 GLU 641 HG2 GLU 641 -8.110 -11.591 16.055 329 HG3 GLU 641 HG3 GLU 641 -9.723 -10.857 16.031 330 H CYS 642 H CYS 642 -9.904 -8.620 12.482 331 HA CYS 642 HA CYS 642 -8.444 -8.051 10.072 332 HB2 CYS 642 HB2 CYS 642 -9.825 -9.724 8.732 333 HB3 CYS 642 HB3 CYS 642 -8.529 -10.389 9.712 334 H ALA 643 H ALA 643 -9.921 -7.198 8.461 335 HA ALA 643 HA ALA 643 -12.233 -5.726 9.594 336 HB1 ALA 643 HB1 ALA 643 -12.231 -4.612 7.406 337 HB2 ALA 643 HB2 ALA 643 -10.569 -4.633 8.062 338 HB3 ALA 643 HB3 ALA 643 -11.082 -5.788 6.799 339 H LYS 644 H LYS 644 -14.315 -6.541 9.460 340 HA LYS 644 HA LYS 644 -14.946 -8.890 7.946 341 HB2 LYS 644 HB2 LYS 644 -17.214 -8.504 8.717 342 HB3 LYS 644 HB3 LYS 644 -16.024 -8.427 10.026 343 HG2 LYS 644 HG2 LYS 644 -16.131 -5.806 9.500 344 HG3 LYS 644 HG3 LYS 644 -17.709 -6.265 8.814 345 HD2 LYS 644 HD2 LYS 644 -18.365 -7.213 10.977 346 HD3 LYS 644 HD3 LYS 644 -16.748 -6.899 11.628 347 HE2 LYS 644 HE2 LYS 644 -18.016 -5.060 12.402 348 HE3 LYS 644 HE3 LYS 644 -17.041 -4.473 11.042 349 HZ1 LYS 644 HZ1 LYS 644 -19.020 -3.589 10.516 350 HZ2 LYS 644 HZ2 LYS 644 -19.935 -4.824 11.167 351 HZ3 LYS 644 HZ3 LYS 644 -19.158 -4.977 9.708 352 H VAL 645 H VAL 645 -15.461 -8.987 5.856 353 HA VAL 645 HA VAL 645 -15.319 -6.730 4.125 354 HB VAL 645 HB VAL 645 -16.314 -9.565 3.711 355 HG11 VAL 645 HG11 VAL 645 -15.962 -9.105 1.234 356 HG12 VAL 645 HG12 VAL 645 -17.403 -8.406 1.954 357 HG13 VAL 645 HG13 VAL 645 -16.000 -7.368 1.637 358 HG21 VAL 645 HG21 VAL 645 -13.733 -8.126 2.950 359 HG22 VAL 645 HG22 VAL 645 -13.914 -9.331 4.226 360 HG23 VAL 645 HG23 VAL 645 -14.152 -9.797 2.535 361 H LYS 646 H LYS 646 -18.025 -8.024 5.910 362 HA LYS 646 HA LYS 646 -20.151 -6.798 4.439 363 HB2 LYS 646 HB2 LYS 646 -19.937 -7.198 7.466 364 HB3 LYS 646 HB3 LYS 646 -21.414 -6.950 6.538 365 HG2 LYS 646 HG2 LYS 646 -19.596 -9.391 6.525 366 HG3 LYS 646 HG3 LYS 646 -21.272 -9.285 7.078 367 HD2 LYS 646 HD2 LYS 646 -21.989 -8.804 4.726 368 HD3 LYS 646 HD3 LYS 646 -20.298 -8.980 4.207 369 HE2 LYS 646 HE2 LYS 646 -20.317 -11.289 5.297 370 HE3 LYS 646 HE3 LYS 646 -22.082 -11.157 5.374 371 HZ1 LYS 646 HZ1 LYS 646 -22.091 -11.056 2.945 372 HZ2 LYS 646 HZ2 LYS 646 -21.005 -12.282 3.367 373 HZ3 LYS 646 HZ3 LYS 646 -20.411 -10.934 2.930 374 H ASP 647 H ASP 647 -17.778 -5.476 6.766 375 HA ASP 647 HA ASP 647 -19.296 -3.044 7.072 376 HB2 ASP 647 HB2 ASP 647 -17.301 -4.104 8.596 377 HB3 ASP 647 HB3 ASP 647 -16.313 -3.162 7.557 378 H ILE 648 H ILE 648 -16.506 -4.245 5.248 379 HA ILE 648 HA ILE 648 -15.815 -1.746 4.121 380 HB ILE 648 HB ILE 648 -15.278 -4.436 2.788 381 HG12 ILE 648 HG12 ILE 648 -13.471 -3.150 4.888 382 HG13 ILE 648 HG13 ILE 648 -14.584 -4.459 5.251 383 HG21 ILE 648 HG21 ILE 648 -14.738 -2.388 1.464 384 HG22 ILE 648 HG22 ILE 648 -13.717 -1.801 2.791 385 HG23 ILE 648 HG23 ILE 648 -13.276 -3.262 1.890 386 HD11 ILE 648 HD11 ILE 648 -12.227 -4.628 3.379 387 HD12 ILE 648 HD12 ILE 648 -12.469 -5.469 4.913 388 HD13 ILE 648 HD13 ILE 648 -13.459 -5.879 3.503 389 H LEU 649 H LEU 649 -17.827 -4.419 2.886 390 HA LEU 649 HA LEU 649 -18.688 -3.228 0.482 391 HB2 LEU 649 HB2 LEU 649 -19.797 -5.324 2.356 392 HB3 LEU 649 HB3 LEU 649 -20.842 -4.703 1.093 393 HG LEU 649 HG LEU 649 -18.060 -5.779 0.473 394 HD11 LEU 649 HD11 LEU 649 -20.674 -7.332 0.181 395 HD12 LEU 649 HD12 LEU 649 -19.461 -7.629 1.447 396 HD13 LEU 649 HD13 LEU 649 -19.048 -7.875 -0.257 397 HD21 LEU 649 HD21 LEU 649 -19.016 -6.016 -1.808 398 HD22 LEU 649 HD22 LEU 649 -19.137 -4.339 -1.263 399 HD23 LEU 649 HD23 LEU 649 -20.567 -5.366 -1.222 400 H LYS 650 H LYS 650 -20.025 -2.894 3.803 401 HA LYS 650 HA LYS 650 -22.269 -1.263 3.139 402 HB2 LYS 650 HB2 LYS 650 -20.632 -1.872 5.566 403 HB3 LYS 650 HB3 LYS 650 -21.418 -0.326 5.610 404 HG2 LYS 650 HG2 LYS 650 -23.039 -2.742 4.830 405 HG3 LYS 650 HG3 LYS 650 -22.561 -2.560 6.514 406 HD2 LYS 650 HD2 LYS 650 -24.031 -0.358 4.993 407 HD3 LYS 650 HD3 LYS 650 -24.829 -1.647 5.886 408 HE2 LYS 650 HE2 LYS 650 -24.826 -0.101 7.524 409 HE3 LYS 650 HE3 LYS 650 -23.295 -0.896 7.905 410 HZ1 LYS 650 HZ1 LYS 650 -23.264 1.596 7.883 411 HZ2 LYS 650 HZ2 LYS 650 -23.501 1.556 6.250 412 HZ3 LYS 650 HZ3 LYS 650 -22.124 0.998 6.888 413 H GLU 651 H GLU 651 -19.032 -0.199 4.312 414 HA GLU 651 HA GLU 651 -19.800 2.537 3.916 415 HB2 GLU 651 HB2 GLU 651 -17.065 1.335 4.474 416 HB3 GLU 651 HB3 GLU 651 -17.488 3.045 4.611 417 HG2 GLU 651 HG2 GLU 651 -18.503 0.729 6.313 418 HG3 GLU 651 HG3 GLU 651 -17.538 2.107 6.827 419 H ALA 652 H ALA 652 -17.900 0.287 1.853 420 HA ALA 652 HA ALA 652 -17.177 2.349 -0.050 421 HB1 ALA 652 HB1 ALA 652 -17.268 -0.650 -0.303 422 HB2 ALA 652 HB2 ALA 652 -16.557 0.487 -1.474 423 HB3 ALA 652 HB3 ALA 652 -15.877 0.343 0.157 424 H GLN 653 H GLN 653 -20.080 0.185 0.245 425 HA GLN 653 HA GLN 653 -21.240 1.054 -2.241 426 HB2 GLN 653 HB2 GLN 653 -22.412 -0.080 0.316 427 HB3 GLN 653 HB3 GLN 653 -23.430 0.425 -1.016 428 HG2 GLN 653 HG2 GLN 653 -21.198 -1.425 -1.775 429 HG3 GLN 653 HG3 GLN 653 -22.443 -2.095 -0.730 430 HE21 GLN 653 HE21 GLN 653 -22.199 -0.124 -3.840 431 HE22 GLN 653 HE22 GLN 653 -23.722 -0.804 -4.428 432 H GLN 654 H GLN 654 -21.382 2.372 1.103 433 HA GLN 654 HA GLN 654 -23.116 4.564 0.424 434 HB2 GLN 654 HB2 GLN 654 -21.122 4.044 2.637 435 HB3 GLN 654 HB3 GLN 654 -22.023 5.561 2.553 436 HG2 GLN 654 HG2 GLN 654 -24.072 4.581 3.024 437 HG3 GLN 654 HG3 GLN 654 -23.624 3.027 2.329 438 HE21 GLN 654 HE21 GLN 654 -21.511 4.617 4.777 439 HE22 GLN 654 HE22 GLN 654 -21.611 3.291 5.863 440 H VAL 655 H VAL 655 -19.509 4.305 0.382 441 HA VAL 655 HA VAL 655 -19.024 6.953 -0.576 442 HB VAL 655 HB VAL 655 -17.567 4.312 -0.785 443 HG11 VAL 655 HG11 VAL 655 -16.513 6.930 -1.900 444 HG12 VAL 655 HG12 VAL 655 -15.581 5.425 -1.667 445 HG13 VAL 655 HG13 VAL 655 -16.899 5.465 -2.832 446 HG21 VAL 655 HG21 VAL 655 -15.992 5.375 0.753 447 HG22 VAL 655 HG22 VAL 655 -16.856 6.925 0.617 448 HG23 VAL 655 HG23 VAL 655 -17.625 5.539 1.404 449 H GLY 656 H GLY 656 -20.068 4.008 -2.284 450 HA2 GLY 656 HA2 GLY 656 -21.846 4.584 -3.908 451 HA3 GLY 656 HA3 GLY 656 -20.745 5.751 -4.638 452 H ILE 657 H ILE 657 -19.155 2.849 -3.656 453 HA ILE 657 HA ILE 657 -18.699 2.097 -6.468 454 HB ILE 657 HB ILE 657 -17.651 0.982 -3.830 455 HG12 ILE 657 HG12 ILE 657 -16.055 2.721 -5.767 456 HG13 ILE 657 HG13 ILE 657 -16.997 3.457 -4.480 457 HG21 ILE 657 HG21 ILE 657 -17.468 -0.635 -5.676 458 HG22 ILE 657 HG22 ILE 657 -16.622 0.559 -6.674 459 HG23 ILE 657 HG23 ILE 657 -15.883 -0.087 -5.184 460 HD11 ILE 657 HD11 ILE 657 -14.786 1.442 -4.026 461 HD12 ILE 657 HD12 ILE 657 -14.742 3.197 -3.732 462 HD13 ILE 657 HD13 ILE 657 -15.825 2.175 -2.777 463 H GLU 658 H GLU 658 -19.114 -0.386 -7.065 464 HA GLU 658 HA GLU 658 -21.809 -0.985 -6.000 465 HB2 GLU 658 HB2 GLU 658 -21.714 -0.899 -8.354 466 HB3 GLU 658 HB3 GLU 658 -20.289 -1.926 -8.420 467 HG2 GLU 658 HG2 GLU 658 -22.756 -3.050 -7.101 468 HG3 GLU 658 HG3 GLU 658 -22.901 -2.773 -8.812 469 H LYS 659 H LYS 659 -22.203 -2.895 -5.016 470 HA LYS 659 HA LYS 659 -20.798 -4.298 -3.262 471 HB2 LYS 659 HB2 LYS 659 -23.144 -4.656 -3.926 472 HB3 LYS 659 HB3 LYS 659 -22.672 -5.435 -5.421 473 HG2 LYS 659 HG2 LYS 659 -21.818 -6.489 -2.738 474 HG3 LYS 659 HG3 LYS 659 -23.428 -6.842 -3.451 475 HD2 LYS 659 HD2 LYS 659 -20.806 -7.729 -4.590 476 HD3 LYS 659 HD3 LYS 659 -21.832 -8.678 -3.538 477 HE2 LYS 659 HE2 LYS 659 -23.686 -8.602 -5.131 478 HE3 LYS 659 HE3 LYS 659 -22.781 -7.501 -6.172 479 HZ1 LYS 659 HZ1 LYS 659 -21.221 -9.811 -5.648 480 HZ2 LYS 659 HZ2 LYS 659 -21.689 -9.103 -7.048 481 HZ3 LYS 659 HZ3 LYS 659 -22.689 -10.229 -6.337 482 H SER 660 H SER 660 -20.886 -5.340 -6.698 483 HA SER 660 HA SER 660 -19.105 -7.547 -6.002 484 HB2 SER 660 HB2 SER 660 -19.670 -6.854 -8.821 485 HB3 SER 660 HB3 SER 660 -19.564 -8.447 -7.973 486 HG SER 660 HG SER 660 -21.705 -6.527 -8.032 487 H ASN 661 H ASN 661 -18.812 -4.408 -7.623 488 HA ASN 661 HA ASN 661 -16.125 -4.533 -8.426 489 HB2 ASN 661 HB2 ASN 661 -17.552 -2.150 -7.284 490 HB3 ASN 661 HB3 ASN 661 -15.873 -2.220 -7.719 491 HD21 ASN 661 HD21 ASN 661 -18.966 -3.434 -9.429 492 HD22 ASN 661 HD22 ASN 661 -18.444 -2.666 -10.916 493 H ILE 662 H ILE 662 -17.407 -3.986 -5.110 494 HA ILE 662 HA ILE 662 -14.834 -3.331 -3.951 495 HB ILE 662 HB ILE 662 -17.488 -4.214 -2.753 496 HG12 ILE 662 HG12 ILE 662 -16.392 -1.421 -2.544 497 HG13 ILE 662 HG13 ILE 662 -17.147 -1.921 -4.031 498 HG21 ILE 662 HG21 ILE 662 -15.017 -3.201 -1.309 499 HG22 ILE 662 HG22 ILE 662 -16.637 -3.265 -0.582 500 HG23 ILE 662 HG23 ILE 662 -15.854 -4.752 -1.095 501 HD11 ILE 662 HD11 ILE 662 -18.569 -2.032 -1.365 502 HD12 ILE 662 HD12 ILE 662 -18.801 -0.821 -2.641 503 HD13 ILE 662 HD13 ILE 662 -19.229 -2.513 -2.928 504 H GLU 663 H GLU 663 -16.862 -6.182 -4.357 505 HA GLU 663 HA GLU 663 -15.024 -7.777 -2.635 506 HB2 GLU 663 HB2 GLU 663 -16.415 -9.755 -3.236 507 HB3 GLU 663 HB3 GLU 663 -17.229 -8.390 -2.386 508 HG2 GLU 663 HG2 GLU 663 -18.361 -7.771 -4.191 509 HG3 GLU 663 HG3 GLU 663 -17.473 -8.840 -5.298 510 H LYS 664 H LYS 664 -15.494 -7.335 -6.086 511 HA LYS 664 HA LYS 664 -13.282 -8.863 -7.041 512 HB2 LYS 664 HB2 LYS 664 -14.485 -8.002 -8.784 513 HB3 LYS 664 HB3 LYS 664 -14.852 -6.483 -7.975 514 HG2 LYS 664 HG2 LYS 664 -12.884 -5.452 -8.487 515 HG3 LYS 664 HG3 LYS 664 -12.058 -6.984 -8.864 516 HD2 LYS 664 HD2 LYS 664 -13.652 -7.204 -10.857 517 HD3 LYS 664 HD3 LYS 664 -14.178 -5.554 -10.495 518 HE2 LYS 664 HE2 LYS 664 -12.497 -5.421 -12.212 519 HE3 LYS 664 HE3 LYS 664 -11.786 -4.789 -10.719 520 HZ1 LYS 664 HZ1 LYS 664 -10.542 -6.822 -10.450 521 HZ2 LYS 664 HZ2 LYS 664 -10.317 -6.307 -11.966 522 HZ3 LYS 664 HZ3 LYS 664 -11.351 -7.556 -11.681 523 H LEU 665 H LEU 665 -13.380 -5.410 -5.866 524 HA LEU 665 HA LEU 665 -10.664 -5.149 -6.346 525 HB2 LEU 665 HB2 LEU 665 -12.514 -3.324 -5.894 526 HB3 LEU 665 HB3 LEU 665 -12.031 -3.438 -4.223 527 HG LEU 665 HG LEU 665 -10.002 -2.373 -4.629 528 HD11 LEU 665 HD11 LEU 665 -8.941 -3.804 -6.271 529 HD12 LEU 665 HD12 LEU 665 -8.873 -2.140 -6.838 530 HD13 LEU 665 HD13 LEU 665 -10.065 -3.254 -7.544 531 HD21 LEU 665 HD21 LEU 665 -10.443 -0.458 -6.037 532 HD22 LEU 665 HD22 LEU 665 -12.017 -0.949 -5.386 533 HD23 LEU 665 HD23 LEU 665 -11.589 -1.373 -7.042 534 H LEU 666 H LEU 666 -12.311 -6.005 -3.320 535 HA LEU 666 HA LEU 666 -10.043 -6.331 -1.635 536 HB2 LEU 666 HB2 LEU 666 -12.731 -7.756 -1.811 537 HB3 LEU 666 HB3 LEU 666 -11.578 -8.080 -0.523 538 HG LEU 666 HG LEU 666 -12.617 -5.264 -1.066 539 HD11 LEU 666 HD11 LEU 666 -14.181 -5.674 0.821 540 HD12 LEU 666 HD12 LEU 666 -13.695 -7.389 0.823 541 HD13 LEU 666 HD13 LEU 666 -14.538 -6.702 -0.575 542 HD21 LEU 666 HD21 LEU 666 -11.901 -4.884 1.220 543 HD22 LEU 666 HD22 LEU 666 -10.535 -5.419 0.256 544 HD23 LEU 666 HD23 LEU 666 -11.325 -6.558 1.376 545 H THR 667 H THR 667 -11.562 -8.595 -3.996 546 HA THR 667 HA THR 667 -9.844 -10.803 -3.420 547 HB THR 667 HB THR 667 -11.334 -10.012 -5.962 548 HG1 THR 667 HG1 THR 667 -12.738 -10.452 -4.393 549 HG21 THR 667 HG21 THR 667 -11.008 -12.422 -6.562 550 HG22 THR 667 HG22 THR 667 -9.766 -12.500 -5.281 551 HG23 THR 667 HG23 THR 667 -9.552 -11.417 -6.658 552 H ASP 668 H ASP 668 -9.651 -8.189 -5.878 553 HA ASP 668 HA ASP 668 -7.203 -8.964 -7.023 554 HB2 ASP 668 HB2 ASP 668 -9.024 -6.627 -7.023 555 HB3 ASP 668 HB3 ASP 668 -7.346 -6.236 -7.383 556 H MET 669 H MET 669 -7.893 -6.777 -4.298 557 HA MET 669 HA MET 669 -5.274 -5.884 -3.750 558 HB2 MET 669 HB2 MET 669 -7.654 -6.376 -1.918 559 HB3 MET 669 HB3 MET 669 -6.149 -5.638 -1.397 560 HG2 MET 669 HG2 MET 669 -7.003 -4.196 -3.697 561 HG3 MET 669 HG3 MET 669 -8.406 -4.407 -2.647 562 HE1 MET 669 HE1 MET 669 -8.460 -1.697 -2.583 563 HE2 MET 669 HE2 MET 669 -7.081 -0.742 -1.979 564 HE3 MET 669 HE3 MET 669 -6.932 -1.656 -3.497 565 H ARG 670 H ARG 670 -7.008 -8.768 -2.304 566 HA ARG 670 HA ARG 670 -4.612 -9.545 -0.891 567 HB2 ARG 670 HB2 ARG 670 -5.681 -11.639 -0.368 568 HB3 ARG 670 HB3 ARG 670 -6.798 -10.313 -0.090 569 HG2 ARG 670 HG2 ARG 670 -8.199 -10.898 -1.806 570 HG3 ARG 670 HG3 ARG 670 -6.982 -11.809 -2.693 571 HD2 ARG 670 HD2 ARG 670 -7.166 -13.693 -1.449 572 HD3 ARG 670 HD3 ARG 670 -7.671 -12.829 0.008 573 HE ARG 670 HE ARG 670 -9.867 -12.816 -0.631 574 HH11 ARG 670 HH11 ARG 670 -8.027 -14.338 -3.232 575 HH12 ARG 670 HH12 ARG 670 -9.396 -14.520 -4.281 576 HH21 ARG 670 HH21 ARG 670 -11.591 -12.857 -2.021 577 HH22 ARG 670 HH22 ARG 670 -11.475 -13.425 -3.645 578 H LYS 671 H LYS 671 -5.921 -10.347 -4.020 579 HA LYS 671 HA LYS 671 -4.050 -12.386 -4.721 580 HB2 LYS 671 HB2 LYS 671 -6.328 -12.015 -5.631 581 HB3 LYS 671 HB3 LYS 671 -5.812 -10.495 -6.328 582 HG2 LYS 671 HG2 LYS 671 -4.056 -12.575 -7.294 583 HG3 LYS 671 HG3 LYS 671 -5.678 -13.178 -7.286 584 HD2 LYS 671 HD2 LYS 671 -4.996 -12.104 -9.488 585 HD3 LYS 671 HD3 LYS 671 -6.485 -11.492 -8.780 586 HE2 LYS 671 HE2 LYS 671 -5.232 -9.634 -9.690 587 HE3 LYS 671 HE3 LYS 671 -5.355 -9.484 -7.958 588 HZ1 LYS 671 HZ1 LYS 671 -3.194 -8.977 -8.391 589 HZ2 LYS 671 HZ2 LYS 671 -2.970 -10.186 -9.511 590 HZ3 LYS 671 HZ3 LYS 671 -3.047 -10.532 -7.897 591 H SER 672 H SER 672 -3.836 -8.940 -4.721 592 HA SER 672 HA SER 672 -1.223 -9.031 -6.167 593 HB2 SER 672 HB2 SER 672 -2.772 -6.551 -5.406 594 HB3 SER 672 HB3 SER 672 -1.475 -6.726 -6.608 595 HG SER 672 HG SER 672 -4.150 -7.648 -6.620 596 H GLY 673 H GLY 673 -2.360 -8.765 -2.893 597 HA2 GLY 673 HA2 GLY 673 -0.786 -9.436 -1.233 598 HA3 GLY 673 HA3 GLY 673 0.508 -8.601 -2.096 599 H ILE 674 H ILE 674 -2.307 -6.713 -2.043 600 HA ILE 674 HA ILE 674 -1.151 -4.702 -0.285 601 HB ILE 674 HB ILE 674 -3.967 -4.971 -1.437 602 HG12 ILE 674 HG12 ILE 674 -1.574 -3.568 -2.684 603 HG13 ILE 674 HG13 ILE 674 -2.350 -5.040 -3.270 604 HG21 ILE 674 HG21 ILE 674 -4.058 -2.477 -1.121 605 HG22 ILE 674 HG22 ILE 674 -3.837 -3.323 0.393 606 HG23 ILE 674 HG23 ILE 674 -2.447 -2.536 -0.379 607 HD11 ILE 674 HD11 ILE 674 -4.472 -3.750 -3.619 608 HD12 ILE 674 HD12 ILE 674 -3.548 -2.265 -3.289 609 HD13 ILE 674 HD13 ILE 674 -3.110 -3.295 -4.657 610 H ILE 675 H ILE 675 -3.573 -7.271 -0.069 611 HA ILE 675 HA ILE 675 -3.738 -6.923 2.836 612 HB ILE 675 HB ILE 675 -6.119 -6.973 2.929 613 HG12 ILE 675 HG12 ILE 675 -6.110 -7.415 -0.043 614 HG13 ILE 675 HG13 ILE 675 -6.674 -8.510 1.217 615 HG21 ILE 675 HG21 ILE 675 -5.676 -4.943 0.702 616 HG22 ILE 675 HG22 ILE 675 -6.668 -4.820 2.161 617 HG23 ILE 675 HG23 ILE 675 -4.927 -4.714 2.261 618 HD11 ILE 675 HD11 ILE 675 -8.466 -6.936 1.816 619 HD12 ILE 675 HD12 ILE 675 -7.967 -5.864 0.478 620 HD13 ILE 675 HD13 ILE 675 -8.564 -7.483 0.126 621 H TYR 676 H TYR 676 -5.146 -8.833 3.647 622 HA TYR 676 HA TYR 676 -4.343 -11.378 2.350 623 HB2 TYR 676 HB2 TYR 676 -4.567 -10.521 5.281 624 HB3 TYR 676 HB3 TYR 676 -3.976 -12.089 4.729 625 HD1 TYR 676 HD1 TYR 676 -1.842 -10.604 2.744 626 HD2 TYR 676 HD2 TYR 676 -2.978 -10.430 6.902 627 HE1 TYR 676 HE1 TYR 676 0.489 -10.145 3.382 628 HE2 TYR 676 HE2 TYR 676 -0.664 -9.997 7.562 629 HH TYR 676 HH TYR 676 2.023 -9.919 5.159 630 H GLU 677 H GLU 677 -5.925 -13.189 3.002 631 HA GLU 677 HA GLU 677 -8.509 -12.225 4.040 632 HB2 GLU 677 HB2 GLU 677 -7.655 -14.484 2.444 633 HB3 GLU 677 HB3 GLU 677 -8.319 -15.099 3.946 634 HG2 GLU 677 HG2 GLU 677 -9.715 -13.059 2.172 635 HG3 GLU 677 HG3 GLU 677 -9.878 -14.806 2.025 636 H ALA 678 H ALA 678 -9.199 -13.643 5.994 637 HA ALA 678 HA ALA 678 -6.966 -14.834 7.487 638 HB1 ALA 678 HB1 ALA 678 -7.026 -12.525 8.409 639 HB2 ALA 678 HB2 ALA 678 -8.739 -12.747 8.833 640 HB3 ALA 678 HB3 ALA 678 -7.493 -13.731 9.626 641 H LYS 679 H LYS 679 -10.499 -14.257 7.225 642 HA LYS 679 HA LYS 679 -11.092 -16.996 7.948 643 HB2 LYS 679 HB2 LYS 679 -12.268 -14.693 9.605 644 HB3 LYS 679 HB3 LYS 679 -12.734 -16.391 9.705 645 HG2 LYS 679 HG2 LYS 679 -10.435 -16.947 10.529 646 HG3 LYS 679 HG3 LYS 679 -10.031 -15.218 10.480 647 HD2 LYS 679 HD2 LYS 679 -11.881 -14.763 12.095 648 HD3 LYS 679 HD3 LYS 679 -12.131 -16.523 12.248 649 HE2 LYS 679 HE2 LYS 679 -9.760 -16.785 12.967 650 HE3 LYS 679 HE3 LYS 679 -9.506 -15.047 12.748 651 HZ1 LYS 679 HZ1 LYS 679 -11.118 -14.621 14.495 652 HZ2 LYS 679 HZ2 LYS 679 -9.855 -15.336 15.007 653 HZ3 LYS 679 HZ3 LYS 679 -11.246 -16.266 14.810 654 HA PRO 680 HA PRO 680 -13.315 -15.984 4.435 655 HB2 PRO 680 HB2 PRO 680 -15.860 -17.171 4.702 656 HB3 PRO 680 HB3 PRO 680 -14.352 -17.941 4.125 657 HG2 PRO 680 HG2 PRO 680 -15.528 -17.956 6.909 658 HG3 PRO 680 HG3 PRO 680 -14.775 -19.313 6.010 659 HD2 PRO 680 HD2 PRO 680 -13.391 -17.978 7.903 660 HD3 PRO 680 HD3 PRO 680 -12.581 -18.430 6.368 661 H GLU 681 H GLU 681 -13.709 -14.015 3.992 662 HA GLU 681 HA GLU 681 -14.739 -12.037 3.667 663 HB2 GLU 681 HB2 GLU 681 -17.147 -13.201 5.094 664 HB3 GLU 681 HB3 GLU 681 -17.041 -11.532 4.593 665 HG2 GLU 681 HG2 GLU 681 -16.488 -12.373 2.235 666 HG3 GLU 681 HG3 GLU 681 -17.041 -13.961 2.802 667 H CYS 682 H CYS 682 -12.926 -12.740 5.947 668 HA CYS 682 HA CYS 682 -13.216 -10.076 7.187 669 HB2 CYS 682 HB2 CYS 682 -13.958 -11.939 8.717 670 HB3 CYS 682 HB3 CYS 682 -12.305 -12.541 8.687 671 H TYR 683 H TYR 683 -11.760 -9.152 5.828 672 HA TYR 683 HA TYR 683 -9.247 -10.600 5.120 673 HB2 TYR 683 HB2 TYR 683 -10.642 -8.173 3.926 674 HB3 TYR 683 HB3 TYR 683 -9.020 -8.661 3.508 675 HD1 TYR 683 HD1 TYR 683 -12.086 -10.930 3.893 676 HD2 TYR 683 HD2 TYR 683 -9.098 -9.264 1.267 677 HE1 TYR 683 HE1 TYR 683 -13.012 -12.200 2.056 678 HE2 TYR 683 HE2 TYR 683 -10.091 -10.483 -0.627 679 HH TYR 683 HH TYR 683 -13.000 -12.545 -0.173 680 H LYS 684 H LYS 684 -7.235 -9.408 5.340 681 HA LYS 684 HA LYS 684 -7.367 -7.172 7.312 682 HB2 LYS 684 HB2 LYS 684 -6.836 -9.368 8.400 683 HB3 LYS 684 HB3 LYS 684 -5.345 -9.456 7.461 684 HG2 LYS 684 HG2 LYS 684 -5.825 -6.864 8.862 685 HG3 LYS 684 HG3 LYS 684 -5.718 -8.253 9.936 686 HD2 LYS 684 HD2 LYS 684 -3.510 -8.763 9.384 687 HD3 LYS 684 HD3 LYS 684 -3.565 -7.844 7.871 688 HE2 LYS 684 HE2 LYS 684 -3.894 -5.740 9.266 689 HE3 LYS 684 HE3 LYS 684 -3.596 -6.719 10.710 690 HZ1 LYS 684 HZ1 LYS 684 -1.685 -5.999 8.538 691 HZ2 LYS 684 HZ2 LYS 684 -1.378 -7.233 9.594 692 HZ3 LYS 684 HZ3 LYS 684 -1.578 -5.679 10.099 693 H LYS 685 H LYS 685 -6.456 -5.452 6.487 694 HA LYS 685 HA LYS 685 -4.795 -5.710 4.101 695 HB2 LYS 685 HB2 LYS 685 -4.568 -3.332 4.018 696 HB3 LYS 685 HB3 LYS 685 -6.241 -3.755 4.198 697 HG2 LYS 685 HG2 LYS 685 -5.934 -1.903 5.581 698 HG3 LYS 685 HG3 LYS 685 -6.010 -3.270 6.700 699 HD2 LYS 685 HD2 LYS 685 -4.316 -1.701 7.309 700 HD3 LYS 685 HD3 LYS 685 -3.535 -3.197 6.924 701 HE2 LYS 685 HE2 LYS 685 -2.761 -2.399 4.808 702 HE3 LYS 685 HE3 LYS 685 -3.775 -0.951 4.913 703 HZ1 LYS 685 HZ1 LYS 685 -1.450 -1.791 6.526 704 HZ2 LYS 685 HZ2 LYS 685 -2.448 -0.489 7.020 705 HZ3 LYS 685 HZ3 LYS 685 -1.541 -0.409 5.623 706 H VAL 686 H VAL 686 -2.544 -4.966 3.963 707 HA VAL 686 HA VAL 686 -1.372 -6.567 6.041 708 HB VAL 686 HB VAL 686 -0.791 -6.715 3.682 709 HG11 VAL 686 HG11 VAL 686 0.938 -4.253 4.080 710 HG12 VAL 686 HG12 VAL 686 0.749 -5.240 2.606 711 HG13 VAL 686 HG13 VAL 686 -0.588 -4.238 3.200 712 HG21 VAL 686 HG21 VAL 686 1.458 -7.347 4.083 713 HG22 VAL 686 HG22 VAL 686 1.629 -6.176 5.420 714 HG23 VAL 686 HG23 VAL 686 0.575 -7.574 5.614 Start of MODEL 6 1 H1 GLY 600 H1 GLY 600 20.448 7.919 5.993 2 H2 GLY 600 H2 GLY 600 21.154 7.021 4.787 3 H3 GLY 600 H3 GLY 600 19.866 6.453 5.619 4 HA2 GLY 600 HA2 GLY 600 22.588 6.848 6.670 5 HA3 GLY 600 HA3 GLY 600 21.182 6.370 7.652 6 H SER 601 H SER 601 22.015 4.226 8.202 7 HA SER 601 HA SER 601 22.808 2.302 6.325 8 HB2 SER 601 HB2 SER 601 21.352 1.791 8.942 9 HB3 SER 601 HB3 SER 601 22.568 0.775 8.141 10 HG SER 601 HG SER 601 23.555 1.930 9.792 11 H HIS 602 H HIS 602 19.719 3.670 6.758 12 HA HIS 602 HA HIS 602 18.642 1.898 4.722 13 HB2 HIS 602 HB2 HIS 602 17.110 2.892 7.174 14 HB3 HIS 602 HB3 HIS 602 16.330 2.399 5.675 15 HD1 HIS 602 HD1 HIS 602 19.106 0.026 6.289 16 HD2 HIS 602 HD2 HIS 602 15.139 0.646 7.592 17 HE1 HIS 602 HE1 HIS 602 18.271 -2.209 7.250 18 H MET 603 H MET 603 17.106 3.296 3.381 19 HA MET 603 HA MET 603 17.589 6.182 3.600 20 HB2 MET 603 HB2 MET 603 18.289 4.535 1.121 21 HB3 MET 603 HB3 MET 603 18.305 6.303 1.240 22 HG2 MET 603 HG2 MET 603 20.061 6.132 3.001 23 HG3 MET 603 HG3 MET 603 20.096 4.381 2.748 24 HE1 MET 603 HE1 MET 603 23.434 5.102 1.135 25 HE2 MET 603 HE2 MET 603 22.733 5.694 2.665 26 HE3 MET 603 HE3 MET 603 22.456 4.013 2.153 27 H GLY 604 H GLY 604 16.213 7.240 1.773 28 HA2 GLY 604 HA2 GLY 604 14.017 7.699 1.181 29 HA3 GLY 604 HA3 GLY 604 13.640 5.948 1.228 30 H GLU 605 H GLU 605 14.803 8.476 3.418 31 HA GLU 605 HA GLU 605 13.689 7.281 5.785 32 HB2 GLU 605 HB2 GLU 605 15.242 9.807 5.092 33 HB3 GLU 605 HB3 GLU 605 14.694 9.423 6.728 34 HG2 GLU 605 HG2 GLU 605 16.001 7.410 6.826 35 HG3 GLU 605 HG3 GLU 605 16.329 7.445 5.099 36 H SER 606 H SER 606 11.493 7.228 4.794 37 HA SER 606 HA SER 606 9.679 9.164 5.859 38 HB2 SER 606 HB2 SER 606 10.221 9.088 2.848 39 HB3 SER 606 HB3 SER 606 8.726 9.740 3.545 40 HG SER 606 HG SER 606 11.199 10.631 4.557 41 H GLY 607 H GLY 607 7.430 8.404 4.355 42 HA2 GLY 607 HA2 GLY 607 7.002 5.558 4.838 43 HA3 GLY 607 HA3 GLY 607 5.978 6.655 3.896 44 H LYS 608 H LYS 608 6.323 4.185 3.088 45 HA LYS 608 HA LYS 608 7.386 4.705 0.447 46 HB2 LYS 608 HB2 LYS 608 7.848 2.362 0.038 47 HB3 LYS 608 HB3 LYS 608 8.925 2.977 1.278 48 HG2 LYS 608 HG2 LYS 608 8.195 1.498 2.839 49 HG3 LYS 608 HG3 LYS 608 6.503 1.772 2.463 50 HD2 LYS 608 HD2 LYS 608 7.052 -0.554 2.034 51 HD3 LYS 608 HD3 LYS 608 6.604 0.267 0.544 52 HE2 LYS 608 HE2 LYS 608 8.468 -1.180 0.088 53 HE3 LYS 608 HE3 LYS 608 8.997 0.497 -0.073 54 HZ1 LYS 608 HZ1 LYS 608 10.595 -0.828 1.138 55 HZ2 LYS 608 HZ2 LYS 608 9.478 -1.233 2.276 56 HZ3 LYS 608 HZ3 LYS 608 9.976 0.330 2.129 57 H ILE 609 H ILE 609 5.954 2.996 -0.910 58 HA ILE 609 HA ILE 609 4.048 3.083 -2.004 59 HB ILE 609 HB ILE 609 2.987 2.606 0.697 60 HG12 ILE 609 HG12 ILE 609 2.768 0.283 -1.129 61 HG13 ILE 609 HG13 ILE 609 4.433 0.807 -0.950 62 HG21 ILE 609 HG21 ILE 609 1.112 3.429 -0.724 63 HG22 ILE 609 HG22 ILE 609 1.604 2.376 -2.043 64 HG23 ILE 609 HG23 ILE 609 0.883 1.695 -0.559 65 HD11 ILE 609 HD11 ILE 609 3.872 -0.870 0.740 66 HD12 ILE 609 HD12 ILE 609 4.217 0.683 1.527 67 HD13 ILE 609 HD13 ILE 609 2.536 0.137 1.339 68 H ASP 610 H ASP 610 4.593 5.224 -2.428 69 HA ASP 610 HA ASP 610 3.250 7.455 -1.243 70 HB2 ASP 610 HB2 ASP 610 3.857 7.169 -4.181 71 HB3 ASP 610 HB3 ASP 610 3.935 8.612 -3.174 72 H ILE 611 H ILE 611 1.573 8.601 -2.619 73 HA ILE 611 HA ILE 611 -0.527 6.861 -3.781 74 HB ILE 611 HB ILE 611 -0.398 9.897 -3.784 75 HG12 ILE 611 HG12 ILE 611 -0.203 9.482 -1.476 76 HG13 ILE 611 HG13 ILE 611 -1.858 9.961 -1.801 77 HG21 ILE 611 HG21 ILE 611 -2.720 7.946 -3.968 78 HG22 ILE 611 HG22 ILE 611 -2.845 9.729 -3.979 79 HG23 ILE 611 HG23 ILE 611 -2.019 8.883 -5.295 80 HD11 ILE 611 HD11 ILE 611 -0.885 7.110 -1.327 81 HD12 ILE 611 HD12 ILE 611 -1.773 8.138 -0.190 82 HD13 ILE 611 HD13 ILE 611 -2.566 7.579 -1.683 83 H ASP 612 H ASP 612 1.938 9.229 -4.562 84 HA ASP 612 HA ASP 612 1.565 9.766 -7.198 85 HB2 ASP 612 HB2 ASP 612 4.196 9.527 -5.684 86 HB3 ASP 612 HB3 ASP 612 3.897 10.512 -7.124 87 H THR 613 H THR 613 3.336 7.051 -5.775 88 HA THR 613 HA THR 613 4.488 6.010 -8.167 89 HB THR 613 HB THR 613 5.177 5.489 -5.814 90 HG1 THR 613 HG1 THR 613 4.631 3.484 -7.714 91 HG21 THR 613 HG21 THR 613 3.059 3.350 -5.737 92 HG22 THR 613 HG22 THR 613 2.841 4.937 -4.970 93 HG23 THR 613 HG23 THR 613 4.173 3.886 -4.468 94 H ILE 614 H ILE 614 1.227 6.118 -7.248 95 HA ILE 614 HA ILE 614 0.493 3.822 -9.011 96 HB ILE 614 HB ILE 614 -1.025 5.233 -6.782 97 HG12 ILE 614 HG12 ILE 614 -0.356 2.288 -6.721 98 HG13 ILE 614 HG13 ILE 614 0.947 3.397 -6.389 99 HG21 ILE 614 HG21 ILE 614 -2.763 3.510 -7.065 100 HG22 ILE 614 HG22 ILE 614 -2.615 4.540 -8.493 101 HG23 ILE 614 HG23 ILE 614 -1.923 2.900 -8.503 102 HD11 ILE 614 HD11 ILE 614 -0.044 2.785 -4.306 103 HD12 ILE 614 HD12 ILE 614 -0.346 4.502 -4.618 104 HD13 ILE 614 HD13 ILE 614 -1.655 3.318 -4.853 105 H MET 615 H MET 615 -0.272 7.257 -8.152 106 HA MET 615 HA MET 615 -2.017 7.806 -10.326 107 HB2 MET 615 HB2 MET 615 -0.317 9.446 -8.528 108 HB3 MET 615 HB3 MET 615 -1.212 10.173 -9.879 109 HG2 MET 615 HG2 MET 615 -2.884 8.388 -8.249 110 HG3 MET 615 HG3 MET 615 -2.175 9.701 -7.316 111 HE1 MET 615 HE1 MET 615 -4.136 9.004 -10.691 112 HE2 MET 615 HE2 MET 615 -4.705 10.643 -11.091 113 HE3 MET 615 HE3 MET 615 -2.980 10.266 -11.161 114 H THR 616 H THR 616 1.563 7.734 -10.170 115 HA THR 616 HA THR 616 1.992 9.097 -12.553 116 HB THR 616 HB THR 616 3.701 8.509 -10.857 117 HG1 THR 616 HG1 THR 616 4.299 9.116 -12.995 118 HG21 THR 616 HG21 THR 616 3.090 6.075 -10.570 119 HG22 THR 616 HG22 THR 616 4.818 6.365 -10.833 120 HG23 THR 616 HG23 THR 616 3.812 5.752 -12.159 121 H GLY 617 H GLY 617 0.672 5.892 -12.121 122 HA2 GLY 617 HA2 GLY 617 0.723 5.442 -15.079 123 HA3 GLY 617 HA3 GLY 617 1.171 4.174 -13.943 124 H LYS 618 H LYS 618 -1.337 5.944 -12.477 125 HA LYS 618 HA LYS 618 -3.509 4.473 -13.860 126 HB2 LYS 618 HB2 LYS 618 -2.777 4.452 -10.896 127 HB3 LYS 618 HB3 LYS 618 -4.422 4.301 -11.393 128 HG2 LYS 618 HG2 LYS 618 -3.914 2.066 -11.381 129 HG3 LYS 618 HG3 LYS 618 -3.447 2.415 -13.037 130 HD2 LYS 618 HD2 LYS 618 -1.043 2.887 -11.867 131 HD3 LYS 618 HD3 LYS 618 -1.753 1.902 -10.596 132 HE2 LYS 618 HE2 LYS 618 -0.732 0.262 -11.882 133 HE3 LYS 618 HE3 LYS 618 -2.379 0.251 -12.534 134 HZ1 LYS 618 HZ1 LYS 618 0.056 1.390 -13.716 135 HZ2 LYS 618 HZ2 LYS 618 -1.390 1.952 -14.202 136 HZ3 LYS 618 HZ3 LYS 618 -1.015 0.345 -14.401 137 HA PRO 619 HA PRO 619 -5.592 8.336 -13.555 138 HB2 PRO 619 HB2 PRO 619 -8.236 7.625 -13.438 139 HB3 PRO 619 HB3 PRO 619 -7.228 7.424 -14.910 140 HG2 PRO 619 HG2 PRO 619 -7.899 5.354 -12.789 141 HG3 PRO 619 HG3 PRO 619 -8.011 5.171 -14.570 142 HD2 PRO 619 HD2 PRO 619 -5.864 4.278 -13.171 143 HD3 PRO 619 HD3 PRO 619 -5.663 5.005 -14.789 144 H LYS 620 H LYS 620 -6.987 9.659 -12.203 145 HA LYS 620 HA LYS 620 -6.467 9.455 -9.452 146 HB2 LYS 620 HB2 LYS 620 -7.083 11.518 -10.765 147 HB3 LYS 620 HB3 LYS 620 -8.770 10.977 -10.756 148 HG2 LYS 620 HG2 LYS 620 -8.761 11.016 -8.273 149 HG3 LYS 620 HG3 LYS 620 -7.064 11.520 -8.283 150 HD2 LYS 620 HD2 LYS 620 -9.342 13.127 -9.521 151 HD3 LYS 620 HD3 LYS 620 -8.731 13.364 -7.879 152 HE2 LYS 620 HE2 LYS 620 -6.454 13.840 -8.805 153 HE3 LYS 620 HE3 LYS 620 -7.100 13.675 -10.442 154 HZ1 LYS 620 HZ1 LYS 620 -8.561 15.536 -9.991 155 HZ2 LYS 620 HZ2 LYS 620 -6.993 15.969 -9.758 156 HZ3 LYS 620 HZ3 LYS 620 -7.966 15.691 -8.464 157 H SER 621 H SER 621 -9.417 8.394 -11.269 158 HA SER 621 HA SER 621 -11.019 7.728 -9.069 159 HB2 SER 621 HB2 SER 621 -12.065 6.192 -10.871 160 HB3 SER 621 HB3 SER 621 -12.034 7.942 -11.157 161 HG SER 621 HG SER 621 -11.320 6.705 -12.975 162 H ALA 622 H ALA 622 -8.227 5.980 -10.407 163 HA ALA 622 HA ALA 622 -8.955 3.327 -9.587 164 HB1 ALA 622 HB1 ALA 622 -6.532 2.858 -9.777 165 HB2 ALA 622 HB2 ALA 622 -7.117 3.758 -11.195 166 HB3 ALA 622 HB3 ALA 622 -6.186 4.584 -9.924 167 H ARG 623 H ARG 623 -6.628 5.655 -8.153 168 HA ARG 623 HA ARG 623 -6.668 4.438 -5.550 169 HB2 ARG 623 HB2 ARG 623 -5.673 6.441 -4.695 170 HB3 ARG 623 HB3 ARG 623 -4.870 6.009 -6.205 171 HG2 ARG 623 HG2 ARG 623 -6.006 7.766 -7.402 172 HG3 ARG 623 HG3 ARG 623 -7.112 8.042 -6.054 173 HD2 ARG 623 HD2 ARG 623 -4.944 8.596 -4.731 174 HD3 ARG 623 HD3 ARG 623 -4.289 8.857 -6.364 175 HE ARG 623 HE ARG 623 -5.350 10.849 -6.400 176 HH11 ARG 623 HH11 ARG 623 -7.183 8.961 -3.975 177 HH12 ARG 623 HH12 ARG 623 -8.584 10.019 -4.028 178 HH21 ARG 623 HH21 ARG 623 -7.114 12.375 -6.174 179 HH22 ARG 623 HH22 ARG 623 -8.598 11.751 -5.483 180 H GLU 624 H GLU 624 -8.781 6.985 -7.034 181 HA GLU 624 HA GLU 624 -9.903 7.770 -4.641 182 HB2 GLU 624 HB2 GLU 624 -10.225 8.639 -7.150 183 HB3 GLU 624 HB3 GLU 624 -11.694 7.667 -7.059 184 HG2 GLU 624 HG2 GLU 624 -12.186 9.965 -6.588 185 HG3 GLU 624 HG3 GLU 624 -12.384 9.027 -5.114 186 H LYS 625 H LYS 625 -10.583 4.909 -6.422 187 HA LYS 625 HA LYS 625 -12.810 4.044 -4.620 188 HB2 LYS 625 HB2 LYS 625 -11.326 2.643 -6.901 189 HB3 LYS 625 HB3 LYS 625 -12.589 1.879 -5.933 190 HG2 LYS 625 HG2 LYS 625 -14.276 3.381 -6.761 191 HG3 LYS 625 HG3 LYS 625 -13.072 4.410 -7.557 192 HD2 LYS 625 HD2 LYS 625 -12.435 2.586 -9.060 193 HD3 LYS 625 HD3 LYS 625 -13.582 1.484 -8.288 194 HE2 LYS 625 HE2 LYS 625 -14.450 4.111 -9.553 195 HE3 LYS 625 HE3 LYS 625 -14.252 2.639 -10.515 196 HZ1 LYS 625 HZ1 LYS 625 -16.528 2.995 -9.735 197 HZ2 LYS 625 HZ2 LYS 625 -16.033 2.791 -8.177 198 HZ3 LYS 625 HZ3 LYS 625 -15.914 1.549 -9.276 199 H MET 626 H MET 626 -9.478 2.919 -5.490 200 HA MET 626 HA MET 626 -9.488 0.704 -3.746 201 HB2 MET 626 HB2 MET 626 -7.234 2.328 -5.005 202 HB3 MET 626 HB3 MET 626 -6.977 0.806 -4.165 203 HG2 MET 626 HG2 MET 626 -8.400 -0.365 -5.777 204 HG3 MET 626 HG3 MET 626 -8.800 1.142 -6.579 205 HE1 MET 626 HE1 MET 626 -5.318 -0.383 -5.292 206 HE2 MET 626 HE2 MET 626 -6.209 -1.704 -6.090 207 HE3 MET 626 HE3 MET 626 -4.732 -1.053 -6.828 208 H MET 627 H MET 627 -8.260 3.995 -3.356 209 HA MET 627 HA MET 627 -6.863 3.609 -0.960 210 HB2 MET 627 HB2 MET 627 -6.403 5.870 -1.036 211 HB3 MET 627 HB3 MET 627 -6.554 5.368 -2.705 212 HG2 MET 627 HG2 MET 627 -7.684 7.216 -2.994 213 HG3 MET 627 HG3 MET 627 -9.051 6.349 -2.329 214 HE1 MET 627 HE1 MET 627 -5.873 7.910 -0.362 215 HE2 MET 627 HE2 MET 627 -6.196 8.954 -1.764 216 HE3 MET 627 HE3 MET 627 -6.507 9.543 -0.117 217 H LYS 628 H LYS 628 -10.224 4.384 -1.660 218 HA LYS 628 HA LYS 628 -10.887 4.907 1.151 219 HB2 LYS 628 HB2 LYS 628 -12.655 4.456 -1.284 220 HB3 LYS 628 HB3 LYS 628 -13.281 4.720 0.362 221 HG2 LYS 628 HG2 LYS 628 -12.095 6.860 0.534 222 HG3 LYS 628 HG3 LYS 628 -11.313 6.551 -1.014 223 HD2 LYS 628 HD2 LYS 628 -13.667 6.580 -2.059 224 HD3 LYS 628 HD3 LYS 628 -14.246 7.196 -0.506 225 HE2 LYS 628 HE2 LYS 628 -13.776 8.969 -2.232 226 HE3 LYS 628 HE3 LYS 628 -12.898 9.197 -0.705 227 HZ1 LYS 628 HZ1 LYS 628 -11.451 9.433 -2.800 228 HZ2 LYS 628 HZ2 LYS 628 -11.750 7.828 -3.040 229 HZ3 LYS 628 HZ3 LYS 628 -10.943 8.331 -1.702 230 H ILE 629 H ILE 629 -11.221 2.101 -1.098 231 HA ILE 629 HA ILE 629 -12.466 0.352 0.726 232 HB ILE 629 HB ILE 629 -10.467 -0.234 -1.485 233 HG12 ILE 629 HG12 ILE 629 -13.472 -0.760 -1.401 234 HG13 ILE 629 HG13 ILE 629 -12.803 0.763 -1.985 235 HG21 ILE 629 HG21 ILE 629 -12.128 -2.237 0.112 236 HG22 ILE 629 HG22 ILE 629 -11.210 -2.613 -1.362 237 HG23 ILE 629 HG23 ILE 629 -10.355 -2.124 0.086 238 HD11 ILE 629 HD11 ILE 629 -11.495 -0.464 -3.702 239 HD12 ILE 629 HD12 ILE 629 -12.312 -1.966 -3.206 240 HD13 ILE 629 HD13 ILE 629 -13.255 -0.622 -3.869 241 H ILE 630 H ILE 630 -8.937 0.848 0.298 242 HA ILE 630 HA ILE 630 -8.253 -0.928 2.451 243 HB ILE 630 HB ILE 630 -5.983 -0.053 2.336 244 HG12 ILE 630 HG12 ILE 630 -5.559 1.390 0.145 245 HG13 ILE 630 HG13 ILE 630 -7.161 2.002 0.489 246 HG21 ILE 630 HG21 ILE 630 -6.823 -1.868 0.884 247 HG22 ILE 630 HG22 ILE 630 -7.202 -0.670 -0.374 248 HG23 ILE 630 HG23 ILE 630 -5.524 -0.931 0.131 249 HD11 ILE 630 HD11 ILE 630 -6.334 2.749 2.748 250 HD12 ILE 630 HD12 ILE 630 -4.729 2.131 2.312 251 HD13 ILE 630 HD13 ILE 630 -5.453 3.474 1.400 252 H GLU 631 H GLU 631 -9.126 2.548 2.469 253 HA GLU 631 HA GLU 631 -8.206 3.070 5.112 254 HB2 GLU 631 HB2 GLU 631 -10.073 4.289 3.090 255 HB3 GLU 631 HB3 GLU 631 -10.171 4.823 4.745 256 HG2 GLU 631 HG2 GLU 631 -7.949 5.652 4.759 257 HG3 GLU 631 HG3 GLU 631 -7.506 4.755 3.315 258 H ILE 632 H ILE 632 -11.356 1.909 3.691 259 HA ILE 632 HA ILE 632 -12.640 1.744 6.241 260 HB ILE 632 HB ILE 632 -13.258 -0.279 4.101 261 HG12 ILE 632 HG12 ILE 632 -13.419 1.429 2.622 262 HG13 ILE 632 HG13 ILE 632 -15.041 1.267 3.197 263 HG21 ILE 632 HG21 ILE 632 -15.570 -0.010 5.028 264 HG22 ILE 632 HG22 ILE 632 -14.404 -0.477 6.263 265 HG23 ILE 632 HG23 ILE 632 -14.956 1.204 6.162 266 HD11 ILE 632 HD11 ILE 632 -14.500 3.607 2.951 267 HD12 ILE 632 HD12 ILE 632 -14.719 3.256 4.685 268 HD13 ILE 632 HD13 ILE 632 -13.092 3.470 3.999 269 H ILE 633 H ILE 633 -10.656 -0.620 4.395 270 HA ILE 633 HA ILE 633 -11.165 -2.913 5.920 271 HB ILE 633 HB ILE 633 -8.613 -2.112 4.460 272 HG12 ILE 633 HG12 ILE 633 -11.199 -2.858 3.458 273 HG13 ILE 633 HG13 ILE 633 -9.726 -2.481 2.585 274 HG21 ILE 633 HG21 ILE 633 -9.392 -4.834 5.555 275 HG22 ILE 633 HG22 ILE 633 -7.985 -4.489 4.511 276 HG23 ILE 633 HG23 ILE 633 -8.065 -3.799 6.116 277 HD11 ILE 633 HD11 ILE 633 -9.051 -4.805 2.576 278 HD12 ILE 633 HD12 ILE 633 -10.492 -5.247 3.498 279 HD13 ILE 633 HD13 ILE 633 -10.649 -4.575 1.859 280 H ASP 634 H ASP 634 -8.463 -0.491 6.251 281 HA ASP 634 HA ASP 634 -7.946 -1.884 8.755 282 HB2 ASP 634 HB2 ASP 634 -6.226 -0.599 6.902 283 HB3 ASP 634 HB3 ASP 634 -5.986 0.114 8.502 284 H SER 635 H SER 635 -9.705 0.966 8.015 285 HA SER 635 HA SER 635 -9.586 2.127 10.664 286 HB2 SER 635 HB2 SER 635 -11.889 2.116 8.660 287 HB3 SER 635 HB3 SER 635 -11.758 3.147 10.098 288 HG SER 635 HG SER 635 -10.203 3.102 7.740 289 H LEU 636 H LEU 636 -11.408 -0.534 9.178 290 HA LEU 636 HA LEU 636 -12.928 -1.208 11.580 291 HB2 LEU 636 HB2 LEU 636 -12.343 -2.423 8.882 292 HB3 LEU 636 HB3 LEU 636 -13.006 -3.446 10.129 293 HG LEU 636 HG LEU 636 -14.493 -2.248 8.332 294 HD11 LEU 636 HD11 LEU 636 -16.417 -2.387 9.905 295 HD12 LEU 636 HD12 LEU 636 -15.279 -2.436 11.270 296 HD13 LEU 636 HD13 LEU 636 -15.309 -3.756 10.068 297 HD21 LEU 636 HD21 LEU 636 -15.629 -0.226 9.037 298 HD22 LEU 636 HD22 LEU 636 -13.909 0.095 8.818 299 HD23 LEU 636 HD23 LEU 636 -14.577 -0.072 10.456 300 H ALA 637 H ALA 637 -10.156 -2.699 9.828 301 HA ALA 637 HA ALA 637 -9.717 -4.616 11.915 302 HB1 ALA 637 HB1 ALA 637 -9.507 -5.017 9.459 303 HB2 ALA 637 HB2 ALA 637 -8.044 -4.018 9.463 304 HB3 ALA 637 HB3 ALA 637 -8.102 -5.521 10.421 305 H VAL 638 H VAL 638 -8.649 -1.400 11.986 306 HA VAL 638 HA VAL 638 -6.239 -1.991 13.503 307 HB VAL 638 HB VAL 638 -6.813 0.213 12.376 308 HG11 VAL 638 HG11 VAL 638 -8.216 1.818 13.464 309 HG12 VAL 638 HG12 VAL 638 -9.179 0.359 13.202 310 HG13 VAL 638 HG13 VAL 638 -8.547 0.722 14.822 311 HG21 VAL 638 HG21 VAL 638 -5.750 1.584 14.073 312 HG22 VAL 638 HG22 VAL 638 -6.091 0.370 15.324 313 HG23 VAL 638 HG23 VAL 638 -4.974 -0.006 13.994 314 H SER 639 H SER 639 -9.664 -2.305 14.041 315 HA SER 639 HA SER 639 -9.347 -2.453 16.990 316 HB2 SER 639 HB2 SER 639 -11.787 -1.903 15.261 317 HB3 SER 639 HB3 SER 639 -11.716 -1.840 17.031 318 HG SER 639 HG SER 639 -11.383 0.172 15.584 319 H SER 640 H SER 640 -9.199 -4.680 14.613 320 HA SER 640 HA SER 640 -10.249 -6.767 16.243 321 HB2 SER 640 HB2 SER 640 -12.323 -5.881 14.964 322 HB3 SER 640 HB3 SER 640 -11.534 -6.476 13.492 323 HG SER 640 HG SER 640 -12.431 -7.913 15.765 324 H GLU 641 H GLU 641 -10.062 -8.891 14.664 325 HA GLU 641 HA GLU 641 -7.285 -9.092 13.880 326 HB2 GLU 641 HB2 GLU 641 -9.679 -10.847 13.171 327 HB3 GLU 641 HB3 GLU 641 -7.989 -11.263 12.892 328 HG2 GLU 641 HG2 GLU 641 -7.595 -11.203 15.367 329 HG3 GLU 641 HG3 GLU 641 -9.335 -10.930 15.603 330 H CYS 642 H CYS 642 -10.317 -8.380 12.148 331 HA CYS 642 HA CYS 642 -9.014 -7.524 9.732 332 HB2 CYS 642 HB2 CYS 642 -10.131 -9.315 8.340 333 HB3 CYS 642 HB3 CYS 642 -8.760 -9.825 9.309 334 H ALA 643 H ALA 643 -10.680 -6.983 8.128 335 HA ALA 643 HA ALA 643 -13.085 -5.795 9.370 336 HB1 ALA 643 HB1 ALA 643 -11.608 -4.370 8.086 337 HB2 ALA 643 HB2 ALA 643 -11.714 -5.417 6.674 338 HB3 ALA 643 HB3 ALA 643 -13.156 -4.523 7.232 339 H LYS 644 H LYS 644 -14.945 -6.785 9.192 340 HA LYS 644 HA LYS 644 -15.610 -9.090 7.639 341 HB2 LYS 644 HB2 LYS 644 -18.018 -8.085 8.005 342 HB3 LYS 644 HB3 LYS 644 -17.157 -8.828 9.350 343 HG2 LYS 644 HG2 LYS 644 -17.027 -5.862 8.942 344 HG3 LYS 644 HG3 LYS 644 -18.492 -6.625 9.599 345 HD2 LYS 644 HD2 LYS 644 -17.152 -7.602 11.388 346 HD3 LYS 644 HD3 LYS 644 -15.721 -6.716 10.769 347 HE2 LYS 644 HE2 LYS 644 -17.050 -4.580 10.996 348 HE3 LYS 644 HE3 LYS 644 -18.344 -5.486 11.741 349 HZ1 LYS 644 HZ1 LYS 644 -15.602 -5.226 12.817 350 HZ2 LYS 644 HZ2 LYS 644 -16.823 -6.077 13.530 351 HZ3 LYS 644 HZ3 LYS 644 -16.942 -4.442 13.365 352 H VAL 645 H VAL 645 -15.884 -9.218 5.471 353 HA VAL 645 HA VAL 645 -15.737 -6.982 3.810 354 HB VAL 645 HB VAL 645 -15.274 -9.433 3.312 355 HG11 VAL 645 HG11 VAL 645 -18.203 -9.492 2.481 356 HG12 VAL 645 HG12 VAL 645 -16.983 -10.744 2.241 357 HG13 VAL 645 HG13 VAL 645 -17.519 -10.349 3.883 358 HG21 VAL 645 HG21 VAL 645 -16.757 -7.763 1.252 359 HG22 VAL 645 HG22 VAL 645 -15.032 -7.670 1.690 360 HG23 VAL 645 HG23 VAL 645 -15.684 -9.134 0.917 361 H LYS 646 H LYS 646 -18.542 -8.252 5.420 362 HA LYS 646 HA LYS 646 -20.763 -7.185 4.046 363 HB2 LYS 646 HB2 LYS 646 -20.030 -7.159 7.020 364 HB3 LYS 646 HB3 LYS 646 -21.614 -6.718 6.386 365 HG2 LYS 646 HG2 LYS 646 -22.102 -8.974 5.793 366 HG3 LYS 646 HG3 LYS 646 -20.421 -9.486 6.049 367 HD2 LYS 646 HD2 LYS 646 -21.954 -10.088 7.926 368 HD3 LYS 646 HD3 LYS 646 -20.562 -9.139 8.432 369 HE2 LYS 646 HE2 LYS 646 -23.128 -7.676 7.796 370 HE3 LYS 646 HE3 LYS 646 -23.080 -8.657 9.260 371 HZ1 LYS 646 HZ1 LYS 646 -21.204 -6.376 8.716 372 HZ2 LYS 646 HZ2 LYS 646 -21.174 -7.374 10.011 373 HZ3 LYS 646 HZ3 LYS 646 -22.459 -6.399 9.739 374 H ASP 647 H ASP 647 -18.522 -5.690 6.465 375 HA ASP 647 HA ASP 647 -20.054 -3.309 6.483 376 HB2 ASP 647 HB2 ASP 647 -17.469 -4.319 7.678 377 HB3 ASP 647 HB3 ASP 647 -17.990 -2.692 7.982 378 H ILE 648 H ILE 648 -17.035 -4.373 5.020 379 HA ILE 648 HA ILE 648 -16.172 -1.857 3.963 380 HB ILE 648 HB ILE 648 -15.671 -4.585 2.700 381 HG12 ILE 648 HG12 ILE 648 -14.041 -3.366 4.981 382 HG13 ILE 648 HG13 ILE 648 -15.156 -4.703 5.151 383 HG21 ILE 648 HG21 ILE 648 -14.964 -2.556 1.403 384 HG22 ILE 648 HG22 ILE 648 -13.942 -2.065 2.767 385 HG23 ILE 648 HG23 ILE 648 -13.596 -3.555 1.870 386 HD11 ILE 648 HD11 ILE 648 -13.023 -5.720 4.921 387 HD12 ILE 648 HD12 ILE 648 -13.854 -5.991 3.390 388 HD13 ILE 648 HD13 ILE 648 -12.631 -4.726 3.515 389 H LEU 649 H LEU 649 -18.055 -4.552 2.494 390 HA LEU 649 HA LEU 649 -18.696 -3.342 0.043 391 HB2 LEU 649 HB2 LEU 649 -20.082 -5.336 1.850 392 HB3 LEU 649 HB3 LEU 649 -20.937 -4.726 0.455 393 HG LEU 649 HG LEU 649 -18.158 -5.914 0.146 394 HD11 LEU 649 HD11 LEU 649 -19.219 -8.078 -0.390 395 HD12 LEU 649 HD12 LEU 649 -20.812 -7.424 0.059 396 HD13 LEU 649 HD13 LEU 649 -19.543 -7.614 1.284 397 HD21 LEU 649 HD21 LEU 649 -20.542 -5.744 -1.761 398 HD22 LEU 649 HD22 LEU 649 -18.912 -6.330 -2.156 399 HD23 LEU 649 HD23 LEU 649 -19.174 -4.624 -1.766 400 H LYS 650 H LYS 650 -20.327 -3.026 3.240 401 HA LYS 650 HA LYS 650 -22.439 -1.381 2.257 402 HB2 LYS 650 HB2 LYS 650 -22.438 -2.552 4.467 403 HB3 LYS 650 HB3 LYS 650 -21.261 -1.374 5.068 404 HG2 LYS 650 HG2 LYS 650 -22.895 0.466 4.650 405 HG3 LYS 650 HG3 LYS 650 -24.034 -0.704 3.981 406 HD2 LYS 650 HD2 LYS 650 -24.714 -0.209 6.244 407 HD3 LYS 650 HD3 LYS 650 -24.132 -1.871 6.172 408 HE2 LYS 650 HE2 LYS 650 -23.252 -0.907 8.189 409 HE3 LYS 650 HE3 LYS 650 -21.906 -1.083 7.059 410 HZ1 LYS 650 HZ1 LYS 650 -23.283 1.448 7.756 411 HZ2 LYS 650 HZ2 LYS 650 -22.176 1.304 6.511 412 HZ3 LYS 650 HZ3 LYS 650 -21.662 1.033 7.933 413 H GLU 651 H GLU 651 -19.390 -0.326 3.971 414 HA GLU 651 HA GLU 651 -20.143 2.414 3.594 415 HB2 GLU 651 HB2 GLU 651 -17.298 1.485 4.029 416 HB3 GLU 651 HB3 GLU 651 -17.991 3.051 4.389 417 HG2 GLU 651 HG2 GLU 651 -18.157 0.489 5.932 418 HG3 GLU 651 HG3 GLU 651 -17.695 2.079 6.465 419 H ALA 652 H ALA 652 -18.084 0.280 1.623 420 HA ALA 652 HA ALA 652 -17.095 2.121 -0.282 421 HB1 ALA 652 HB1 ALA 652 -17.174 0.141 -1.792 422 HB2 ALA 652 HB2 ALA 652 -16.525 -0.312 -0.193 423 HB3 ALA 652 HB3 ALA 652 -18.197 -0.705 -0.619 424 H GLN 653 H GLN 653 -20.180 0.327 -0.160 425 HA GLN 653 HA GLN 653 -21.035 1.209 -2.731 426 HB2 GLN 653 HB2 GLN 653 -21.402 -0.939 -1.678 427 HB3 GLN 653 HB3 GLN 653 -22.471 -0.218 -0.467 428 HG2 GLN 653 HG2 GLN 653 -22.938 0.008 -3.466 429 HG3 GLN 653 HG3 GLN 653 -23.289 -1.435 -2.526 430 HE21 GLN 653 HE21 GLN 653 -25.365 -0.009 -3.921 431 HE22 GLN 653 HE22 GLN 653 -26.394 0.767 -2.724 432 H GLN 654 H GLN 654 -21.758 2.232 0.611 433 HA GLN 654 HA GLN 654 -23.643 4.296 -0.160 434 HB2 GLN 654 HB2 GLN 654 -21.872 3.936 2.293 435 HB3 GLN 654 HB3 GLN 654 -23.119 5.177 2.133 436 HG2 GLN 654 HG2 GLN 654 -23.619 2.153 2.069 437 HG3 GLN 654 HG3 GLN 654 -23.943 3.228 3.418 438 HE21 GLN 654 HE21 GLN 654 -25.191 2.017 0.257 439 HE22 GLN 654 HE22 GLN 654 -26.655 2.977 0.406 440 H VAL 655 H VAL 655 -20.052 4.249 0.246 441 HA VAL 655 HA VAL 655 -19.636 6.990 -0.429 442 HB VAL 655 HB VAL 655 -18.002 4.450 -0.501 443 HG11 VAL 655 HG11 VAL 655 -17.182 5.556 -2.495 444 HG12 VAL 655 HG12 VAL 655 -16.988 7.081 -1.594 445 HG13 VAL 655 HG13 VAL 655 -16.002 5.649 -1.186 446 HG21 VAL 655 HG21 VAL 655 -16.675 5.617 1.163 447 HG22 VAL 655 HG22 VAL 655 -17.588 7.121 0.895 448 HG23 VAL 655 HG23 VAL 655 -18.380 5.711 1.620 449 H GLY 656 H GLY 656 -20.301 4.157 -2.461 450 HA2 GLY 656 HA2 GLY 656 -21.924 4.973 -4.231 451 HA3 GLY 656 HA3 GLY 656 -20.619 6.015 -4.800 452 H ILE 657 H ILE 657 -19.404 2.963 -3.742 453 HA ILE 657 HA ILE 657 -18.680 2.374 -6.520 454 HB ILE 657 HB ILE 657 -17.861 1.177 -3.839 455 HG12 ILE 657 HG12 ILE 657 -16.247 3.080 -5.592 456 HG13 ILE 657 HG13 ILE 657 -17.227 3.636 -4.245 457 HG21 ILE 657 HG21 ILE 657 -15.950 0.181 -5.117 458 HG22 ILE 657 HG22 ILE 657 -17.501 -0.415 -5.672 459 HG23 ILE 657 HG23 ILE 657 -16.645 0.812 -6.627 460 HD11 ILE 657 HD11 ILE 657 -14.983 3.463 -3.478 461 HD12 ILE 657 HD12 ILE 657 -15.958 2.224 -2.672 462 HD13 ILE 657 HD13 ILE 657 -14.853 1.772 -3.995 463 H GLU 658 H GLU 658 -19.144 0.232 -7.560 464 HA GLU 658 HA GLU 658 -21.792 -0.735 -6.803 465 HB2 GLU 658 HB2 GLU 658 -20.575 -0.465 -9.189 466 HB3 GLU 658 HB3 GLU 658 -20.024 -2.098 -8.848 467 HG2 GLU 658 HG2 GLU 658 -22.909 -1.097 -9.028 468 HG3 GLU 658 HG3 GLU 658 -22.069 -2.118 -10.199 469 H LYS 659 H LYS 659 -22.204 -2.831 -5.918 470 HA LYS 659 HA LYS 659 -20.371 -4.019 -4.095 471 HB2 LYS 659 HB2 LYS 659 -21.818 -5.811 -3.823 472 HB3 LYS 659 HB3 LYS 659 -22.829 -4.398 -4.122 473 HG2 LYS 659 HG2 LYS 659 -22.940 -5.188 -6.552 474 HG3 LYS 659 HG3 LYS 659 -22.186 -6.692 -6.025 475 HD2 LYS 659 HD2 LYS 659 -24.080 -7.230 -4.642 476 HD3 LYS 659 HD3 LYS 659 -24.786 -5.601 -4.874 477 HE2 LYS 659 HE2 LYS 659 -24.986 -5.953 -7.270 478 HE3 LYS 659 HE3 LYS 659 -24.161 -7.511 -7.161 479 HZ1 LYS 659 HZ1 LYS 659 -26.542 -7.782 -7.310 480 HZ2 LYS 659 HZ2 LYS 659 -26.782 -6.890 -5.947 481 HZ3 LYS 659 HZ3 LYS 659 -26.007 -8.343 -5.859 482 H SER 660 H SER 660 -20.993 -4.961 -7.579 483 HA SER 660 HA SER 660 -19.027 -7.002 -7.331 484 HB2 SER 660 HB2 SER 660 -21.010 -6.858 -8.966 485 HB3 SER 660 HB3 SER 660 -19.888 -5.945 -10.003 486 HG SER 660 HG SER 660 -19.369 -8.533 -8.748 487 H ASN 661 H ASN 661 -18.686 -3.592 -7.974 488 HA ASN 661 HA ASN 661 -15.996 -3.715 -9.091 489 HB2 ASN 661 HB2 ASN 661 -17.509 -1.577 -7.604 490 HB3 ASN 661 HB3 ASN 661 -15.772 -1.533 -7.714 491 HD21 ASN 661 HD21 ASN 661 -17.866 -2.716 -10.378 492 HD22 ASN 661 HD22 ASN 661 -17.516 -1.350 -11.422 493 H ILE 662 H ILE 662 -17.429 -4.072 -5.787 494 HA ILE 662 HA ILE 662 -14.830 -3.685 -4.496 495 HB ILE 662 HB ILE 662 -17.595 -4.424 -3.496 496 HG12 ILE 662 HG12 ILE 662 -16.243 -1.900 -2.626 497 HG13 ILE 662 HG13 ILE 662 -16.690 -1.958 -4.314 498 HG21 ILE 662 HG21 ILE 662 -15.064 -4.019 -1.880 499 HG22 ILE 662 HG22 ILE 662 -16.700 -3.923 -1.193 500 HG23 ILE 662 HG23 ILE 662 -16.157 -5.426 -1.923 501 HD11 ILE 662 HD11 ILE 662 -19.019 -2.567 -3.700 502 HD12 ILE 662 HD12 ILE 662 -18.607 -2.389 -1.999 503 HD13 ILE 662 HD13 ILE 662 -18.552 -0.995 -3.109 504 H GLU 663 H GLU 663 -16.925 -6.277 -5.709 505 HA GLU 663 HA GLU 663 -15.617 -8.490 -4.421 506 HB2 GLU 663 HB2 GLU 663 -16.854 -8.464 -7.211 507 HB3 GLU 663 HB3 GLU 663 -16.474 -9.881 -6.243 508 HG2 GLU 663 HG2 GLU 663 -18.143 -9.161 -4.547 509 HG3 GLU 663 HG3 GLU 663 -18.544 -7.792 -5.497 510 H LYS 664 H LYS 664 -15.127 -6.980 -7.650 511 HA LYS 664 HA LYS 664 -12.815 -8.619 -8.073 512 HB2 LYS 664 HB2 LYS 664 -12.356 -6.667 -9.941 513 HB3 LYS 664 HB3 LYS 664 -13.273 -8.144 -10.180 514 HG2 LYS 664 HG2 LYS 664 -15.352 -7.021 -9.782 515 HG3 LYS 664 HG3 LYS 664 -14.511 -5.518 -9.319 516 HD2 LYS 664 HD2 LYS 664 -15.055 -4.918 -11.406 517 HD3 LYS 664 HD3 LYS 664 -13.583 -5.776 -11.846 518 HE2 LYS 664 HE2 LYS 664 -16.461 -6.827 -11.905 519 HE3 LYS 664 HE3 LYS 664 -15.492 -6.378 -13.314 520 HZ1 LYS 664 HZ1 LYS 664 -15.547 -8.746 -13.001 521 HZ2 LYS 664 HZ2 LYS 664 -14.944 -8.621 -11.481 522 HZ3 LYS 664 HZ3 LYS 664 -14.005 -8.210 -12.776 523 H LEU 665 H LEU 665 -13.139 -5.226 -6.949 524 HA LEU 665 HA LEU 665 -10.339 -4.739 -6.913 525 HB2 LEU 665 HB2 LEU 665 -12.611 -3.499 -5.322 526 HB3 LEU 665 HB3 LEU 665 -10.945 -2.970 -5.152 527 HG LEU 665 HG LEU 665 -12.344 -3.035 -7.866 528 HD11 LEU 665 HD11 LEU 665 -12.777 -0.677 -7.656 529 HD12 LEU 665 HD12 LEU 665 -12.007 -0.615 -6.057 530 HD13 LEU 665 HD13 LEU 665 -13.535 -1.503 -6.286 531 HD21 LEU 665 HD21 LEU 665 -9.824 -1.633 -6.896 532 HD22 LEU 665 HD22 LEU 665 -10.576 -1.395 -8.486 533 HD23 LEU 665 HD23 LEU 665 -9.908 -2.968 -8.059 534 H LEU 666 H LEU 666 -12.454 -5.871 -4.143 535 HA LEU 666 HA LEU 666 -10.394 -6.269 -2.257 536 HB2 LEU 666 HB2 LEU 666 -12.890 -7.894 -2.869 537 HB3 LEU 666 HB3 LEU 666 -11.843 -8.273 -1.520 538 HG LEU 666 HG LEU 666 -13.134 -5.532 -1.764 539 HD11 LEU 666 HD11 LEU 666 -14.119 -8.084 -0.425 540 HD12 LEU 666 HD12 LEU 666 -14.869 -7.305 -1.819 541 HD13 LEU 666 HD13 LEU 666 -14.874 -6.469 -0.255 542 HD21 LEU 666 HD21 LEU 666 -12.022 -7.127 0.598 543 HD22 LEU 666 HD22 LEU 666 -12.805 -5.540 0.697 544 HD23 LEU 666 HD23 LEU 666 -11.259 -5.707 -0.156 545 H THR 667 H THR 667 -11.593 -8.456 -4.856 546 HA THR 667 HA THR 667 -9.904 -10.627 -4.245 547 HB THR 667 HB THR 667 -11.137 -9.716 -6.867 548 HG1 THR 667 HG1 THR 667 -12.664 -10.294 -5.560 549 HG21 THR 667 HG21 THR 667 -10.705 -12.194 -7.497 550 HG22 THR 667 HG22 THR 667 -9.424 -12.140 -6.261 551 HG23 THR 667 HG23 THR 667 -9.363 -11.042 -7.622 552 H ASP 668 H ASP 668 -9.301 -7.829 -6.543 553 HA ASP 668 HA ASP 668 -6.788 -8.993 -7.254 554 HB2 ASP 668 HB2 ASP 668 -7.962 -7.700 -8.750 555 HB3 ASP 668 HB3 ASP 668 -7.990 -6.303 -7.621 556 H MET 669 H MET 669 -7.809 -6.685 -4.795 557 HA MET 669 HA MET 669 -5.215 -5.829 -3.983 558 HB2 MET 669 HB2 MET 669 -7.766 -6.208 -2.359 559 HB3 MET 669 HB3 MET 669 -6.293 -5.403 -1.796 560 HG2 MET 669 HG2 MET 669 -6.645 -4.014 -4.041 561 HG3 MET 669 HG3 MET 669 -8.306 -4.464 -3.768 562 HE1 MET 669 HE1 MET 669 -8.058 -0.783 -2.801 563 HE2 MET 669 HE2 MET 669 -6.944 -1.630 -3.904 564 HE3 MET 669 HE3 MET 669 -8.683 -1.993 -3.960 565 H ARG 670 H ARG 670 -7.210 -8.630 -2.810 566 HA ARG 670 HA ARG 670 -5.025 -9.572 -1.167 567 HB2 ARG 670 HB2 ARG 670 -6.247 -11.573 -0.802 568 HB3 ARG 670 HB3 ARG 670 -7.314 -10.183 -0.585 569 HG2 ARG 670 HG2 ARG 670 -8.643 -10.727 -2.382 570 HG3 ARG 670 HG3 ARG 670 -7.346 -11.574 -3.238 571 HD2 ARG 670 HD2 ARG 670 -7.781 -13.503 -2.430 572 HD3 ARG 670 HD3 ARG 670 -7.912 -12.937 -0.782 573 HE ARG 670 HE ARG 670 -10.222 -13.030 -0.885 574 HH11 ARG 670 HH11 ARG 670 -9.093 -13.580 -4.138 575 HH12 ARG 670 HH12 ARG 670 -10.605 -13.160 -4.908 576 HH21 ARG 670 HH21 ARG 670 -12.195 -12.183 -1.939 577 HH22 ARG 670 HH22 ARG 670 -12.337 -12.325 -3.669 578 H LYS 671 H LYS 671 -5.894 -10.149 -4.527 579 HA LYS 671 HA LYS 671 -4.074 -12.381 -4.738 580 HB2 LYS 671 HB2 LYS 671 -5.180 -12.808 -6.681 581 HB3 LYS 671 HB3 LYS 671 -6.325 -11.684 -6.037 582 HG2 LYS 671 HG2 LYS 671 -6.259 -10.898 -8.014 583 HG3 LYS 671 HG3 LYS 671 -4.911 -9.934 -7.357 584 HD2 LYS 671 HD2 LYS 671 -3.298 -11.563 -8.397 585 HD3 LYS 671 HD3 LYS 671 -4.653 -12.545 -8.938 586 HE2 LYS 671 HE2 LYS 671 -3.909 -11.341 -10.828 587 HE3 LYS 671 HE3 LYS 671 -5.449 -10.615 -10.342 588 HZ1 LYS 671 HZ1 LYS 671 -3.662 -9.010 -10.891 589 HZ2 LYS 671 HZ2 LYS 671 -2.840 -9.487 -9.535 590 HZ3 LYS 671 HZ3 LYS 671 -4.334 -8.769 -9.444 591 H SER 672 H SER 672 -3.623 -8.953 -4.999 592 HA SER 672 HA SER 672 -1.005 -9.311 -6.358 593 HB2 SER 672 HB2 SER 672 -1.093 -6.859 -6.649 594 HB3 SER 672 HB3 SER 672 -2.465 -7.698 -7.396 595 HG SER 672 HG SER 672 -3.801 -7.045 -5.794 596 H GLY 673 H GLY 673 -2.365 -8.301 -3.210 597 HA2 GLY 673 HA2 GLY 673 -0.947 -8.618 -1.253 598 HA3 GLY 673 HA3 GLY 673 0.452 -8.093 -2.192 599 H ILE 674 H ILE 674 -2.789 -6.597 -2.129 600 HA ILE 674 HA ILE 674 -1.660 -4.133 -0.858 601 HB ILE 674 HB ILE 674 -4.286 -4.648 -2.306 602 HG12 ILE 674 HG12 ILE 674 -1.851 -3.065 -3.203 603 HG13 ILE 674 HG13 ILE 674 -2.343 -4.639 -3.827 604 HG21 ILE 674 HG21 ILE 674 -4.717 -2.237 -2.130 605 HG22 ILE 674 HG22 ILE 674 -4.550 -2.941 -0.540 606 HG23 ILE 674 HG23 ILE 674 -3.198 -2.021 -1.225 607 HD11 ILE 674 HD11 ILE 674 -2.991 -2.988 -5.415 608 HD12 ILE 674 HD12 ILE 674 -4.459 -3.649 -4.678 609 HD13 ILE 674 HD13 ILE 674 -3.853 -2.040 -4.198 610 H ILE 675 H ILE 675 -3.984 -6.806 -0.503 611 HA ILE 675 HA ILE 675 -4.193 -6.307 2.359 612 HB ILE 675 HB ILE 675 -6.576 -6.466 2.462 613 HG12 ILE 675 HG12 ILE 675 -6.510 -7.141 -0.468 614 HG13 ILE 675 HG13 ILE 675 -7.064 -8.140 0.848 615 HG21 ILE 675 HG21 ILE 675 -7.318 -4.417 1.419 616 HG22 ILE 675 HG22 ILE 675 -5.646 -4.210 1.892 617 HG23 ILE 675 HG23 ILE 675 -6.057 -4.507 0.202 618 HD11 ILE 675 HD11 ILE 675 -8.983 -6.645 1.227 619 HD12 ILE 675 HD12 ILE 675 -8.480 -5.649 -0.161 620 HD13 ILE 675 HD13 ILE 675 -8.956 -7.336 -0.400 621 H TYR 676 H TYR 676 -5.536 -8.439 3.168 622 HA TYR 676 HA TYR 676 -5.321 -10.701 1.314 623 HB2 TYR 676 HB2 TYR 676 -4.328 -12.188 2.906 624 HB3 TYR 676 HB3 TYR 676 -3.229 -10.838 2.657 625 HD1 TYR 676 HD1 TYR 676 -3.472 -8.862 4.477 626 HD2 TYR 676 HD2 TYR 676 -4.625 -12.965 5.107 627 HE1 TYR 676 HE1 TYR 676 -3.101 -8.565 6.877 628 HE2 TYR 676 HE2 TYR 676 -4.295 -12.674 7.536 629 HH TYR 676 HH TYR 676 -3.719 -11.184 9.258 630 H GLU 677 H GLU 677 -6.660 -12.554 2.205 631 HA GLU 677 HA GLU 677 -8.979 -11.567 3.686 632 HB2 GLU 677 HB2 GLU 677 -9.195 -12.504 1.384 633 HB3 GLU 677 HB3 GLU 677 -8.614 -14.069 1.973 634 HG2 GLU 677 HG2 GLU 677 -10.465 -14.310 3.440 635 HG3 GLU 677 HG3 GLU 677 -10.894 -12.596 3.308 636 H ALA 678 H ALA 678 -8.551 -11.812 5.831 637 HA ALA 678 HA ALA 678 -6.400 -13.549 6.769 638 HB1 ALA 678 HB1 ALA 678 -6.805 -11.238 7.662 639 HB2 ALA 678 HB2 ALA 678 -8.386 -11.784 8.266 640 HB3 ALA 678 HB3 ALA 678 -6.896 -12.479 8.934 641 H LYS 679 H LYS 679 -9.921 -13.505 6.777 642 HA LYS 679 HA LYS 679 -9.990 -16.340 7.351 643 HB2 LYS 679 HB2 LYS 679 -11.754 -14.362 8.917 644 HB3 LYS 679 HB3 LYS 679 -12.015 -16.083 8.826 645 HG2 LYS 679 HG2 LYS 679 -10.938 -16.041 10.817 646 HG3 LYS 679 HG3 LYS 679 -9.535 -16.237 9.771 647 HD2 LYS 679 HD2 LYS 679 -9.408 -13.618 9.828 648 HD3 LYS 679 HD3 LYS 679 -10.559 -13.711 11.151 649 HE2 LYS 679 HE2 LYS 679 -7.863 -15.152 11.089 650 HE3 LYS 679 HE3 LYS 679 -8.120 -13.545 11.786 651 HZ1 LYS 679 HZ1 LYS 679 -9.308 -16.049 12.808 652 HZ2 LYS 679 HZ2 LYS 679 -9.731 -14.499 13.314 653 HZ3 LYS 679 HZ3 LYS 679 -8.275 -14.947 13.568 654 HA PRO 680 HA PRO 680 -12.752 -15.830 3.862 655 HB2 PRO 680 HB2 PRO 680 -14.988 -17.361 4.522 656 HB3 PRO 680 HB3 PRO 680 -13.468 -17.990 3.815 657 HG2 PRO 680 HG2 PRO 680 -14.292 -17.917 6.728 658 HG3 PRO 680 HG3 PRO 680 -13.532 -19.265 5.821 659 HD2 PRO 680 HD2 PRO 680 -12.049 -17.674 7.407 660 HD3 PRO 680 HD3 PRO 680 -11.410 -18.164 5.814 661 H GLU 681 H GLU 681 -13.950 -14.181 3.315 662 HA GLU 681 HA GLU 681 -15.371 -12.438 3.364 663 HB2 GLU 681 HB2 GLU 681 -16.700 -13.836 5.719 664 HB3 GLU 681 HB3 GLU 681 -17.321 -12.403 4.945 665 HG2 GLU 681 HG2 GLU 681 -16.875 -15.015 3.447 666 HG3 GLU 681 HG3 GLU 681 -18.379 -14.569 4.245 667 H CYS 682 H CYS 682 -12.849 -12.711 5.372 668 HA CYS 682 HA CYS 682 -13.382 -10.101 6.683 669 HB2 CYS 682 HB2 CYS 682 -13.800 -12.157 8.120 670 HB3 CYS 682 HB3 CYS 682 -12.059 -12.415 8.073 671 H TYR 683 H TYR 683 -11.931 -8.723 5.830 672 HA TYR 683 HA TYR 683 -9.365 -9.808 4.760 673 HB2 TYR 683 HB2 TYR 683 -11.050 -7.386 4.052 674 HB3 TYR 683 HB3 TYR 683 -9.445 -7.677 3.395 675 HD1 TYR 683 HD1 TYR 683 -12.923 -9.073 3.525 676 HD2 TYR 683 HD2 TYR 683 -9.067 -9.165 1.592 677 HE1 TYR 683 HE1 TYR 683 -13.843 -10.547 1.737 678 HE2 TYR 683 HE2 TYR 683 -10.006 -10.546 -0.228 679 HH TYR 683 HH TYR 683 -12.042 -12.410 0.038 680 H LYS 684 H LYS 684 -7.347 -8.536 4.973 681 HA LYS 684 HA LYS 684 -7.575 -6.158 6.699 682 HB2 LYS 684 HB2 LYS 684 -7.081 -8.356 8.079 683 HB3 LYS 684 HB3 LYS 684 -5.465 -8.208 7.434 684 HG2 LYS 684 HG2 LYS 684 -6.688 -5.740 8.596 685 HG3 LYS 684 HG3 LYS 684 -6.494 -7.083 9.712 686 HD2 LYS 684 HD2 LYS 684 -4.045 -7.199 9.024 687 HD3 LYS 684 HD3 LYS 684 -4.285 -5.654 8.182 688 HE2 LYS 684 HE2 LYS 684 -4.889 -6.200 11.120 689 HE3 LYS 684 HE3 LYS 684 -3.424 -5.424 10.509 690 HZ1 LYS 684 HZ1 LYS 684 -5.759 -4.144 9.512 691 HZ2 LYS 684 HZ2 LYS 684 -4.566 -3.453 10.226 692 HZ3 LYS 684 HZ3 LYS 684 -5.755 -4.150 11.188 693 H LYS 685 H LYS 685 -5.734 -4.668 6.485 694 HA LYS 685 HA LYS 685 -4.755 -4.735 3.778 695 HB2 LYS 685 HB2 LYS 685 -5.561 -2.799 5.370 696 HB3 LYS 685 HB3 LYS 685 -3.902 -2.772 5.946 697 HG2 LYS 685 HG2 LYS 685 -4.486 -2.627 2.973 698 HG3 LYS 685 HG3 LYS 685 -4.847 -1.227 3.972 699 HD2 LYS 685 HD2 LYS 685 -2.622 -0.810 4.521 700 HD3 LYS 685 HD3 LYS 685 -2.110 -2.453 4.149 701 HE2 LYS 685 HE2 LYS 685 -2.731 -2.026 1.728 702 HE3 LYS 685 HE3 LYS 685 -2.962 -0.316 2.151 703 HZ1 LYS 685 HZ1 LYS 685 -0.732 -0.768 1.297 704 HZ2 LYS 685 HZ2 LYS 685 -0.512 -1.938 2.430 705 HZ3 LYS 685 HZ3 LYS 685 -0.603 -0.364 2.907 706 H VAL 686 H VAL 686 -2.371 -4.599 3.132 707 HA VAL 686 HA VAL 686 -0.525 -5.480 5.275 708 HB VAL 686 HB VAL 686 0.834 -6.726 3.751 709 HG11 VAL 686 HG11 VAL 686 -1.062 -7.856 4.977 710 HG12 VAL 686 HG12 VAL 686 -2.007 -7.729 3.469 711 HG13 VAL 686 HG13 VAL 686 -0.526 -8.702 3.509 712 HG21 VAL 686 HG21 VAL 686 -1.297 -6.344 1.611 713 HG22 VAL 686 HG22 VAL 686 0.338 -5.660 1.575 714 HG23 VAL 686 HG23 VAL 686 0.115 -7.409 1.499 Start of MODEL 7 1 H1 GLY 600 H1 GLY 600 14.753 7.667 11.332 2 H2 GLY 600 H2 GLY 600 13.833 6.770 10.317 3 H3 GLY 600 H3 GLY 600 15.409 7.119 9.912 4 HA2 GLY 600 HA2 GLY 600 14.830 9.497 9.844 5 HA3 GLY 600 HA3 GLY 600 13.949 8.516 8.638 6 H SER 601 H SER 601 11.689 8.455 8.731 7 HA SER 601 HA SER 601 10.206 8.955 11.161 8 HB2 SER 601 HB2 SER 601 8.559 7.538 9.799 9 HB3 SER 601 HB3 SER 601 9.044 9.070 9.051 10 HG SER 601 HG SER 601 9.344 6.562 8.107 11 H HIS 602 H HIS 602 9.162 6.895 12.112 12 HA HIS 602 HA HIS 602 11.196 4.787 12.553 13 HB2 HIS 602 HB2 HIS 602 8.572 5.461 13.936 14 HB3 HIS 602 HB3 HIS 602 9.582 4.074 14.337 15 HD1 HIS 602 HD1 HIS 602 11.808 4.539 15.722 16 HD2 HIS 602 HD2 HIS 602 9.608 7.950 14.589 17 HE1 HIS 602 HE1 HIS 602 12.814 6.524 16.985 18 H MET 603 H MET 603 8.747 5.309 10.321 19 HA MET 603 HA MET 603 8.539 2.485 9.643 20 HB2 MET 603 HB2 MET 603 6.089 4.269 10.087 21 HB3 MET 603 HB3 MET 603 6.065 2.683 9.305 22 HG2 MET 603 HG2 MET 603 6.853 1.638 11.392 23 HG3 MET 603 HG3 MET 603 6.809 3.220 12.189 24 HE1 MET 603 HE1 MET 603 5.350 0.691 13.299 25 HE2 MET 603 HE2 MET 603 5.317 2.300 14.066 26 HE3 MET 603 HE3 MET 603 3.796 1.406 13.805 27 H GLY 604 H GLY 604 7.458 2.386 7.361 28 HA2 GLY 604 HA2 GLY 604 7.235 4.802 5.812 29 HA3 GLY 604 HA3 GLY 604 8.692 3.860 5.430 30 H GLU 605 H GLU 605 5.444 4.231 4.659 31 HA GLU 605 HA GLU 605 4.952 1.438 3.857 32 HB2 GLU 605 HB2 GLU 605 3.150 2.811 4.810 33 HB3 GLU 605 HB3 GLU 605 3.338 4.005 3.515 34 HG2 GLU 605 HG2 GLU 605 2.595 2.393 1.844 35 HG3 GLU 605 HG3 GLU 605 2.651 1.076 3.021 36 H SER 606 H SER 606 5.504 4.674 2.305 37 HA SER 606 HA SER 606 5.639 3.732 -0.350 38 HB2 SER 606 HB2 SER 606 6.922 6.110 1.070 39 HB3 SER 606 HB3 SER 606 6.921 5.888 -0.675 40 HG SER 606 HG SER 606 5.003 6.577 -0.833 41 H GLY 607 H GLY 607 7.544 3.676 -1.715 42 HA2 GLY 607 HA2 GLY 607 10.147 3.973 -1.112 43 HA3 GLY 607 HA3 GLY 607 9.895 2.338 -0.483 44 H LYS 608 H LYS 608 8.581 0.905 -2.145 45 HA LYS 608 HA LYS 608 9.286 1.623 -4.941 46 HB2 LYS 608 HB2 LYS 608 9.169 -1.171 -3.737 47 HB3 LYS 608 HB3 LYS 608 9.278 -0.869 -5.465 48 HG2 LYS 608 HG2 LYS 608 11.402 0.151 -3.533 49 HG3 LYS 608 HG3 LYS 608 11.422 -1.482 -4.177 50 HD2 LYS 608 HD2 LYS 608 12.909 0.020 -5.408 51 HD3 LYS 608 HD3 LYS 608 11.675 -0.706 -6.451 52 HE2 LYS 608 HE2 LYS 608 10.438 1.305 -6.614 53 HE3 LYS 608 HE3 LYS 608 11.252 2.023 -5.220 54 HZ1 LYS 608 HZ1 LYS 608 12.523 1.510 -7.831 55 HZ2 LYS 608 HZ2 LYS 608 13.266 2.168 -6.511 56 HZ3 LYS 608 HZ3 LYS 608 12.044 2.975 -7.253 57 H ILE 609 H ILE 609 6.837 1.423 -2.788 58 HA ILE 609 HA ILE 609 4.886 1.353 -4.998 59 HB ILE 609 HB ILE 609 4.339 1.156 -1.998 60 HG12 ILE 609 HG12 ILE 609 5.292 -0.952 -2.435 61 HG13 ILE 609 HG13 ILE 609 3.558 -1.199 -2.462 62 HG21 ILE 609 HG21 ILE 609 2.512 2.189 -3.275 63 HG22 ILE 609 HG22 ILE 609 2.480 0.812 -4.396 64 HG23 ILE 609 HG23 ILE 609 2.036 0.601 -2.685 65 HD11 ILE 609 HD11 ILE 609 3.665 -1.142 -5.010 66 HD12 ILE 609 HD12 ILE 609 5.430 -1.086 -4.872 67 HD13 ILE 609 HD13 ILE 609 4.561 -2.479 -4.252 68 H ASP 610 H ASP 610 3.892 3.384 -5.272 69 HA ASP 610 HA ASP 610 3.584 5.195 -3.183 70 HB2 ASP 610 HB2 ASP 610 5.693 5.916 -5.194 71 HB3 ASP 610 HB3 ASP 610 4.533 7.146 -4.792 72 H ILE 611 H ILE 611 2.681 7.196 -4.339 73 HA ILE 611 HA ILE 611 0.206 6.048 -5.535 74 HB ILE 611 HB ILE 611 0.694 8.751 -4.200 75 HG12 ILE 611 HG12 ILE 611 -0.970 7.504 -2.474 76 HG13 ILE 611 HG13 ILE 611 -0.192 6.061 -3.109 77 HG21 ILE 611 HG21 ILE 611 -1.788 8.851 -4.099 78 HG22 ILE 611 HG22 ILE 611 -1.183 8.848 -5.754 79 HG23 ILE 611 HG23 ILE 611 -1.853 7.347 -5.064 80 HD11 ILE 611 HD11 ILE 611 2.019 6.965 -2.341 81 HD12 ILE 611 HD12 ILE 611 1.209 8.454 -1.810 82 HD13 ILE 611 HD13 ILE 611 0.847 6.909 -1.022 83 H ASP 612 H ASP 612 2.829 8.183 -6.295 84 HA ASP 612 HA ASP 612 1.532 9.785 -8.328 85 HB2 ASP 612 HB2 ASP 612 3.713 10.596 -8.817 86 HB3 ASP 612 HB3 ASP 612 3.586 10.467 -7.058 87 H THR 613 H THR 613 3.624 7.017 -8.203 88 HA THR 613 HA THR 613 3.918 6.387 -10.899 89 HB THR 613 HB THR 613 4.834 5.540 -8.448 90 HG1 THR 613 HG1 THR 613 6.095 5.519 -10.172 91 HG21 THR 613 HG21 THR 613 3.095 3.951 -8.033 92 HG22 THR 613 HG22 THR 613 4.668 3.178 -8.217 93 HG23 THR 613 HG23 THR 613 3.479 3.083 -9.541 94 H ILE 614 H ILE 614 1.106 6.013 -8.996 95 HA ILE 614 HA ILE 614 -0.140 4.026 -10.819 96 HB ILE 614 HB ILE 614 -0.995 5.193 -8.132 97 HG12 ILE 614 HG12 ILE 614 -0.231 2.313 -8.807 98 HG13 ILE 614 HG13 ILE 614 0.947 3.484 -8.246 99 HG21 ILE 614 HG21 ILE 614 -2.360 3.029 -9.782 100 HG22 ILE 614 HG22 ILE 614 -2.848 3.570 -8.164 101 HG23 ILE 614 HG23 ILE 614 -2.988 4.675 -9.530 102 HD11 ILE 614 HD11 ILE 614 -0.361 3.863 -6.183 103 HD12 ILE 614 HD12 ILE 614 -1.420 2.508 -6.662 104 HD13 ILE 614 HD13 ILE 614 0.313 2.237 -6.368 105 H MET 615 H MET 615 -0.762 7.306 -9.373 106 HA MET 615 HA MET 615 -3.043 7.689 -11.073 107 HB2 MET 615 HB2 MET 615 -3.207 9.868 -10.049 108 HB3 MET 615 HB3 MET 615 -2.734 8.700 -8.818 109 HG2 MET 615 HG2 MET 615 -1.296 10.422 -8.315 110 HG3 MET 615 HG3 MET 615 -0.291 9.468 -9.395 111 HE1 MET 615 HE1 MET 615 1.108 12.770 -10.659 112 HE2 MET 615 HE2 MET 615 0.985 12.049 -9.038 113 HE3 MET 615 HE3 MET 615 1.404 11.033 -10.442 114 H THR 616 H THR 616 0.406 8.267 -11.621 115 HA THR 616 HA THR 616 0.067 10.097 -13.767 116 HB THR 616 HB THR 616 2.180 9.565 -12.523 117 HG1 THR 616 HG1 THR 616 3.461 9.897 -14.326 118 HG21 THR 616 HG21 THR 616 2.062 7.044 -12.739 119 HG22 THR 616 HG22 THR 616 3.614 7.752 -13.207 120 HG23 THR 616 HG23 THR 616 2.468 7.224 -14.456 121 H GLY 617 H GLY 617 -0.574 6.650 -13.558 122 HA2 GLY 617 HA2 GLY 617 -0.926 6.481 -16.533 123 HA3 GLY 617 HA3 GLY 617 -0.429 5.147 -15.495 124 H LYS 618 H LYS 618 -2.655 6.490 -13.538 125 HA LYS 618 HA LYS 618 -5.020 5.246 -14.861 126 HB2 LYS 618 HB2 LYS 618 -3.952 4.889 -12.018 127 HB3 LYS 618 HB3 LYS 618 -5.557 4.411 -12.520 128 HG2 LYS 618 HG2 LYS 618 -4.485 2.957 -14.327 129 HG3 LYS 618 HG3 LYS 618 -2.912 3.347 -13.606 130 HD2 LYS 618 HD2 LYS 618 -3.744 2.378 -11.433 131 HD3 LYS 618 HD3 LYS 618 -5.217 1.860 -12.282 132 HE2 LYS 618 HE2 LYS 618 -3.826 0.560 -13.882 133 HE3 LYS 618 HE3 LYS 618 -2.360 1.099 -13.052 134 HZ1 LYS 618 HZ1 LYS 618 -3.124 -0.057 -11.078 135 HZ2 LYS 618 HZ2 LYS 618 -3.000 -1.094 -12.347 136 HZ3 LYS 618 HZ3 LYS 618 -4.481 -0.574 -11.858 137 HA PRO 619 HA PRO 619 -6.993 9.002 -13.711 138 HB2 PRO 619 HB2 PRO 619 -9.610 8.284 -13.215 139 HB3 PRO 619 HB3 PRO 619 -8.885 8.311 -14.853 140 HG2 PRO 619 HG2 PRO 619 -9.188 5.933 -12.989 141 HG3 PRO 619 HG3 PRO 619 -9.641 6.039 -14.722 142 HD2 PRO 619 HD2 PRO 619 -7.289 4.939 -13.954 143 HD3 PRO 619 HD3 PRO 619 -7.365 5.981 -15.407 144 H LYS 620 H LYS 620 -7.748 10.198 -11.916 145 HA LYS 620 HA LYS 620 -6.677 9.621 -9.436 146 HB2 LYS 620 HB2 LYS 620 -9.008 11.411 -10.215 147 HB3 LYS 620 HB3 LYS 620 -8.318 11.410 -8.589 148 HG2 LYS 620 HG2 LYS 620 -6.352 12.435 -9.225 149 HG3 LYS 620 HG3 LYS 620 -6.357 11.733 -10.838 150 HD2 LYS 620 HD2 LYS 620 -6.662 14.099 -11.031 151 HD3 LYS 620 HD3 LYS 620 -8.130 13.270 -11.562 152 HE2 LYS 620 HE2 LYS 620 -9.183 13.758 -9.347 153 HE3 LYS 620 HE3 LYS 620 -7.707 14.601 -8.845 154 HZ1 LYS 620 HZ1 LYS 620 -9.370 16.134 -9.653 155 HZ2 LYS 620 HZ2 LYS 620 -9.436 15.381 -11.112 156 HZ3 LYS 620 HZ3 LYS 620 -8.064 16.162 -10.650 157 H SER 621 H SER 621 -10.033 8.867 -10.499 158 HA SER 621 HA SER 621 -11.019 7.919 -8.064 159 HB2 SER 621 HB2 SER 621 -11.746 7.015 -10.871 160 HB3 SER 621 HB3 SER 621 -12.797 7.031 -9.441 161 HG SER 621 HG SER 621 -12.847 9.236 -9.520 162 H ALA 622 H ALA 622 -8.691 6.307 -10.205 163 HA ALA 622 HA ALA 622 -9.447 3.587 -9.585 164 HB1 ALA 622 HB1 ALA 622 -6.780 4.741 -10.530 165 HB2 ALA 622 HB2 ALA 622 -7.245 3.033 -10.538 166 HB3 ALA 622 HB3 ALA 622 -8.102 4.188 -11.582 167 H ARG 623 H ARG 623 -6.693 5.633 -8.513 168 HA ARG 623 HA ARG 623 -6.207 4.050 -6.086 169 HB2 ARG 623 HB2 ARG 623 -4.512 5.580 -5.648 170 HB3 ARG 623 HB3 ARG 623 -4.703 6.020 -7.355 171 HG2 ARG 623 HG2 ARG 623 -6.484 7.626 -6.579 172 HG3 ARG 623 HG3 ARG 623 -5.972 7.297 -4.910 173 HD2 ARG 623 HD2 ARG 623 -3.729 8.267 -5.738 174 HD3 ARG 623 HD3 ARG 623 -4.686 8.935 -7.072 175 HE ARG 623 HE ARG 623 -4.470 10.015 -4.516 176 HH11 ARG 623 HH11 ARG 623 -7.454 9.244 -6.541 177 HH12 ARG 623 HH12 ARG 623 -8.420 9.921 -5.232 178 HH21 ARG 623 HH21 ARG 623 -6.117 10.814 -2.971 179 HH22 ARG 623 HH22 ARG 623 -7.793 10.627 -3.488 180 H GLU 624 H GLU 624 -8.516 6.740 -6.798 181 HA GLU 624 HA GLU 624 -9.003 7.071 -4.061 182 HB2 GLU 624 HB2 GLU 624 -9.955 8.442 -6.058 183 HB3 GLU 624 HB3 GLU 624 -11.271 7.257 -6.056 184 HG2 GLU 624 HG2 GLU 624 -11.858 9.260 -4.774 185 HG3 GLU 624 HG3 GLU 624 -11.814 7.823 -3.761 186 H LYS 625 H LYS 625 -10.503 4.622 -6.298 187 HA LYS 625 HA LYS 625 -11.953 3.510 -4.048 188 HB2 LYS 625 HB2 LYS 625 -12.602 1.672 -5.413 189 HB3 LYS 625 HB3 LYS 625 -12.855 3.238 -6.186 190 HG2 LYS 625 HG2 LYS 625 -10.902 2.852 -7.645 191 HG3 LYS 625 HG3 LYS 625 -10.712 1.224 -6.954 192 HD2 LYS 625 HD2 LYS 625 -12.914 0.577 -7.751 193 HD3 LYS 625 HD3 LYS 625 -13.316 2.259 -8.158 194 HE2 LYS 625 HE2 LYS 625 -11.423 2.227 -9.831 195 HE3 LYS 625 HE3 LYS 625 -11.304 0.480 -9.572 196 HZ1 LYS 625 HZ1 LYS 625 -13.700 1.930 -10.527 197 HZ2 LYS 625 HZ2 LYS 625 -13.644 0.306 -10.297 198 HZ3 LYS 625 HZ3 LYS 625 -12.709 1.010 -11.456 199 H MET 626 H MET 626 -8.723 2.709 -5.392 200 HA MET 626 HA MET 626 -8.370 0.289 -3.842 201 HB2 MET 626 HB2 MET 626 -6.383 2.360 -4.778 202 HB3 MET 626 HB3 MET 626 -5.926 0.861 -3.984 203 HG2 MET 626 HG2 MET 626 -6.697 -0.431 -5.855 204 HG3 MET 626 HG3 MET 626 -7.373 1.009 -6.638 205 HE1 MET 626 HE1 MET 626 -2.813 0.259 -6.016 206 HE2 MET 626 HE2 MET 626 -3.862 0.803 -4.699 207 HE3 MET 626 HE3 MET 626 -4.092 -0.809 -5.407 208 H MET 627 H MET 627 -7.382 3.672 -3.301 209 HA MET 627 HA MET 627 -6.193 3.414 -0.806 210 HB2 MET 627 HB2 MET 627 -7.500 5.818 -2.113 211 HB3 MET 627 HB3 MET 627 -6.568 5.894 -0.628 212 HG2 MET 627 HG2 MET 627 -5.441 4.850 -3.255 213 HG3 MET 627 HG3 MET 627 -5.288 6.511 -2.709 214 HE1 MET 627 HE1 MET 627 -3.399 7.387 -1.317 215 HE2 MET 627 HE2 MET 627 -4.378 6.793 0.047 216 HE3 MET 627 HE3 MET 627 -2.630 6.460 -0.011 217 H LYS 628 H LYS 628 -9.451 4.109 -1.891 218 HA LYS 628 HA LYS 628 -10.459 4.667 0.800 219 HB2 LYS 628 HB2 LYS 628 -11.965 4.052 -1.762 220 HB3 LYS 628 HB3 LYS 628 -12.796 4.240 -0.223 221 HG2 LYS 628 HG2 LYS 628 -10.829 6.366 -1.120 222 HG3 LYS 628 HG3 LYS 628 -12.482 6.373 -1.736 223 HD2 LYS 628 HD2 LYS 628 -13.411 6.615 0.437 224 HD3 LYS 628 HD3 LYS 628 -11.895 6.237 1.248 225 HE2 LYS 628 HE2 LYS 628 -12.460 8.708 -0.432 226 HE3 LYS 628 HE3 LYS 628 -12.427 8.617 1.344 227 HZ1 LYS 628 HZ1 LYS 628 -10.319 9.349 0.833 228 HZ2 LYS 628 HZ2 LYS 628 -10.209 8.474 -0.561 229 HZ3 LYS 628 HZ3 LYS 628 -10.018 7.742 0.945 230 H ILE 629 H ILE 629 -10.434 1.690 -1.213 231 HA ILE 629 HA ILE 629 -11.790 0.133 0.685 232 HB ILE 629 HB ILE 629 -9.694 -0.598 -1.372 233 HG12 ILE 629 HG12 ILE 629 -12.625 -1.400 -1.414 234 HG13 ILE 629 HG13 ILE 629 -12.190 0.234 -1.880 235 HG21 ILE 629 HG21 ILE 629 -10.405 -2.990 -1.087 236 HG22 ILE 629 HG22 ILE 629 -9.524 -2.356 0.299 237 HG23 ILE 629 HG23 ILE 629 -11.291 -2.512 0.377 238 HD11 ILE 629 HD11 ILE 629 -10.528 -0.712 -3.541 239 HD12 ILE 629 HD12 ILE 629 -11.169 -2.315 -3.141 240 HD13 ILE 629 HD13 ILE 629 -12.221 -1.086 -3.889 241 H ILE 630 H ILE 630 -8.278 0.737 0.357 242 HA ILE 630 HA ILE 630 -7.592 -0.862 2.627 243 HB ILE 630 HB ILE 630 -5.369 0.101 2.621 244 HG12 ILE 630 HG12 ILE 630 -4.784 1.340 0.398 245 HG13 ILE 630 HG13 ILE 630 -6.461 1.814 0.421 246 HG21 ILE 630 HG21 ILE 630 -6.457 -0.886 -0.032 247 HG22 ILE 630 HG22 ILE 630 -4.764 -0.988 0.502 248 HG23 ILE 630 HG23 ILE 630 -6.014 -1.900 1.358 249 HD11 ILE 630 HD11 ILE 630 -4.958 3.545 1.386 250 HD12 ILE 630 HD12 ILE 630 -6.094 2.987 2.602 251 HD13 ILE 630 HD13 ILE 630 -4.431 2.385 2.631 252 H GLU 631 H GLU 631 -8.659 2.553 2.421 253 HA GLU 631 HA GLU 631 -7.931 3.354 5.048 254 HB2 GLU 631 HB2 GLU 631 -9.908 4.147 2.906 255 HB3 GLU 631 HB3 GLU 631 -10.078 4.811 4.504 256 HG2 GLU 631 HG2 GLU 631 -8.036 5.989 4.359 257 HG3 GLU 631 HG3 GLU 631 -7.504 5.068 2.950 258 H ILE 632 H ILE 632 -10.916 1.842 3.607 259 HA ILE 632 HA ILE 632 -12.243 1.659 6.139 260 HB ILE 632 HB ILE 632 -12.639 -0.486 4.075 261 HG12 ILE 632 HG12 ILE 632 -12.921 1.095 2.485 262 HG13 ILE 632 HG13 ILE 632 -14.533 0.866 3.056 263 HG21 ILE 632 HG21 ILE 632 -15.006 -0.297 4.950 264 HG22 ILE 632 HG22 ILE 632 -13.839 -0.642 6.218 265 HG23 ILE 632 HG23 ILE 632 -14.477 1.001 6.020 266 HD11 ILE 632 HD11 ILE 632 -14.167 3.209 2.664 267 HD12 ILE 632 HD12 ILE 632 -14.349 2.965 4.422 268 HD13 ILE 632 HD13 ILE 632 -12.748 3.250 3.705 269 H ILE 633 H ILE 633 -9.921 -0.487 4.438 270 HA ILE 633 HA ILE 633 -10.253 -2.680 6.188 271 HB ILE 633 HB ILE 633 -7.793 -1.983 4.556 272 HG12 ILE 633 HG12 ILE 633 -10.415 -2.931 3.743 273 HG13 ILE 633 HG13 ILE 633 -9.019 -2.497 2.774 274 HG21 ILE 633 HG21 ILE 633 -8.565 -4.588 5.925 275 HG22 ILE 633 HG22 ILE 633 -7.189 -4.347 4.824 276 HG23 ILE 633 HG23 ILE 633 -7.226 -3.513 6.370 277 HD11 ILE 633 HD11 ILE 633 -9.772 -4.676 2.194 278 HD12 ILE 633 HD12 ILE 633 -8.167 -4.794 2.898 279 HD13 ILE 633 HD13 ILE 633 -9.599 -5.253 3.861 280 H ASP 634 H ASP 634 -7.878 0.086 6.238 281 HA ASP 634 HA ASP 634 -6.690 -0.983 8.587 282 HB2 ASP 634 HB2 ASP 634 -5.183 0.681 8.544 283 HB3 ASP 634 HB3 ASP 634 -5.703 0.748 6.872 284 H SER 635 H SER 635 -9.215 1.483 8.063 285 HA SER 635 HA SER 635 -9.437 2.385 10.711 286 HB2 SER 635 HB2 SER 635 -10.415 3.452 8.704 287 HB3 SER 635 HB3 SER 635 -11.607 2.144 8.583 288 HG SER 635 HG SER 635 -12.365 4.052 9.648 289 H LEU 636 H LEU 636 -10.859 -0.456 9.141 290 HA LEU 636 HA LEU 636 -12.353 -1.360 11.482 291 HB2 LEU 636 HB2 LEU 636 -11.502 -2.524 8.816 292 HB3 LEU 636 HB3 LEU 636 -12.215 -3.548 10.027 293 HG LEU 636 HG LEU 636 -13.569 -2.318 8.054 294 HD11 LEU 636 HD11 LEU 636 -15.625 -2.795 9.445 295 HD12 LEU 636 HD12 LEU 636 -14.569 -3.014 10.850 296 HD13 LEU 636 HD13 LEU 636 -14.436 -4.107 9.446 297 HD21 LEU 636 HD21 LEU 636 -14.144 -0.459 10.391 298 HD22 LEU 636 HD22 LEU 636 -15.041 -0.563 8.865 299 HD23 LEU 636 HD23 LEU 636 -13.371 -0.008 8.853 300 H ALA 637 H ALA 637 -9.312 -2.377 9.866 301 HA ALA 637 HA ALA 637 -8.888 -4.561 11.688 302 HB1 ALA 637 HB1 ALA 637 -7.109 -3.430 9.497 303 HB2 ALA 637 HB2 ALA 637 -7.024 -5.037 10.229 304 HB3 ALA 637 HB3 ALA 637 -8.427 -4.607 9.240 305 H VAL 638 H VAL 638 -8.024 -1.271 11.999 306 HA VAL 638 HA VAL 638 -5.661 -1.629 13.607 307 HB VAL 638 HB VAL 638 -6.438 0.464 12.425 308 HG11 VAL 638 HG11 VAL 638 -8.820 0.396 13.200 309 HG12 VAL 638 HG12 VAL 638 -8.277 0.849 14.827 310 HG13 VAL 638 HG13 VAL 638 -8.026 1.951 13.456 311 HG21 VAL 638 HG21 VAL 638 -5.798 0.888 15.360 312 HG22 VAL 638 HG22 VAL 638 -4.617 0.500 14.089 313 HG23 VAL 638 HG23 VAL 638 -5.536 2.011 14.014 314 H SER 639 H SER 639 -8.846 -2.627 14.173 315 HA SER 639 HA SER 639 -8.045 -3.377 16.892 316 HB2 SER 639 HB2 SER 639 -10.527 -1.677 16.441 317 HB3 SER 639 HB3 SER 639 -10.164 -2.563 17.940 318 HG SER 639 HG SER 639 -8.029 -1.099 17.038 319 H SER 640 H SER 640 -10.251 -3.794 14.125 320 HA SER 640 HA SER 640 -11.291 -6.326 15.132 321 HB2 SER 640 HB2 SER 640 -10.920 -5.578 12.215 322 HB3 SER 640 HB3 SER 640 -12.145 -6.629 12.936 323 HG SER 640 HG SER 640 -11.894 -3.810 13.003 324 H GLU 641 H GLU 641 -10.456 -8.451 14.353 325 HA GLU 641 HA GLU 641 -7.631 -8.743 14.098 326 HB2 GLU 641 HB2 GLU 641 -9.844 -10.522 12.982 327 HB3 GLU 641 HB3 GLU 641 -8.151 -10.974 13.193 328 HG2 GLU 641 HG2 GLU 641 -8.414 -10.686 15.669 329 HG3 GLU 641 HG3 GLU 641 -10.138 -10.342 15.417 330 H CYS 642 H CYS 642 -10.273 -8.452 11.709 331 HA CYS 642 HA CYS 642 -8.562 -7.414 9.632 332 HB2 CYS 642 HB2 CYS 642 -9.465 -9.242 8.049 333 HB3 CYS 642 HB3 CYS 642 -8.155 -9.664 9.137 334 H ALA 643 H ALA 643 -10.005 -6.888 7.725 335 HA ALA 643 HA ALA 643 -12.380 -5.512 8.780 336 HB1 ALA 643 HB1 ALA 643 -10.647 -4.254 7.593 337 HB2 ALA 643 HB2 ALA 643 -10.849 -5.276 6.161 338 HB3 ALA 643 HB3 ALA 643 -12.188 -4.228 6.700 339 H LYS 644 H LYS 644 -14.123 -6.731 8.747 340 HA LYS 644 HA LYS 644 -14.566 -8.955 7.020 341 HB2 LYS 644 HB2 LYS 644 -16.901 -7.527 8.147 342 HB3 LYS 644 HB3 LYS 644 -16.629 -9.231 7.977 343 HG2 LYS 644 HG2 LYS 644 -15.818 -9.479 10.058 344 HG3 LYS 644 HG3 LYS 644 -14.790 -8.049 10.001 345 HD2 LYS 644 HD2 LYS 644 -17.794 -8.026 10.333 346 HD3 LYS 644 HD3 LYS 644 -16.583 -7.806 11.630 347 HE2 LYS 644 HE2 LYS 644 -15.810 -5.891 9.790 348 HE3 LYS 644 HE3 LYS 644 -17.540 -5.934 9.517 349 HZ1 LYS 644 HZ1 LYS 644 -16.120 -5.133 11.953 350 HZ2 LYS 644 HZ2 LYS 644 -17.710 -5.615 12.017 351 HZ3 LYS 644 HZ3 LYS 644 -17.288 -4.351 11.059 352 H VAL 645 H VAL 645 -15.636 -9.035 5.118 353 HA VAL 645 HA VAL 645 -15.442 -6.558 3.571 354 HB VAL 645 HB VAL 645 -14.613 -8.555 2.639 355 HG11 VAL 645 HG11 VAL 645 -17.468 -9.582 2.529 356 HG12 VAL 645 HG12 VAL 645 -16.124 -10.274 1.597 357 HG13 VAL 645 HG13 VAL 645 -16.083 -10.308 3.364 358 HG21 VAL 645 HG21 VAL 645 -15.508 -6.686 1.186 359 HG22 VAL 645 HG22 VAL 645 -15.343 -8.276 0.415 360 HG23 VAL 645 HG23 VAL 645 -16.936 -7.702 0.901 361 H LYS 646 H LYS 646 -18.117 -8.171 5.171 362 HA LYS 646 HA LYS 646 -20.266 -6.909 3.820 363 HB2 LYS 646 HB2 LYS 646 -21.378 -6.862 6.040 364 HB3 LYS 646 HB3 LYS 646 -20.789 -8.436 5.485 365 HG2 LYS 646 HG2 LYS 646 -20.324 -8.702 7.623 366 HG3 LYS 646 HG3 LYS 646 -18.809 -7.980 7.130 367 HD2 LYS 646 HD2 LYS 646 -19.622 -7.116 9.276 368 HD3 LYS 646 HD3 LYS 646 -19.481 -5.842 8.083 369 HE2 LYS 646 HE2 LYS 646 -21.968 -5.989 7.704 370 HE3 LYS 646 HE3 LYS 646 -22.054 -7.183 9.010 371 HZ1 LYS 646 HZ1 LYS 646 -21.021 -4.413 9.255 372 HZ2 LYS 646 HZ2 LYS 646 -21.207 -5.468 10.498 373 HZ3 LYS 646 HZ3 LYS 646 -22.536 -4.883 9.714 374 H ASP 647 H ASP 647 -17.992 -5.675 6.286 375 HA ASP 647 HA ASP 647 -19.441 -3.200 6.397 376 HB2 ASP 647 HB2 ASP 647 -17.167 -4.516 7.749 377 HB3 ASP 647 HB3 ASP 647 -16.988 -2.778 7.592 378 H ILE 648 H ILE 648 -16.604 -4.438 4.729 379 HA ILE 648 HA ILE 648 -15.685 -1.875 3.785 380 HB ILE 648 HB ILE 648 -15.258 -4.542 2.396 381 HG12 ILE 648 HG12 ILE 648 -13.617 -3.265 4.646 382 HG13 ILE 648 HG13 ILE 648 -14.575 -4.714 4.778 383 HG21 ILE 648 HG21 ILE 648 -14.691 -2.450 1.099 384 HG22 ILE 648 HG22 ILE 648 -13.566 -1.996 2.392 385 HG23 ILE 648 HG23 ILE 648 -13.293 -3.457 1.419 386 HD11 ILE 648 HD11 ILE 648 -12.321 -5.445 4.481 387 HD12 ILE 648 HD12 ILE 648 -13.183 -5.818 2.988 388 HD13 ILE 648 HD13 ILE 648 -12.092 -4.415 3.070 389 H LEU 649 H LEU 649 -17.805 -4.387 2.357 390 HA LEU 649 HA LEU 649 -18.486 -2.989 0.023 391 HB2 LEU 649 HB2 LEU 649 -19.882 -5.072 1.698 392 HB3 LEU 649 HB3 LEU 649 -20.692 -4.376 0.305 393 HG LEU 649 HG LEU 649 -17.917 -5.626 0.090 394 HD11 LEU 649 HD11 LEU 649 -19.009 -7.655 -0.775 395 HD12 LEU 649 HD12 LEU 649 -20.612 -6.954 -0.445 396 HD13 LEU 649 HD13 LEU 649 -19.506 -7.341 0.891 397 HD21 LEU 649 HD21 LEU 649 -18.496 -5.813 -2.305 398 HD22 LEU 649 HD22 LEU 649 -18.571 -4.133 -1.776 399 HD23 LEU 649 HD23 LEU 649 -20.072 -5.055 -1.986 400 H LYS 650 H LYS 650 -19.931 -2.796 3.302 401 HA LYS 650 HA LYS 650 -21.929 -0.872 2.600 402 HB2 LYS 650 HB2 LYS 650 -20.533 -1.611 5.187 403 HB3 LYS 650 HB3 LYS 650 -21.545 -0.180 5.141 404 HG2 LYS 650 HG2 LYS 650 -22.564 -2.906 4.242 405 HG3 LYS 650 HG3 LYS 650 -22.644 -2.344 5.921 406 HD2 LYS 650 HD2 LYS 650 -23.941 -0.353 5.219 407 HD3 LYS 650 HD3 LYS 650 -23.907 -0.915 3.535 408 HE2 LYS 650 HE2 LYS 650 -25.082 -2.991 4.200 409 HE3 LYS 650 HE3 LYS 650 -25.120 -2.432 5.881 410 HZ1 LYS 650 HZ1 LYS 650 -26.444 -0.552 5.160 411 HZ2 LYS 650 HZ2 LYS 650 -27.187 -1.962 4.743 412 HZ3 LYS 650 HZ3 LYS 650 -26.409 -1.069 3.600 413 H GLU 651 H GLU 651 -18.729 -0.172 4.198 414 HA GLU 651 HA GLU 651 -19.318 2.612 3.940 415 HB2 GLU 651 HB2 GLU 651 -16.677 1.231 4.539 416 HB3 GLU 651 HB3 GLU 651 -16.983 2.959 4.729 417 HG2 GLU 651 HG2 GLU 651 -18.305 0.691 6.277 418 HG3 GLU 651 HG3 GLU 651 -17.187 1.902 6.896 419 H ALA 652 H ALA 652 -17.486 0.420 1.806 420 HA ALA 652 HA ALA 652 -16.494 2.584 0.163 421 HB1 ALA 652 HB1 ALA 652 -16.917 -0.339 -0.457 422 HB2 ALA 652 HB2 ALA 652 -15.993 0.812 -1.447 423 HB3 ALA 652 HB3 ALA 652 -15.439 0.391 0.182 424 H GLN 653 H GLN 653 -19.609 0.656 0.127 425 HA GLN 653 HA GLN 653 -20.554 1.993 -2.260 426 HB2 GLN 653 HB2 GLN 653 -21.912 0.484 -0.019 427 HB3 GLN 653 HB3 GLN 653 -22.855 1.303 -1.236 428 HG2 GLN 653 HG2 GLN 653 -20.626 -0.579 -2.089 429 HG3 GLN 653 HG3 GLN 653 -22.141 -1.234 -1.529 430 HE21 GLN 653 HE21 GLN 653 -22.766 1.751 -3.203 431 HE22 GLN 653 HE22 GLN 653 -23.152 1.005 -4.741 432 H GLN 654 H GLN 654 -20.637 2.846 1.216 433 HA GLN 654 HA GLN 654 -22.213 5.232 0.823 434 HB2 GLN 654 HB2 GLN 654 -20.119 4.626 2.955 435 HB3 GLN 654 HB3 GLN 654 -21.191 6.009 2.967 436 HG2 GLN 654 HG2 GLN 654 -22.070 3.095 3.126 437 HG3 GLN 654 HG3 GLN 654 -21.976 4.222 4.466 438 HE21 GLN 654 HE21 GLN 654 -23.264 6.468 3.831 439 HE22 GLN 654 HE22 GLN 654 -24.882 6.122 3.232 440 H VAL 655 H VAL 655 -18.666 4.628 0.500 441 HA VAL 655 HA VAL 655 -17.966 7.357 -0.050 442 HB VAL 655 HB VAL 655 -16.726 4.642 -0.584 443 HG11 VAL 655 HG11 VAL 655 -15.945 6.051 -2.448 444 HG12 VAL 655 HG12 VAL 655 -15.393 7.273 -1.286 445 HG13 VAL 655 HG13 VAL 655 -14.665 5.644 -1.322 446 HG21 VAL 655 HG21 VAL 655 -16.770 5.607 1.757 447 HG22 VAL 655 HG22 VAL 655 -15.160 5.260 1.128 448 HG23 VAL 655 HG23 VAL 655 -15.772 6.935 1.165 449 H GLY 656 H GLY 656 -19.110 4.656 -2.089 450 HA2 GLY 656 HA2 GLY 656 -20.632 5.470 -3.918 451 HA3 GLY 656 HA3 GLY 656 -19.324 6.556 -4.402 452 H ILE 657 H ILE 657 -18.108 3.523 -3.293 453 HA ILE 657 HA ILE 657 -17.349 2.754 -6.015 454 HB ILE 657 HB ILE 657 -16.927 1.145 -3.498 455 HG12 ILE 657 HG12 ILE 657 -15.981 3.081 -2.643 456 HG13 ILE 657 HG13 ILE 657 -14.640 2.134 -3.247 457 HG21 ILE 657 HG21 ILE 657 -14.870 0.382 -4.700 458 HG22 ILE 657 HG22 ILE 657 -16.300 0.094 -5.669 459 HG23 ILE 657 HG23 ILE 657 -15.267 1.466 -6.056 460 HD11 ILE 657 HD11 ILE 657 -14.820 3.592 -5.381 461 HD12 ILE 657 HD12 ILE 657 -15.838 4.655 -4.401 462 HD13 ILE 657 HD13 ILE 657 -14.172 4.330 -3.887 463 H GLU 658 H GLU 658 -17.899 0.399 -6.707 464 HA GLU 658 HA GLU 658 -20.704 -0.230 -5.942 465 HB2 GLU 658 HB2 GLU 658 -20.419 0.515 -8.204 466 HB3 GLU 658 HB3 GLU 658 -19.094 -0.598 -8.483 467 HG2 GLU 658 HG2 GLU 658 -21.839 -1.647 -7.746 468 HG3 GLU 658 HG3 GLU 658 -21.571 -1.029 -9.371 469 H LYS 659 H LYS 659 -21.077 -2.205 -5.146 470 HA LYS 659 HA LYS 659 -19.513 -3.901 -3.892 471 HB2 LYS 659 HB2 LYS 659 -21.170 -5.667 -4.182 472 HB3 LYS 659 HB3 LYS 659 -21.951 -4.087 -4.037 473 HG2 LYS 659 HG2 LYS 659 -21.931 -4.031 -6.602 474 HG3 LYS 659 HG3 LYS 659 -21.534 -5.760 -6.534 475 HD2 LYS 659 HD2 LYS 659 -23.694 -6.089 -5.285 476 HD3 LYS 659 HD3 LYS 659 -24.075 -4.382 -5.615 477 HE2 LYS 659 HE2 LYS 659 -23.430 -6.555 -7.665 478 HE3 LYS 659 HE3 LYS 659 -25.043 -5.896 -7.339 479 HZ1 LYS 659 HZ1 LYS 659 -22.743 -4.376 -8.480 480 HZ2 LYS 659 HZ2 LYS 659 -24.240 -3.758 -8.171 481 HZ3 LYS 659 HZ3 LYS 659 -24.038 -4.931 -9.313 482 H SER 660 H SER 660 -19.798 -4.230 -7.488 483 HA SER 660 HA SER 660 -18.272 -6.735 -7.381 484 HB2 SER 660 HB2 SER 660 -18.750 -5.179 -9.925 485 HB3 SER 660 HB3 SER 660 -18.630 -6.921 -9.675 486 HG SER 660 HG SER 660 -20.755 -5.100 -9.082 487 H ASN 661 H ASN 661 -17.685 -3.366 -7.621 488 HA ASN 661 HA ASN 661 -14.992 -3.492 -8.762 489 HB2 ASN 661 HB2 ASN 661 -16.529 -1.127 -7.564 490 HB3 ASN 661 HB3 ASN 661 -14.819 -1.174 -7.764 491 HD21 ASN 661 HD21 ASN 661 -17.829 -1.995 -9.740 492 HD22 ASN 661 HD22 ASN 661 -17.148 -1.334 -11.208 493 H ILE 662 H ILE 662 -16.579 -3.195 -5.571 494 HA ILE 662 HA ILE 662 -14.167 -2.721 -4.110 495 HB ILE 662 HB ILE 662 -16.898 -3.877 -3.365 496 HG12 ILE 662 HG12 ILE 662 -15.821 -1.127 -2.673 497 HG13 ILE 662 HG13 ILE 662 -16.594 -1.433 -4.208 498 HG21 ILE 662 HG21 ILE 662 -14.620 -3.053 -1.518 499 HG22 ILE 662 HG22 ILE 662 -16.296 -3.271 -0.978 500 HG23 ILE 662 HG23 ILE 662 -15.414 -4.638 -1.640 501 HD11 ILE 662 HD11 ILE 662 -18.675 -2.103 -3.171 502 HD12 ILE 662 HD12 ILE 662 -17.991 -1.820 -1.575 503 HD13 ILE 662 HD13 ILE 662 -18.212 -0.476 -2.696 504 H GLU 663 H GLU 663 -15.943 -5.626 -5.153 505 HA GLU 663 HA GLU 663 -14.091 -7.331 -3.657 506 HB2 GLU 663 HB2 GLU 663 -16.560 -7.823 -5.296 507 HB3 GLU 663 HB3 GLU 663 -15.591 -9.159 -4.646 508 HG2 GLU 663 HG2 GLU 663 -16.219 -6.898 -2.743 509 HG3 GLU 663 HG3 GLU 663 -17.558 -7.850 -3.268 510 H LYS 664 H LYS 664 -14.462 -6.548 -7.164 511 HA LYS 664 HA LYS 664 -12.327 -8.421 -7.766 512 HB2 LYS 664 HB2 LYS 664 -12.185 -7.511 -9.949 513 HB3 LYS 664 HB3 LYS 664 -13.850 -7.793 -9.494 514 HG2 LYS 664 HG2 LYS 664 -14.248 -5.798 -10.354 515 HG3 LYS 664 HG3 LYS 664 -13.683 -5.185 -8.808 516 HD2 LYS 664 HD2 LYS 664 -11.996 -4.084 -9.732 517 HD3 LYS 664 HD3 LYS 664 -11.401 -5.503 -10.580 518 HE2 LYS 664 HE2 LYS 664 -11.946 -3.677 -12.135 519 HE3 LYS 664 HE3 LYS 664 -12.933 -5.113 -12.429 520 HZ1 LYS 664 HZ1 LYS 664 -14.734 -4.046 -11.229 521 HZ2 LYS 664 HZ2 LYS 664 -14.276 -3.150 -12.522 522 HZ3 LYS 664 HZ3 LYS 664 -13.858 -2.670 -11.008 523 H LEU 665 H LEU 665 -12.364 -4.909 -6.837 524 HA LEU 665 HA LEU 665 -9.527 -4.588 -6.978 525 HB2 LEU 665 HB2 LEU 665 -11.717 -3.234 -5.395 526 HB3 LEU 665 HB3 LEU 665 -10.084 -3.098 -4.832 527 HG LEU 665 HG LEU 665 -10.856 -1.184 -6.201 528 HD11 LEU 665 HD11 LEU 665 -8.514 -1.665 -5.670 529 HD12 LEU 665 HD12 LEU 665 -8.682 -0.905 -7.266 530 HD13 LEU 665 HD13 LEU 665 -8.360 -2.649 -7.139 531 HD21 LEU 665 HD21 LEU 665 -10.669 -1.293 -8.635 532 HD22 LEU 665 HD22 LEU 665 -11.989 -2.327 -8.061 533 HD23 LEU 665 HD23 LEU 665 -10.431 -3.044 -8.562 534 H LEU 666 H LEU 666 -11.585 -5.481 -4.092 535 HA LEU 666 HA LEU 666 -9.522 -6.034 -2.314 536 HB2 LEU 666 HB2 LEU 666 -12.207 -7.366 -2.749 537 HB3 LEU 666 HB3 LEU 666 -11.141 -7.891 -1.490 538 HG LEU 666 HG LEU 666 -12.038 -4.998 -1.568 539 HD11 LEU 666 HD11 LEU 666 -13.794 -5.628 0.017 540 HD12 LEU 666 HD12 LEU 666 -13.341 -7.345 -0.141 541 HD13 LEU 666 HD13 LEU 666 -14.037 -6.479 -1.516 542 HD21 LEU 666 HD21 LEU 666 -10.137 -5.518 -0.088 543 HD22 LEU 666 HD22 LEU 666 -11.064 -6.841 0.660 544 HD23 LEU 666 HD23 LEU 666 -11.596 -5.164 0.852 545 H THR 667 H THR 667 -10.784 -8.125 -4.931 546 HA THR 667 HA THR 667 -9.277 -10.452 -4.253 547 HB THR 667 HB THR 667 -10.527 -9.551 -6.868 548 HG1 THR 667 HG1 THR 667 -12.042 -9.920 -5.424 549 HG21 THR 667 HG21 THR 667 -8.749 -11.063 -7.441 550 HG22 THR 667 HG22 THR 667 -10.263 -11.963 -7.508 551 HG23 THR 667 HG23 THR 667 -9.160 -12.161 -6.112 552 H ASP 668 H ASP 668 -8.784 -7.927 -6.748 553 HA ASP 668 HA ASP 668 -6.320 -8.764 -7.769 554 HB2 ASP 668 HB2 ASP 668 -7.813 -6.155 -7.454 555 HB3 ASP 668 HB3 ASP 668 -6.213 -6.189 -8.201 556 H MET 669 H MET 669 -7.087 -6.718 -4.983 557 HA MET 669 HA MET 669 -4.400 -5.945 -4.351 558 HB2 MET 669 HB2 MET 669 -6.953 -5.902 -2.707 559 HB3 MET 669 HB3 MET 669 -5.472 -5.053 -2.271 560 HG2 MET 669 HG2 MET 669 -6.640 -4.519 -4.996 561 HG3 MET 669 HG3 MET 669 -7.514 -3.903 -3.613 562 HE1 MET 669 HE1 MET 669 -5.449 -1.016 -2.357 563 HE2 MET 669 HE2 MET 669 -7.088 -1.669 -2.600 564 HE3 MET 669 HE3 MET 669 -5.890 -2.595 -1.657 565 H ARG 670 H ARG 670 -6.600 -8.451 -2.825 566 HA ARG 670 HA ARG 670 -4.506 -9.464 -1.129 567 HB2 ARG 670 HB2 ARG 670 -5.898 -11.351 -0.585 568 HB3 ARG 670 HB3 ARG 670 -6.915 -9.943 -0.627 569 HG2 ARG 670 HG2 ARG 670 -7.775 -10.508 -2.787 570 HG3 ARG 670 HG3 ARG 670 -6.652 -11.829 -3.009 571 HD2 ARG 670 HD2 ARG 670 -7.780 -13.219 -1.476 572 HD3 ARG 670 HD3 ARG 670 -8.656 -11.854 -0.764 573 HE ARG 670 HE ARG 670 -9.158 -12.284 -3.616 574 HH11 ARG 670 HH11 ARG 670 -10.271 -13.554 -0.555 575 HH12 ARG 670 HH12 ARG 670 -11.948 -13.081 -0.772 576 HH21 ARG 670 HH21 ARG 670 -11.453 -11.771 -4.058 577 HH22 ARG 670 HH22 ARG 670 -12.543 -12.003 -2.739 578 H LYS 671 H LYS 671 -5.390 -10.118 -4.485 579 HA LYS 671 HA LYS 671 -3.692 -12.386 -4.726 580 HB2 LYS 671 HB2 LYS 671 -5.041 -10.509 -6.697 581 HB3 LYS 671 HB3 LYS 671 -3.849 -11.623 -7.312 582 HG2 LYS 671 HG2 LYS 671 -6.093 -12.697 -5.586 583 HG3 LYS 671 HG3 LYS 671 -6.378 -12.282 -7.274 584 HD2 LYS 671 HD2 LYS 671 -5.896 -14.615 -7.115 585 HD3 LYS 671 HD3 LYS 671 -4.616 -13.832 -8.026 586 HE2 LYS 671 HE2 LYS 671 -4.330 -14.348 -5.047 587 HE3 LYS 671 HE3 LYS 671 -4.124 -15.665 -6.199 588 HZ1 LYS 671 HZ1 LYS 671 -2.448 -13.202 -6.137 589 HZ2 LYS 671 HZ2 LYS 671 -2.357 -14.391 -7.272 590 HZ3 LYS 671 HZ3 LYS 671 -2.009 -14.707 -5.700 591 H SER 672 H SER 672 -3.165 -8.939 -5.295 592 HA SER 672 HA SER 672 -0.492 -9.244 -6.360 593 HB2 SER 672 HB2 SER 672 -1.847 -6.797 -5.137 594 HB3 SER 672 HB3 SER 672 -0.411 -6.811 -6.181 595 HG SER 672 HG SER 672 -3.108 -7.503 -6.827 596 H GLY 673 H GLY 673 -1.879 -8.584 -3.119 597 HA2 GLY 673 HA2 GLY 673 -0.762 -9.368 -1.133 598 HA3 GLY 673 HA3 GLY 673 0.806 -9.081 -1.900 599 H ILE 674 H ILE 674 -1.935 -6.857 -2.124 600 HA ILE 674 HA ILE 674 -0.475 -4.701 -0.678 601 HB ILE 674 HB ILE 674 -3.102 -4.889 -2.258 602 HG12 ILE 674 HG12 ILE 674 -0.482 -3.501 -2.932 603 HG13 ILE 674 HG13 ILE 674 -1.017 -5.028 -3.596 604 HG21 ILE 674 HG21 ILE 674 -3.484 -3.241 -0.520 605 HG22 ILE 674 HG22 ILE 674 -1.950 -2.431 -0.882 606 HG23 ILE 674 HG23 ILE 674 -3.298 -2.414 -2.043 607 HD11 ILE 674 HD11 ILE 674 -1.434 -3.315 -5.220 608 HD12 ILE 674 HD12 ILE 674 -2.973 -3.966 -4.640 609 HD13 ILE 674 HD13 ILE 674 -2.400 -2.372 -4.077 610 H ILE 675 H ILE 675 -3.240 -6.849 -0.530 611 HA ILE 675 HA ILE 675 -3.423 -6.470 2.356 612 HB ILE 675 HB ILE 675 -5.826 -6.596 2.349 613 HG12 ILE 675 HG12 ILE 675 -5.639 -6.959 -0.638 614 HG13 ILE 675 HG13 ILE 675 -6.187 -8.153 0.548 615 HG21 ILE 675 HG21 ILE 675 -4.745 -4.315 1.812 616 HG22 ILE 675 HG22 ILE 675 -5.279 -4.573 0.152 617 HG23 ILE 675 HG23 ILE 675 -6.461 -4.480 1.462 618 HD11 ILE 675 HD11 ILE 675 -8.087 -6.590 1.101 619 HD12 ILE 675 HD12 ILE 675 -7.596 -5.617 -0.315 620 HD13 ILE 675 HD13 ILE 675 -8.113 -7.294 -0.527 621 H TYR 676 H TYR 676 -4.718 -8.585 3.042 622 HA TYR 676 HA TYR 676 -4.468 -10.831 1.202 623 HB2 TYR 676 HB2 TYR 676 -3.616 -12.310 2.932 624 HB3 TYR 676 HB3 TYR 676 -2.448 -11.048 2.560 625 HD1 TYR 676 HD1 TYR 676 -2.306 -9.003 4.203 626 HD2 TYR 676 HD2 TYR 676 -4.160 -12.781 5.172 627 HE1 TYR 676 HE1 TYR 676 -2.044 -8.506 6.606 628 HE2 TYR 676 HE2 TYR 676 -3.859 -12.317 7.570 629 HH TYR 676 HH TYR 676 -3.003 -10.836 9.156 630 H GLU 677 H GLU 677 -6.009 -12.739 2.473 631 HA GLU 677 HA GLU 677 -7.516 -11.269 4.443 632 HB2 GLU 677 HB2 GLU 677 -9.582 -12.036 3.896 633 HB3 GLU 677 HB3 GLU 677 -8.869 -11.488 2.399 634 HG2 GLU 677 HG2 GLU 677 -9.221 -14.341 3.298 635 HG3 GLU 677 HG3 GLU 677 -10.301 -13.401 2.256 636 H ALA 678 H ALA 678 -8.275 -12.264 6.244 637 HA ALA 678 HA ALA 678 -6.107 -14.123 7.122 638 HB1 ALA 678 HB1 ALA 678 -7.725 -12.073 8.686 639 HB2 ALA 678 HB2 ALA 678 -6.301 -12.965 9.257 640 HB3 ALA 678 HB3 ALA 678 -6.138 -11.752 7.960 641 H LYS 679 H LYS 679 -9.568 -13.674 7.031 642 HA LYS 679 HA LYS 679 -9.932 -16.413 7.835 643 HB2 LYS 679 HB2 LYS 679 -11.567 -14.144 9.124 644 HB3 LYS 679 HB3 LYS 679 -12.058 -15.814 9.099 645 HG2 LYS 679 HG2 LYS 679 -11.150 -15.795 11.165 646 HG3 LYS 679 HG3 LYS 679 -9.700 -16.240 10.263 647 HD2 LYS 679 HD2 LYS 679 -9.137 -13.728 10.216 648 HD3 LYS 679 HD3 LYS 679 -10.488 -13.474 11.316 649 HE2 LYS 679 HE2 LYS 679 -8.122 -15.333 11.870 650 HE3 LYS 679 HE3 LYS 679 -8.203 -13.635 12.367 651 HZ1 LYS 679 HZ1 LYS 679 -10.249 -14.172 13.591 652 HZ2 LYS 679 HZ2 LYS 679 -8.931 -14.689 14.207 653 HZ3 LYS 679 HZ3 LYS 679 -9.909 -15.809 13.395 654 HA PRO 680 HA PRO 680 -12.611 -15.945 4.238 655 HB2 PRO 680 HB2 PRO 680 -14.936 -17.287 5.030 656 HB3 PRO 680 HB3 PRO 680 -13.469 -18.062 4.356 657 HG2 PRO 680 HG2 PRO 680 -14.246 -17.739 7.264 658 HG3 PRO 680 HG3 PRO 680 -13.591 -19.192 6.441 659 HD2 PRO 680 HD2 PRO 680 -11.983 -17.588 7.902 660 HD3 PRO 680 HD3 PRO 680 -11.399 -18.249 6.355 661 H GLU 681 H GLU 681 -14.083 -14.400 3.616 662 HA GLU 681 HA GLU 681 -15.363 -12.575 3.653 663 HB2 GLU 681 HB2 GLU 681 -16.794 -14.135 5.068 664 HB3 GLU 681 HB3 GLU 681 -16.298 -13.213 6.471 665 HG2 GLU 681 HG2 GLU 681 -17.597 -11.850 4.075 666 HG3 GLU 681 HG3 GLU 681 -18.557 -12.780 5.201 667 H CYS 682 H CYS 682 -12.484 -12.739 5.406 668 HA CYS 682 HA CYS 682 -12.817 -9.979 6.473 669 HB2 CYS 682 HB2 CYS 682 -13.414 -11.898 8.007 670 HB3 CYS 682 HB3 CYS 682 -11.726 -12.383 7.934 671 H TYR 683 H TYR 683 -11.475 -8.856 5.244 672 HA TYR 683 HA TYR 683 -8.908 -10.020 4.398 673 HB2 TYR 683 HB2 TYR 683 -10.290 -7.552 3.437 674 HB3 TYR 683 HB3 TYR 683 -8.797 -8.255 2.805 675 HD1 TYR 683 HD1 TYR 683 -12.453 -9.205 3.237 676 HD2 TYR 683 HD2 TYR 683 -8.904 -9.356 0.791 677 HE1 TYR 683 HE1 TYR 683 -13.786 -10.073 1.317 678 HE2 TYR 683 HE2 TYR 683 -10.256 -10.129 -1.117 679 HH TYR 683 HH TYR 683 -13.683 -9.909 -1.377 680 H LYS 684 H LYS 684 -6.804 -8.759 4.669 681 HA LYS 684 HA LYS 684 -7.071 -6.443 6.489 682 HB2 LYS 684 HB2 LYS 684 -6.538 -8.741 7.768 683 HB3 LYS 684 HB3 LYS 684 -4.911 -8.425 7.161 684 HG2 LYS 684 HG2 LYS 684 -5.394 -5.973 8.137 685 HG3 LYS 684 HG3 LYS 684 -6.615 -6.831 9.068 686 HD2 LYS 684 HD2 LYS 684 -4.817 -8.273 10.053 687 HD3 LYS 684 HD3 LYS 684 -3.632 -7.414 9.049 688 HE2 LYS 684 HE2 LYS 684 -3.398 -6.206 10.999 689 HE3 LYS 684 HE3 LYS 684 -4.606 -5.242 10.157 690 HZ1 LYS 684 HZ1 LYS 684 -4.863 -6.799 12.570 691 HZ2 LYS 684 HZ2 LYS 684 -6.134 -6.956 11.572 692 HZ3 LYS 684 HZ3 LYS 684 -5.695 -5.450 12.125 693 H LYS 685 H LYS 685 -5.359 -4.951 6.309 694 HA LYS 685 HA LYS 685 -4.047 -4.952 3.732 695 HB2 LYS 685 HB2 LYS 685 -5.165 -3.006 5.103 696 HB3 LYS 685 HB3 LYS 685 -3.642 -2.916 5.966 697 HG2 LYS 685 HG2 LYS 685 -3.554 -2.913 2.955 698 HG3 LYS 685 HG3 LYS 685 -4.296 -1.514 3.719 699 HD2 LYS 685 HD2 LYS 685 -2.318 -0.813 4.745 700 HD3 LYS 685 HD3 LYS 685 -1.598 -2.426 4.671 701 HE2 LYS 685 HE2 LYS 685 -1.643 -2.226 2.128 702 HE3 LYS 685 HE3 LYS 685 -2.057 -0.509 2.344 703 HZ1 LYS 685 HZ1 LYS 685 0.005 -0.170 3.464 704 HZ2 LYS 685 HZ2 LYS 685 0.356 -0.990 2.095 705 HZ3 LYS 685 HZ3 LYS 685 0.312 -1.833 3.516 706 H VAL 686 H VAL 686 -1.636 -4.724 3.413 707 HA VAL 686 HA VAL 686 -0.168 -6.039 5.635 708 HB VAL 686 HB VAL 686 -0.381 -7.115 3.272 709 HG11 VAL 686 HG11 VAL 686 1.477 -6.595 1.757 710 HG12 VAL 686 HG12 VAL 686 0.393 -5.197 1.900 711 HG13 VAL 686 HG13 VAL 686 1.951 -5.214 2.743 712 HG21 VAL 686 HG21 VAL 686 0.996 -7.972 5.102 713 HG22 VAL 686 HG22 VAL 686 1.818 -8.144 3.540 714 HG23 VAL 686 HG23 VAL 686 2.304 -6.846 4.659 Start of MODEL 8 1 H1 GLY 600 H1 GLY 600 22.318 -3.392 -17.797 2 H2 GLY 600 H2 GLY 600 23.377 -3.601 -16.576 3 H3 GLY 600 H3 GLY 600 23.941 -3.293 -18.110 4 HA2 GLY 600 HA2 GLY 600 22.993 -5.407 -18.865 5 HA3 GLY 600 HA3 GLY 600 24.241 -5.619 -17.610 6 H SER 601 H SER 601 23.635 -6.356 -15.498 7 HA SER 601 HA SER 601 20.870 -6.551 -14.669 8 HB2 SER 601 HB2 SER 601 22.172 -6.420 -12.420 9 HB3 SER 601 HB3 SER 601 22.408 -7.864 -13.424 10 HG SER 601 HG SER 601 24.383 -6.904 -12.634 11 H HIS 602 H HIS 602 20.136 -4.848 -13.012 12 HA HIS 602 HA HIS 602 21.336 -2.205 -13.279 13 HB2 HIS 602 HB2 HIS 602 18.413 -2.735 -13.982 14 HB3 HIS 602 HB3 HIS 602 19.217 -1.170 -13.953 15 HD1 HIS 602 HD1 HIS 602 18.347 -3.870 -16.327 16 HD2 HIS 602 HD2 HIS 602 21.396 -1.002 -15.870 17 HE1 HIS 602 HE1 HIS 602 19.505 -3.682 -18.586 18 H MET 603 H MET 603 20.207 -0.724 -11.707 19 HA MET 603 HA MET 603 19.544 -2.131 -9.215 20 HB2 MET 603 HB2 MET 603 19.916 0.834 -9.868 21 HB3 MET 603 HB3 MET 603 19.588 0.175 -8.268 22 HG2 MET 603 HG2 MET 603 21.894 0.529 -8.280 23 HG3 MET 603 HG3 MET 603 21.678 -1.206 -8.445 24 HE1 MET 603 HE1 MET 603 22.953 2.114 -9.995 25 HE2 MET 603 HE2 MET 603 23.318 1.685 -11.681 26 HE3 MET 603 HE3 MET 603 21.629 1.798 -11.143 27 H GLY 604 H GLY 604 17.649 -1.090 -7.892 28 HA2 GLY 604 HA2 GLY 604 15.467 0.172 -9.093 29 HA3 GLY 604 HA3 GLY 604 15.197 -1.590 -9.103 30 H GLU 605 H GLU 605 13.401 -0.727 -7.482 31 HA GLU 605 HA GLU 605 14.431 -1.250 -4.810 32 HB2 GLU 605 HB2 GLU 605 13.186 0.490 -3.752 33 HB3 GLU 605 HB3 GLU 605 14.320 1.220 -4.884 34 HG2 GLU 605 HG2 GLU 605 12.537 1.668 -6.493 35 HG3 GLU 605 HG3 GLU 605 11.365 0.773 -5.521 36 H SER 606 H SER 606 12.374 -1.593 -3.313 37 HA SER 606 HA SER 606 9.860 -2.173 -4.380 38 HB2 SER 606 HB2 SER 606 11.689 -4.570 -3.865 39 HB3 SER 606 HB3 SER 606 9.918 -4.686 -3.873 40 HG SER 606 HG SER 606 11.207 -3.425 -6.035 41 H GLY 607 H GLY 607 8.614 -3.415 -2.475 42 HA2 GLY 607 HA2 GLY 607 8.097 -3.663 -0.249 43 HA3 GLY 607 HA3 GLY 607 9.762 -3.243 0.189 44 H LYS 608 H LYS 608 10.132 -0.749 -0.739 45 HA LYS 608 HA LYS 608 8.228 1.045 0.580 46 HB2 LYS 608 HB2 LYS 608 10.646 1.612 0.337 47 HB3 LYS 608 HB3 LYS 608 10.468 1.651 -1.411 48 HG2 LYS 608 HG2 LYS 608 8.425 3.341 -0.123 49 HG3 LYS 608 HG3 LYS 608 10.017 3.737 0.499 50 HD2 LYS 608 HD2 LYS 608 9.435 5.170 -1.386 51 HD3 LYS 608 HD3 LYS 608 10.849 4.176 -1.774 52 HE2 LYS 608 HE2 LYS 608 9.414 2.612 -3.043 53 HE3 LYS 608 HE3 LYS 608 7.973 3.548 -2.575 54 HZ1 LYS 608 HZ1 LYS 608 10.121 4.336 -4.443 55 HZ2 LYS 608 HZ2 LYS 608 8.935 5.417 -3.787 56 HZ3 LYS 608 HZ3 LYS 608 8.460 4.214 -4.671 57 H ILE 609 H ILE 609 6.250 1.178 -0.272 58 HA ILE 609 HA ILE 609 5.820 1.280 -3.211 59 HB ILE 609 HB ILE 609 4.199 0.381 -0.829 60 HG12 ILE 609 HG12 ILE 609 3.365 -1.287 -2.509 61 HG13 ILE 609 HG13 ILE 609 4.430 -0.566 -3.718 62 HG21 ILE 609 HG21 ILE 609 2.704 2.132 -1.697 63 HG22 ILE 609 HG22 ILE 609 2.810 1.425 -3.331 64 HG23 ILE 609 HG23 ILE 609 2.060 0.527 -2.000 65 HD11 ILE 609 HD11 ILE 609 5.342 -1.875 -1.121 66 HD12 ILE 609 HD12 ILE 609 5.287 -2.674 -2.702 67 HD13 ILE 609 HD13 ILE 609 6.393 -1.321 -2.454 68 H ASP 610 H ASP 610 4.094 3.072 -3.743 69 HA ASP 610 HA ASP 610 4.398 5.494 -2.089 70 HB2 ASP 610 HB2 ASP 610 4.435 5.595 -5.116 71 HB3 ASP 610 HB3 ASP 610 4.777 6.885 -3.978 72 H ILE 611 H ILE 611 2.672 7.090 -2.965 73 HA ILE 611 HA ILE 611 0.173 5.690 -3.774 74 HB ILE 611 HB ILE 611 0.677 8.656 -3.219 75 HG12 ILE 611 HG12 ILE 611 -0.979 8.063 -1.242 76 HG13 ILE 611 HG13 ILE 611 -0.367 6.424 -1.434 77 HG21 ILE 611 HG21 ILE 611 -1.796 8.804 -3.223 78 HG22 ILE 611 HG22 ILE 611 -1.177 8.268 -4.784 79 HG23 ILE 611 HG23 ILE 611 -1.894 7.081 -3.673 80 HD11 ILE 611 HD11 ILE 611 1.901 7.207 -0.844 81 HD12 ILE 611 HD12 ILE 611 1.345 8.898 -0.886 82 HD13 ILE 611 HD13 ILE 611 0.743 7.783 0.355 83 H ASP 612 H ASP 612 2.634 8.008 -4.797 84 HA ASP 612 HA ASP 612 1.757 9.025 -7.123 85 HB2 ASP 612 HB2 ASP 612 4.598 8.241 -6.386 86 HB3 ASP 612 HB3 ASP 612 4.112 9.508 -7.524 87 H THR 613 H THR 613 3.649 6.093 -6.675 88 HA THR 613 HA THR 613 4.080 5.275 -9.313 89 HB THR 613 HB THR 613 5.073 4.565 -7.065 90 HG1 THR 613 HG1 THR 613 5.871 2.791 -7.949 91 HG21 THR 613 HG21 THR 613 4.309 2.665 -5.920 92 HG22 THR 613 HG22 THR 613 3.046 2.336 -7.123 93 HG23 THR 613 HG23 THR 613 2.917 3.754 -6.055 94 H ILE 614 H ILE 614 1.097 5.239 -7.544 95 HA ILE 614 HA ILE 614 -0.154 3.308 -9.433 96 HB ILE 614 HB ILE 614 -1.158 4.491 -6.815 97 HG12 ILE 614 HG12 ILE 614 -0.612 1.537 -7.129 98 HG13 ILE 614 HG13 ILE 614 0.787 2.568 -6.953 99 HG21 ILE 614 HG21 ILE 614 -2.960 2.802 -6.979 100 HG22 ILE 614 HG22 ILE 614 -3.025 3.964 -8.310 101 HG23 ILE 614 HG23 ILE 614 -2.353 2.338 -8.586 102 HD11 ILE 614 HD11 ILE 614 0.158 1.819 -4.778 103 HD12 ILE 614 HD12 ILE 614 -0.143 3.561 -4.894 104 HD13 ILE 614 HD13 ILE 614 -1.506 2.422 -4.986 105 H MET 615 H MET 615 -0.629 6.602 -7.977 106 HA MET 615 HA MET 615 -2.852 7.140 -9.749 107 HB2 MET 615 HB2 MET 615 -2.892 9.337 -8.680 108 HB3 MET 615 HB3 MET 615 -2.757 8.028 -7.503 109 HG2 MET 615 HG2 MET 615 -1.340 9.730 -6.709 110 HG3 MET 615 HG3 MET 615 -0.301 8.484 -7.361 111 HE1 MET 615 HE1 MET 615 -0.887 12.741 -9.006 112 HE2 MET 615 HE2 MET 615 -2.231 11.646 -8.576 113 HE3 MET 615 HE3 MET 615 -1.136 12.246 -7.316 114 H THR 616 H THR 616 0.503 7.361 -10.261 115 HA THR 616 HA THR 616 0.392 9.277 -12.405 116 HB THR 616 HB THR 616 2.455 8.580 -11.169 117 HG1 THR 616 HG1 THR 616 2.741 9.672 -13.037 118 HG21 THR 616 HG21 THR 616 2.514 6.144 -13.001 119 HG22 THR 616 HG22 THR 616 2.086 6.067 -11.279 120 HG23 THR 616 HG23 THR 616 3.697 6.614 -11.769 121 H GLY 617 H GLY 617 -0.267 5.789 -12.181 122 HA2 GLY 617 HA2 GLY 617 -0.594 5.583 -15.147 123 HA3 GLY 617 HA3 GLY 617 -0.163 4.272 -14.047 124 H LYS 618 H LYS 618 -2.397 5.683 -12.237 125 HA LYS 618 HA LYS 618 -4.778 4.520 -13.593 126 HB2 LYS 618 HB2 LYS 618 -3.966 4.476 -10.642 127 HB3 LYS 618 HB3 LYS 618 -5.557 4.038 -11.227 128 HG2 LYS 618 HG2 LYS 618 -4.364 2.303 -12.749 129 HG3 LYS 618 HG3 LYS 618 -2.909 2.645 -11.794 130 HD2 LYS 618 HD2 LYS 618 -4.286 2.049 -9.722 131 HD3 LYS 618 HD3 LYS 618 -5.554 1.489 -10.827 132 HE2 LYS 618 HE2 LYS 618 -3.959 -0.100 -11.867 133 HE3 LYS 618 HE3 LYS 618 -2.669 0.484 -10.809 134 HZ1 LYS 618 HZ1 LYS 618 -3.925 -0.339 -8.920 135 HZ2 LYS 618 HZ2 LYS 618 -3.623 -1.553 -9.982 136 HZ3 LYS 618 HZ3 LYS 618 -5.123 -0.893 -9.904 137 HA PRO 619 HA PRO 619 -6.431 8.582 -12.962 138 HB2 PRO 619 HB2 PRO 619 -9.118 8.135 -12.564 139 HB3 PRO 619 HB3 PRO 619 -8.309 7.997 -14.158 140 HG2 PRO 619 HG2 PRO 619 -8.980 5.784 -12.190 141 HG3 PRO 619 HG3 PRO 619 -9.260 5.807 -13.962 142 HD2 PRO 619 HD2 PRO 619 -7.107 4.560 -12.856 143 HD3 PRO 619 HD3 PRO 619 -6.969 5.427 -14.416 144 H LYS 620 H LYS 620 -7.290 9.961 -11.334 145 HA LYS 620 HA LYS 620 -6.426 9.381 -8.710 146 HB2 LYS 620 HB2 LYS 620 -8.129 11.565 -9.951 147 HB3 LYS 620 HB3 LYS 620 -7.841 11.524 -8.222 148 HG2 LYS 620 HG2 LYS 620 -6.262 13.003 -9.460 149 HG3 LYS 620 HG3 LYS 620 -5.486 11.782 -8.454 150 HD2 LYS 620 HD2 LYS 620 -4.934 10.430 -10.408 151 HD3 LYS 620 HD3 LYS 620 -5.812 11.550 -11.480 152 HE2 LYS 620 HE2 LYS 620 -4.195 13.271 -11.145 153 HE3 LYS 620 HE3 LYS 620 -3.504 12.453 -9.745 154 HZ1 LYS 620 HZ1 LYS 620 -2.094 12.144 -11.650 155 HZ2 LYS 620 HZ2 LYS 620 -3.314 11.497 -12.538 156 HZ3 LYS 620 HZ3 LYS 620 -2.710 10.679 -11.258 157 H SER 621 H SER 621 -9.712 9.284 -10.068 158 HA SER 621 HA SER 621 -11.345 8.447 -8.104 159 HB2 SER 621 HB2 SER 621 -11.847 8.668 -10.515 160 HB3 SER 621 HB3 SER 621 -11.100 7.090 -10.809 161 HG SER 621 HG SER 621 -13.552 7.519 -10.276 162 H ALA 622 H ALA 622 -8.634 6.395 -9.396 163 HA ALA 622 HA ALA 622 -9.454 3.937 -8.183 164 HB1 ALA 622 HB1 ALA 622 -7.779 4.054 -10.001 165 HB2 ALA 622 HB2 ALA 622 -6.648 4.885 -8.906 166 HB3 ALA 622 HB3 ALA 622 -7.156 3.224 -8.560 167 H ARG 623 H ARG 623 -6.962 6.358 -7.086 168 HA ARG 623 HA ARG 623 -6.780 5.133 -4.441 169 HB2 ARG 623 HB2 ARG 623 -5.188 6.732 -3.962 170 HB3 ARG 623 HB3 ARG 623 -5.087 6.788 -5.723 171 HG2 ARG 623 HG2 ARG 623 -6.857 8.665 -5.559 172 HG3 ARG 623 HG3 ARG 623 -6.529 8.674 -3.828 173 HD2 ARG 623 HD2 ARG 623 -4.151 9.296 -4.428 174 HD3 ARG 623 HD3 ARG 623 -4.700 9.431 -6.124 175 HE ARG 623 HE ARG 623 -6.541 10.909 -5.230 176 HH11 ARG 623 HH11 ARG 623 -3.374 11.193 -3.676 177 HH12 ARG 623 HH12 ARG 623 -3.946 12.237 -2.413 178 HH21 ARG 623 HH21 ARG 623 -7.333 11.921 -3.449 179 HH22 ARG 623 HH22 ARG 623 -6.287 12.864 -2.409 180 H GLU 624 H GLU 624 -8.781 7.704 -5.828 181 HA GLU 624 HA GLU 624 -9.872 8.686 -3.425 182 HB2 GLU 624 HB2 GLU 624 -10.521 8.657 -6.300 183 HB3 GLU 624 HB3 GLU 624 -11.909 8.941 -5.297 184 HG2 GLU 624 HG2 GLU 624 -10.682 10.952 -6.229 185 HG3 GLU 624 HG3 GLU 624 -11.107 10.966 -4.532 186 H LYS 625 H LYS 625 -10.781 5.723 -5.225 187 HA LYS 625 HA LYS 625 -12.690 5.151 -2.985 188 HB2 LYS 625 HB2 LYS 625 -13.621 3.389 -4.209 189 HB3 LYS 625 HB3 LYS 625 -13.534 4.830 -5.224 190 HG2 LYS 625 HG2 LYS 625 -11.466 3.786 -6.315 191 HG3 LYS 625 HG3 LYS 625 -11.765 2.348 -5.354 192 HD2 LYS 625 HD2 LYS 625 -12.700 2.026 -7.574 193 HD3 LYS 625 HD3 LYS 625 -14.005 2.090 -6.392 194 HE2 LYS 625 HE2 LYS 625 -14.608 3.324 -8.413 195 HE3 LYS 625 HE3 LYS 625 -14.499 4.425 -7.031 196 HZ1 LYS 625 HZ1 LYS 625 -13.356 5.410 -8.905 197 HZ2 LYS 625 HZ2 LYS 625 -12.442 4.057 -9.116 198 HZ3 LYS 625 HZ3 LYS 625 -12.253 5.015 -7.785 199 H MET 626 H MET 626 -9.549 3.928 -4.190 200 HA MET 626 HA MET 626 -9.616 1.536 -2.587 201 HB2 MET 626 HB2 MET 626 -7.379 3.092 -3.925 202 HB3 MET 626 HB3 MET 626 -7.096 1.610 -3.020 203 HG2 MET 626 HG2 MET 626 -8.618 0.379 -4.503 204 HG3 MET 626 HG3 MET 626 -8.986 1.850 -5.389 205 HE1 MET 626 HE1 MET 626 -6.409 -0.999 -4.711 206 HE2 MET 626 HE2 MET 626 -4.971 -0.471 -5.608 207 HE3 MET 626 HE3 MET 626 -5.447 0.384 -4.129 208 H MET 627 H MET 627 -8.329 4.858 -2.045 209 HA MET 627 HA MET 627 -7.189 4.377 0.502 210 HB2 MET 627 HB2 MET 627 -8.366 6.919 -0.667 211 HB3 MET 627 HB3 MET 627 -7.511 6.822 0.864 212 HG2 MET 627 HG2 MET 627 -6.296 6.080 -1.817 213 HG3 MET 627 HG3 MET 627 -6.060 7.603 -0.961 214 HE1 MET 627 HE1 MET 627 -3.704 5.749 -2.068 215 HE2 MET 627 HE2 MET 627 -3.455 7.307 -1.240 216 HE3 MET 627 HE3 MET 627 -2.561 5.863 -0.711 217 H LYS 628 H LYS 628 -10.430 5.114 -0.617 218 HA LYS 628 HA LYS 628 -11.591 5.607 2.019 219 HB2 LYS 628 HB2 LYS 628 -12.829 4.922 -0.672 220 HB3 LYS 628 HB3 LYS 628 -13.806 5.057 0.780 221 HG2 LYS 628 HG2 LYS 628 -11.894 7.290 0.038 222 HG3 LYS 628 HG3 LYS 628 -13.462 7.147 -0.774 223 HD2 LYS 628 HD2 LYS 628 -14.698 7.518 1.119 224 HD3 LYS 628 HD3 LYS 628 -13.391 7.131 2.252 225 HE2 LYS 628 HE2 LYS 628 -13.030 9.401 0.306 226 HE3 LYS 628 HE3 LYS 628 -14.123 9.660 1.671 227 HZ1 LYS 628 HZ1 LYS 628 -11.481 10.057 1.853 228 HZ2 LYS 628 HZ2 LYS 628 -11.554 8.500 2.413 229 HZ3 LYS 628 HZ3 LYS 628 -12.415 9.614 3.143 230 H ILE 629 H ILE 629 -11.439 2.713 -0.082 231 HA ILE 629 HA ILE 629 -12.724 0.993 1.744 232 HB ILE 629 HB ILE 629 -10.656 0.454 -0.406 233 HG12 ILE 629 HG12 ILE 629 -13.604 -0.333 -0.335 234 HG13 ILE 629 HG13 ILE 629 -13.117 1.272 -0.861 235 HG21 ILE 629 HG21 ILE 629 -10.422 -1.386 1.211 236 HG22 ILE 629 HG22 ILE 629 -12.184 -1.609 1.253 237 HG23 ILE 629 HG23 ILE 629 -11.257 -1.973 -0.217 238 HD11 ILE 629 HD11 ILE 629 -13.382 -0.152 -2.788 239 HD12 ILE 629 HD12 ILE 629 -11.676 0.312 -2.615 240 HD13 ILE 629 HD13 ILE 629 -12.209 -1.318 -2.144 241 H ILE 630 H ILE 630 -9.120 1.487 1.368 242 HA ILE 630 HA ILE 630 -8.598 -0.126 3.646 243 HB ILE 630 HB ILE 630 -6.353 0.833 3.725 244 HG12 ILE 630 HG12 ILE 630 -5.802 2.221 1.495 245 HG13 ILE 630 HG13 ILE 630 -7.451 2.740 1.708 246 HG21 ILE 630 HG21 ILE 630 -5.633 -0.142 1.614 247 HG22 ILE 630 HG22 ILE 630 -6.966 -1.086 2.294 248 HG23 ILE 630 HG23 ILE 630 -7.270 0.036 0.951 249 HD11 ILE 630 HD11 ILE 630 -5.153 3.118 3.659 250 HD12 ILE 630 HD12 ILE 630 -5.960 4.371 2.698 251 HD13 ILE 630 HD13 ILE 630 -6.816 3.590 4.025 252 H GLU 631 H GLU 631 -9.520 3.335 3.543 253 HA GLU 631 HA GLU 631 -8.718 4.043 6.166 254 HB2 GLU 631 HB2 GLU 631 -10.747 4.917 4.101 255 HB3 GLU 631 HB3 GLU 631 -10.852 5.571 5.706 256 HG2 GLU 631 HG2 GLU 631 -8.837 6.737 5.548 257 HG3 GLU 631 HG3 GLU 631 -8.251 5.756 4.205 258 H ILE 632 H ILE 632 -11.772 2.634 4.776 259 HA ILE 632 HA ILE 632 -13.054 2.460 7.343 260 HB ILE 632 HB ILE 632 -13.456 0.731 4.880 261 HG12 ILE 632 HG12 ILE 632 -15.334 2.948 5.789 262 HG13 ILE 632 HG13 ILE 632 -13.930 3.367 4.828 263 HG21 ILE 632 HG21 ILE 632 -15.757 0.334 5.970 264 HG22 ILE 632 HG22 ILE 632 -14.399 -0.440 6.792 265 HG23 ILE 632 HG23 ILE 632 -15.100 1.054 7.439 266 HD11 ILE 632 HD11 ILE 632 -16.057 1.377 3.947 267 HD12 ILE 632 HD12 ILE 632 -15.882 3.055 3.394 268 HD13 ILE 632 HD13 ILE 632 -14.624 1.862 3.021 269 H ILE 633 H ILE 633 -10.876 0.195 5.570 270 HA ILE 633 HA ILE 633 -11.265 -1.975 7.367 271 HB ILE 633 HB ILE 633 -8.831 -1.420 5.620 272 HG12 ILE 633 HG12 ILE 633 -11.586 -2.407 5.021 273 HG13 ILE 633 HG13 ILE 633 -10.422 -1.540 4.033 274 HG21 ILE 633 HG21 ILE 633 -8.379 -3.087 7.397 275 HG22 ILE 633 HG22 ILE 633 -9.769 -4.040 6.846 276 HG23 ILE 633 HG23 ILE 633 -8.354 -3.806 5.796 277 HD11 ILE 633 HD11 ILE 633 -10.823 -3.611 3.004 278 HD12 ILE 633 HD12 ILE 633 -9.175 -3.613 3.632 279 HD13 ILE 633 HD13 ILE 633 -10.452 -4.516 4.487 280 H ASP 634 H ASP 634 -8.749 0.595 7.239 281 HA ASP 634 HA ASP 634 -7.580 -0.546 9.627 282 HB2 ASP 634 HB2 ASP 634 -5.766 0.970 9.446 283 HB3 ASP 634 HB3 ASP 634 -6.098 0.113 7.950 284 H SER 635 H SER 635 -9.920 1.929 9.041 285 HA SER 635 HA SER 635 -9.835 3.015 11.738 286 HB2 SER 635 HB2 SER 635 -12.262 2.656 9.927 287 HB3 SER 635 HB3 SER 635 -12.161 3.661 11.384 288 HG SER 635 HG SER 635 -10.796 3.937 8.909 289 H LEU 636 H LEU 636 -11.744 0.324 10.227 290 HA LEU 636 HA LEU 636 -12.993 -0.618 12.583 291 HB2 LEU 636 HB2 LEU 636 -12.194 -1.792 9.936 292 HB3 LEU 636 HB3 LEU 636 -12.737 -2.883 11.177 293 HG LEU 636 HG LEU 636 -14.313 -1.817 9.318 294 HD11 LEU 636 HD11 LEU 636 -15.159 -2.398 12.197 295 HD12 LEU 636 HD12 LEU 636 -14.971 -3.592 10.893 296 HD13 LEU 636 HD13 LEU 636 -16.253 -2.377 10.802 297 HD21 LEU 636 HD21 LEU 636 -14.899 0.089 11.607 298 HD22 LEU 636 HD22 LEU 636 -15.819 -0.118 10.110 299 HD23 LEU 636 HD23 LEU 636 -14.182 0.534 10.035 300 H ALA 637 H ALA 637 -9.870 -1.644 11.109 301 HA ALA 637 HA ALA 637 -9.205 -3.538 13.114 302 HB1 ALA 637 HB1 ALA 637 -8.183 -3.428 10.850 303 HB2 ALA 637 HB2 ALA 637 -7.317 -1.948 11.341 304 HB3 ALA 637 HB3 ALA 637 -6.977 -3.489 12.151 305 H VAL 638 H VAL 638 -9.209 -0.037 13.476 306 HA VAL 638 HA VAL 638 -7.113 -0.004 15.454 307 HB VAL 638 HB VAL 638 -8.364 1.933 14.033 308 HG11 VAL 638 HG11 VAL 638 -9.485 2.427 16.819 309 HG12 VAL 638 HG12 VAL 638 -9.715 3.381 15.342 310 HG13 VAL 638 HG13 VAL 638 -10.467 1.787 15.491 311 HG21 VAL 638 HG21 VAL 638 -6.198 2.121 15.120 312 HG22 VAL 638 HG22 VAL 638 -7.190 3.549 15.450 313 HG23 VAL 638 HG23 VAL 638 -6.980 2.307 16.708 314 H SER 639 H SER 639 -10.254 -1.389 15.519 315 HA SER 639 HA SER 639 -9.877 -2.002 18.362 316 HB2 SER 639 HB2 SER 639 -12.307 -0.458 17.373 317 HB3 SER 639 HB3 SER 639 -12.202 -1.264 18.953 318 HG SER 639 HG SER 639 -10.010 0.292 18.395 319 H SER 640 H SER 640 -9.706 -3.562 15.902 320 HA SER 640 HA SER 640 -11.467 -5.719 16.712 321 HB2 SER 640 HB2 SER 640 -12.820 -4.461 14.986 322 HB3 SER 640 HB3 SER 640 -11.479 -4.664 13.844 323 HG SER 640 HG SER 640 -12.549 -6.411 13.355 324 H GLU 641 H GLU 641 -10.715 -7.729 15.645 325 HA GLU 641 HA GLU 641 -7.844 -7.946 15.219 326 HB2 GLU 641 HB2 GLU 641 -10.124 -9.803 14.404 327 HB3 GLU 641 HB3 GLU 641 -8.410 -10.219 14.429 328 HG2 GLU 641 HG2 GLU 641 -8.377 -9.970 16.896 329 HG3 GLU 641 HG3 GLU 641 -10.100 -9.553 16.880 330 H CYS 642 H CYS 642 -10.723 -7.427 13.243 331 HA CYS 642 HA CYS 642 -9.266 -6.722 10.855 332 HB2 CYS 642 HB2 CYS 642 -10.272 -8.610 9.508 333 HB3 CYS 642 HB3 CYS 642 -9.058 -9.119 10.674 334 H ALA 643 H ALA 643 -10.755 -6.114 9.123 335 HA ALA 643 HA ALA 643 -13.255 -4.923 10.144 336 HB1 ALA 643 HB1 ALA 643 -11.618 -3.622 8.782 337 HB2 ALA 643 HB2 ALA 643 -11.934 -4.696 7.414 338 HB3 ALA 643 HB3 ALA 643 -13.245 -3.689 8.055 339 H LYS 644 H LYS 644 -15.071 -6.153 10.080 340 HA LYS 644 HA LYS 644 -15.524 -8.415 8.399 341 HB2 LYS 644 HB2 LYS 644 -17.805 -8.270 9.261 342 HB3 LYS 644 HB3 LYS 644 -16.575 -8.141 10.530 343 HG2 LYS 644 HG2 LYS 644 -16.945 -5.537 10.168 344 HG3 LYS 644 HG3 LYS 644 -18.480 -6.092 9.455 345 HD2 LYS 644 HD2 LYS 644 -19.042 -7.228 11.555 346 HD3 LYS 644 HD3 LYS 644 -17.448 -6.818 12.223 347 HE2 LYS 644 HE2 LYS 644 -18.864 -5.134 13.101 348 HE3 LYS 644 HE3 LYS 644 -17.951 -4.395 11.772 349 HZ1 LYS 644 HZ1 LYS 644 -20.804 -5.029 11.863 350 HZ2 LYS 644 HZ2 LYS 644 -20.009 -5.021 10.407 351 HZ3 LYS 644 HZ3 LYS 644 -20.020 -3.672 11.284 352 H VAL 645 H VAL 645 -16.203 -8.500 6.280 353 HA VAL 645 HA VAL 645 -16.259 -6.134 4.746 354 HB VAL 645 HB VAL 645 -15.601 -8.318 3.878 355 HG11 VAL 645 HG11 VAL 645 -17.524 -9.662 4.822 356 HG12 VAL 645 HG12 VAL 645 -18.565 -8.966 3.580 357 HG13 VAL 645 HG13 VAL 645 -17.174 -9.970 3.110 358 HG21 VAL 645 HG21 VAL 645 -16.404 -8.007 1.646 359 HG22 VAL 645 HG22 VAL 645 -17.851 -7.166 2.201 360 HG23 VAL 645 HG23 VAL 645 -16.279 -6.397 2.407 361 H LYS 646 H LYS 646 -18.970 -7.717 6.441 362 HA LYS 646 HA LYS 646 -21.053 -6.385 4.982 363 HB2 LYS 646 HB2 LYS 646 -20.799 -7.211 7.907 364 HB3 LYS 646 HB3 LYS 646 -22.232 -6.393 7.267 365 HG2 LYS 646 HG2 LYS 646 -22.524 -8.197 5.578 366 HG3 LYS 646 HG3 LYS 646 -21.146 -9.058 6.274 367 HD2 LYS 646 HD2 LYS 646 -22.381 -9.111 8.491 368 HD3 LYS 646 HD3 LYS 646 -23.742 -8.312 7.690 369 HE2 LYS 646 HE2 LYS 646 -24.403 -10.537 7.574 370 HE3 LYS 646 HE3 LYS 646 -23.649 -10.285 5.992 371 HZ1 LYS 646 HZ1 LYS 646 -21.567 -11.230 7.056 372 HZ2 LYS 646 HZ2 LYS 646 -22.804 -12.304 6.865 373 HZ3 LYS 646 HZ3 LYS 646 -22.461 -11.637 8.335 374 H ASP 647 H ASP 647 -18.704 -5.196 7.430 375 HA ASP 647 HA ASP 647 -20.185 -2.741 7.741 376 HB2 ASP 647 HB2 ASP 647 -18.256 -3.907 9.297 377 HB3 ASP 647 HB3 ASP 647 -17.270 -2.759 8.454 378 H ILE 648 H ILE 648 -17.374 -3.932 5.942 379 HA ILE 648 HA ILE 648 -16.551 -1.393 4.991 380 HB ILE 648 HB ILE 648 -16.065 -4.040 3.557 381 HG12 ILE 648 HG12 ILE 648 -14.313 -2.834 5.755 382 HG13 ILE 648 HG13 ILE 648 -15.403 -4.181 5.992 383 HG21 ILE 648 HG21 ILE 648 -14.025 -2.916 2.699 384 HG22 ILE 648 HG22 ILE 648 -15.454 -1.988 2.278 385 HG23 ILE 648 HG23 ILE 648 -14.428 -1.455 3.624 386 HD11 ILE 648 HD11 ILE 648 -14.178 -5.451 4.167 387 HD12 ILE 648 HD12 ILE 648 -12.944 -4.177 4.256 388 HD13 ILE 648 HD13 ILE 648 -13.294 -5.171 5.670 389 H LEU 649 H LEU 649 -18.636 -3.903 3.564 390 HA LEU 649 HA LEU 649 -19.365 -2.512 1.212 391 HB2 LEU 649 HB2 LEU 649 -20.642 -4.645 2.919 392 HB3 LEU 649 HB3 LEU 649 -21.581 -3.912 1.630 393 HG LEU 649 HG LEU 649 -18.811 -5.059 1.092 394 HD11 LEU 649 HD11 LEU 649 -19.895 -7.129 0.336 395 HD12 LEU 649 HD12 LEU 649 -21.490 -6.502 0.815 396 HD13 LEU 649 HD13 LEU 649 -20.256 -6.850 2.044 397 HD21 LEU 649 HD21 LEU 649 -19.751 -3.547 -0.649 398 HD22 LEU 649 HD22 LEU 649 -21.225 -4.525 -0.707 399 HD23 LEU 649 HD23 LEU 649 -19.673 -5.211 -1.228 400 H LYS 650 H LYS 650 -20.786 -2.396 4.529 401 HA LYS 650 HA LYS 650 -22.971 -0.715 3.828 402 HB2 LYS 650 HB2 LYS 650 -22.728 -1.951 5.981 403 HB3 LYS 650 HB3 LYS 650 -21.465 -0.821 6.481 404 HG2 LYS 650 HG2 LYS 650 -23.133 1.053 6.345 405 HG3 LYS 650 HG3 LYS 650 -24.359 -0.120 5.856 406 HD2 LYS 650 HD2 LYS 650 -24.705 0.194 8.187 407 HD3 LYS 650 HD3 LYS 650 -23.920 -1.372 8.021 408 HE2 LYS 650 HE2 LYS 650 -22.837 -0.338 9.864 409 HE3 LYS 650 HE3 LYS 650 -21.696 -0.187 8.525 410 HZ1 LYS 650 HZ1 LYS 650 -23.460 1.981 9.530 411 HZ2 LYS 650 HZ2 LYS 650 -22.446 2.080 8.195 412 HZ3 LYS 650 HZ3 LYS 650 -21.781 1.899 9.577 413 H GLU 651 H GLU 651 -19.805 0.235 5.298 414 HA GLU 651 HA GLU 651 -20.477 3.019 5.031 415 HB2 GLU 651 HB2 GLU 651 -17.728 1.853 5.510 416 HB3 GLU 651 HB3 GLU 651 -18.265 3.490 5.862 417 HG2 GLU 651 HG2 GLU 651 -19.051 0.926 7.283 418 HG3 GLU 651 HG3 GLU 651 -18.072 2.238 7.904 419 H ALA 652 H ALA 652 -18.554 0.810 2.914 420 HA ALA 652 HA ALA 652 -17.704 3.031 1.334 421 HB1 ALA 652 HB1 ALA 652 -17.666 0.151 0.637 422 HB2 ALA 652 HB2 ALA 652 -16.917 1.481 -0.297 423 HB3 ALA 652 HB3 ALA 652 -16.362 1.130 1.339 424 H GLN 653 H GLN 653 -20.607 0.904 1.137 425 HA GLN 653 HA GLN 653 -21.599 2.156 -1.263 426 HB2 GLN 653 HB2 GLN 653 -23.035 0.788 1.033 427 HB3 GLN 653 HB3 GLN 653 -23.846 1.371 -0.413 428 HG2 GLN 653 HG2 GLN 653 -21.489 -0.422 -0.911 429 HG3 GLN 653 HG3 GLN 653 -22.857 -1.168 -0.114 430 HE21 GLN 653 HE21 GLN 653 -22.012 0.818 -3.036 431 HE22 GLN 653 HE22 GLN 653 -23.197 -0.008 -4.062 432 H GLN 654 H GLN 654 -21.634 3.160 2.215 433 HA GLN 654 HA GLN 654 -23.301 5.452 1.649 434 HB2 GLN 654 HB2 GLN 654 -21.271 5.324 3.903 435 HB3 GLN 654 HB3 GLN 654 -22.631 6.407 3.720 436 HG2 GLN 654 HG2 GLN 654 -22.600 3.585 4.671 437 HG3 GLN 654 HG3 GLN 654 -23.433 4.976 5.301 438 HE21 GLN 654 HE21 GLN 654 -23.649 2.219 3.221 439 HE22 GLN 654 HE22 GLN 654 -25.335 2.489 2.708 440 H VAL 655 H VAL 655 -19.673 5.050 1.416 441 HA VAL 655 HA VAL 655 -19.482 7.888 0.672 442 HB VAL 655 HB VAL 655 -17.063 7.211 0.075 443 HG11 VAL 655 HG11 VAL 655 -18.152 7.087 2.926 444 HG12 VAL 655 HG12 VAL 655 -16.458 7.386 2.515 445 HG13 VAL 655 HG13 VAL 655 -17.702 8.557 2.039 446 HG21 VAL 655 HG21 VAL 655 -16.038 5.400 0.990 447 HG22 VAL 655 HG22 VAL 655 -17.453 4.944 1.930 448 HG23 VAL 655 HG23 VAL 655 -17.447 4.762 0.138 449 H GLY 656 H GLY 656 -20.384 5.055 -0.994 450 HA2 GLY 656 HA2 GLY 656 -21.751 5.647 -2.899 451 HA3 GLY 656 HA3 GLY 656 -20.541 6.838 -3.396 452 H ILE 657 H ILE 657 -19.153 3.905 -2.283 453 HA ILE 657 HA ILE 657 -18.197 3.260 -4.985 454 HB ILE 657 HB ILE 657 -17.745 1.858 -2.324 455 HG12 ILE 657 HG12 ILE 657 -16.856 3.836 -1.717 456 HG13 ILE 657 HG13 ILE 657 -15.459 2.994 -2.342 457 HG21 ILE 657 HG21 ILE 657 -15.780 0.891 -3.433 458 HG22 ILE 657 HG22 ILE 657 -17.201 0.587 -4.424 459 HG23 ILE 657 HG23 ILE 657 -16.092 1.870 -4.898 460 HD11 ILE 657 HD11 ILE 657 -15.840 4.314 -4.524 461 HD12 ILE 657 HD12 ILE 657 -17.001 5.292 -3.598 462 HD13 ILE 657 HD13 ILE 657 -15.314 5.239 -3.089 463 H GLU 658 H GLU 658 -18.803 1.183 -6.081 464 HA GLU 658 HA GLU 658 -21.456 0.397 -5.176 465 HB2 GLU 658 HB2 GLU 658 -21.289 0.869 -7.508 466 HB3 GLU 658 HB3 GLU 658 -19.974 -0.290 -7.705 467 HG2 GLU 658 HG2 GLU 658 -22.122 -1.127 -8.583 468 HG3 GLU 658 HG3 GLU 658 -21.443 -2.154 -7.333 469 H LYS 659 H LYS 659 -21.978 -1.706 -4.638 470 HA LYS 659 HA LYS 659 -20.242 -3.238 -3.046 471 HB2 LYS 659 HB2 LYS 659 -21.888 -5.005 -3.075 472 HB3 LYS 659 HB3 LYS 659 -22.615 -3.413 -2.890 473 HG2 LYS 659 HG2 LYS 659 -23.036 -3.555 -5.481 474 HG3 LYS 659 HG3 LYS 659 -22.694 -5.264 -5.291 475 HD2 LYS 659 HD2 LYS 659 -24.772 -5.641 -4.554 476 HD3 LYS 659 HD3 LYS 659 -24.574 -4.527 -3.212 477 HE2 LYS 659 HE2 LYS 659 -25.447 -3.765 -6.037 478 HE3 LYS 659 HE3 LYS 659 -26.519 -3.997 -4.643 479 HZ1 LYS 659 HZ1 LYS 659 -26.178 -1.724 -4.772 480 HZ2 LYS 659 HZ2 LYS 659 -24.615 -1.835 -5.180 481 HZ3 LYS 659 HZ3 LYS 659 -25.046 -2.112 -3.616 482 H SER 660 H SER 660 -20.885 -3.804 -6.560 483 HA SER 660 HA SER 660 -19.152 -6.059 -6.751 484 HB2 SER 660 HB2 SER 660 -19.160 -5.526 -9.185 485 HB3 SER 660 HB3 SER 660 -20.781 -5.565 -8.465 486 HG SER 660 HG SER 660 -20.596 -3.740 -9.746 487 H ASN 661 H ASN 661 -18.491 -2.567 -6.842 488 HA ASN 661 HA ASN 661 -15.696 -2.785 -7.662 489 HB2 ASN 661 HB2 ASN 661 -17.350 -0.569 -6.447 490 HB3 ASN 661 HB3 ASN 661 -15.617 -0.573 -6.266 491 HD21 ASN 661 HD21 ASN 661 -17.703 -1.547 -9.081 492 HD22 ASN 661 HD22 ASN 661 -16.975 -0.363 -10.158 493 H ILE 662 H ILE 662 -17.475 -2.648 -4.496 494 HA ILE 662 HA ILE 662 -15.083 -2.398 -2.934 495 HB ILE 662 HB ILE 662 -17.902 -3.389 -2.278 496 HG12 ILE 662 HG12 ILE 662 -16.645 -0.768 -1.402 497 HG13 ILE 662 HG13 ILE 662 -17.347 -0.938 -2.993 498 HG21 ILE 662 HG21 ILE 662 -17.292 -2.926 0.145 499 HG22 ILE 662 HG22 ILE 662 -16.518 -4.341 -0.559 500 HG23 ILE 662 HG23 ILE 662 -15.595 -2.831 -0.365 501 HD11 ILE 662 HD11 ILE 662 -18.964 0.066 -1.513 502 HD12 ILE 662 HD12 ILE 662 -19.534 -1.486 -2.108 503 HD13 ILE 662 HD13 ILE 662 -18.915 -1.346 -0.456 504 H GLU 663 H GLU 663 -17.026 -5.140 -4.024 505 HA GLU 663 HA GLU 663 -15.592 -7.139 -2.526 506 HB2 GLU 663 HB2 GLU 663 -17.506 -7.243 -4.891 507 HB3 GLU 663 HB3 GLU 663 -16.940 -8.687 -4.046 508 HG2 GLU 663 HG2 GLU 663 -18.205 -6.426 -2.451 509 HG3 GLU 663 HG3 GLU 663 -19.222 -7.500 -3.372 510 H LYS 664 H LYS 664 -15.466 -6.083 -5.994 511 HA LYS 664 HA LYS 664 -13.334 -7.900 -6.575 512 HB2 LYS 664 HB2 LYS 664 -13.124 -6.989 -8.660 513 HB3 LYS 664 HB3 LYS 664 -14.805 -6.733 -8.282 514 HG2 LYS 664 HG2 LYS 664 -14.255 -4.747 -9.299 515 HG3 LYS 664 HG3 LYS 664 -14.118 -4.332 -7.611 516 HD2 LYS 664 HD2 LYS 664 -12.325 -3.294 -8.819 517 HD3 LYS 664 HD3 LYS 664 -11.596 -4.539 -7.811 518 HE2 LYS 664 HE2 LYS 664 -11.666 -6.090 -9.789 519 HE3 LYS 664 HE3 LYS 664 -12.246 -4.726 -10.758 520 HZ1 LYS 664 HZ1 LYS 664 -9.861 -5.005 -10.991 521 HZ2 LYS 664 HZ2 LYS 664 -9.563 -4.889 -9.402 522 HZ3 LYS 664 HZ3 LYS 664 -10.140 -3.587 -10.211 523 H LEU 665 H LEU 665 -13.348 -4.501 -5.346 524 HA LEU 665 HA LEU 665 -10.510 -4.252 -5.600 525 HB2 LEU 665 HB2 LEU 665 -12.562 -2.714 -3.989 526 HB3 LEU 665 HB3 LEU 665 -10.846 -2.312 -3.951 527 HG LEU 665 HG LEU 665 -12.380 -2.472 -6.578 528 HD11 LEU 665 HD11 LEU 665 -12.663 -0.095 -6.549 529 HD12 LEU 665 HD12 LEU 665 -11.853 0.042 -4.968 530 HD13 LEU 665 HD13 LEU 665 -13.432 -0.765 -5.109 531 HD21 LEU 665 HD21 LEU 665 -9.766 -1.137 -5.793 532 HD22 LEU 665 HD22 LEU 665 -10.550 -1.008 -7.382 533 HD23 LEU 665 HD23 LEU 665 -9.943 -2.571 -6.820 534 H LEU 666 H LEU 666 -12.561 -5.119 -2.737 535 HA LEU 666 HA LEU 666 -10.500 -5.630 -0.890 536 HB2 LEU 666 HB2 LEU 666 -13.112 -7.063 -1.500 537 HB3 LEU 666 HB3 LEU 666 -12.074 -7.583 -0.181 538 HG LEU 666 HG LEU 666 -13.010 -4.691 -0.346 539 HD11 LEU 666 HD11 LEU 666 -14.869 -5.285 1.102 540 HD12 LEU 666 HD12 LEU 666 -14.402 -7.011 1.035 541 HD13 LEU 666 HD13 LEU 666 -15.006 -6.192 -0.413 542 HD21 LEU 666 HD21 LEU 666 -12.167 -6.499 1.967 543 HD22 LEU 666 HD22 LEU 666 -12.694 -4.812 2.092 544 HD23 LEU 666 HD23 LEU 666 -11.193 -5.196 1.245 545 H THR 667 H THR 667 -11.815 -7.790 -3.449 546 HA THR 667 HA THR 667 -10.025 -9.903 -2.986 547 HB THR 667 HB THR 667 -11.431 -9.105 -5.563 548 HG1 THR 667 HG1 THR 667 -12.950 -9.425 -4.079 549 HG21 THR 667 HG21 THR 667 -10.175 -11.733 -4.688 550 HG22 THR 667 HG22 THR 667 -9.678 -10.706 -6.050 551 HG23 THR 667 HG23 THR 667 -11.251 -11.515 -6.095 552 H ASP 668 H ASP 668 -9.607 -7.008 -5.037 553 HA ASP 668 HA ASP 668 -7.247 -7.816 -6.426 554 HB2 ASP 668 HB2 ASP 668 -9.124 -6.044 -6.822 555 HB3 ASP 668 HB3 ASP 668 -8.178 -4.992 -5.782 556 H MET 669 H MET 669 -7.950 -5.925 -3.503 557 HA MET 669 HA MET 669 -5.285 -5.278 -2.737 558 HB2 MET 669 HB2 MET 669 -7.863 -5.464 -1.120 559 HB3 MET 669 HB3 MET 669 -6.331 -4.798 -0.547 560 HG2 MET 669 HG2 MET 669 -6.559 -3.338 -2.770 561 HG3 MET 669 HG3 MET 669 -8.252 -3.636 -2.510 562 HE1 MET 669 HE1 MET 669 -7.691 0.013 -1.275 563 HE2 MET 669 HE2 MET 669 -6.586 -0.792 -2.405 564 HE3 MET 669 HE3 MET 669 -8.348 -1.030 -2.560 565 H ARG 670 H ARG 670 -7.461 -7.930 -1.498 566 HA ARG 670 HA ARG 670 -5.346 -8.983 0.165 567 HB2 ARG 670 HB2 ARG 670 -6.778 -10.931 0.554 568 HB3 ARG 670 HB3 ARG 670 -7.595 -9.407 0.867 569 HG2 ARG 670 HG2 ARG 670 -9.247 -9.912 -0.511 570 HG3 ARG 670 HG3 ARG 670 -8.126 -10.173 -1.846 571 HD2 ARG 670 HD2 ARG 670 -7.817 -12.517 -1.122 572 HD3 ARG 670 HD3 ARG 670 -8.977 -12.262 0.184 573 HE ARG 670 HE ARG 670 -9.680 -11.771 -2.675 574 HH11 ARG 670 HH11 ARG 670 -10.565 -13.714 0.247 575 HH12 ARG 670 HH12 ARG 670 -12.218 -13.622 -0.090 576 HH21 ARG 670 HH21 ARG 670 -12.033 -11.599 -3.015 577 HH22 ARG 670 HH22 ARG 670 -13.012 -12.617 -2.033 578 H LYS 671 H LYS 671 -6.181 -9.510 -3.224 579 HA LYS 671 HA LYS 671 -4.453 -11.819 -3.404 580 HB2 LYS 671 HB2 LYS 671 -6.326 -11.354 -4.964 581 HB3 LYS 671 HB3 LYS 671 -5.445 -9.953 -5.607 582 HG2 LYS 671 HG2 LYS 671 -3.615 -11.476 -6.332 583 HG3 LYS 671 HG3 LYS 671 -4.491 -12.857 -5.663 584 HD2 LYS 671 HD2 LYS 671 -5.469 -11.033 -7.910 585 HD3 LYS 671 HD3 LYS 671 -4.727 -12.611 -8.150 586 HE2 LYS 671 HE2 LYS 671 -7.355 -12.083 -6.690 587 HE3 LYS 671 HE3 LYS 671 -7.194 -12.686 -8.343 588 HZ1 LYS 671 HZ1 LYS 671 -6.101 -14.641 -7.475 589 HZ2 LYS 671 HZ2 LYS 671 -7.582 -14.469 -6.780 590 HZ3 LYS 671 HZ3 LYS 671 -6.224 -14.084 -5.933 591 H SER 672 H SER 672 -4.034 -8.297 -4.026 592 HA SER 672 HA SER 672 -1.294 -8.652 -4.922 593 HB2 SER 672 HB2 SER 672 -1.283 -6.124 -4.831 594 HB3 SER 672 HB3 SER 672 -2.488 -6.864 -5.897 595 HG SER 672 HG SER 672 -4.095 -6.415 -4.490 596 H GLY 673 H GLY 673 -2.786 -7.928 -1.779 597 HA2 GLY 673 HA2 GLY 673 -1.608 -8.661 0.198 598 HA3 GLY 673 HA3 GLY 673 -0.076 -8.171 -0.532 599 H ILE 674 H ILE 674 -2.660 -5.965 -1.103 600 HA ILE 674 HA ILE 674 -1.523 -3.832 0.517 601 HB ILE 674 HB ILE 674 -4.227 -4.123 -0.870 602 HG12 ILE 674 HG12 ILE 674 -1.671 -2.777 -1.820 603 HG13 ILE 674 HG13 ILE 674 -2.334 -4.276 -2.439 604 HG21 ILE 674 HG21 ILE 674 -4.291 -2.389 0.914 605 HG22 ILE 674 HG22 ILE 674 -2.895 -1.589 0.171 606 HG23 ILE 674 HG23 ILE 674 -4.457 -1.689 -0.680 607 HD11 ILE 674 HD11 ILE 674 -4.360 -3.080 -3.235 608 HD12 ILE 674 HD12 ILE 674 -3.595 -1.539 -2.764 609 HD13 ILE 674 HD13 ILE 674 -2.854 -2.558 -4.005 610 H ILE 675 H ILE 675 -4.156 -6.222 0.803 611 HA ILE 675 HA ILE 675 -4.274 -5.740 3.702 612 HB ILE 675 HB ILE 675 -6.631 -5.736 3.808 613 HG12 ILE 675 HG12 ILE 675 -6.608 -6.461 0.878 614 HG13 ILE 675 HG13 ILE 675 -7.227 -7.399 2.223 615 HG21 ILE 675 HG21 ILE 675 -5.460 -3.554 3.131 616 HG22 ILE 675 HG22 ILE 675 -6.050 -3.845 1.500 617 HG23 ILE 675 HG23 ILE 675 -7.184 -3.626 2.831 618 HD11 ILE 675 HD11 ILE 675 -9.012 -5.744 2.591 619 HD12 ILE 675 HD12 ILE 675 -8.450 -4.823 1.174 620 HD13 ILE 675 HD13 ILE 675 -9.066 -6.473 0.974 621 H TYR 676 H TYR 676 -5.597 -7.828 4.605 622 HA TYR 676 HA TYR 676 -5.287 -10.172 2.862 623 HB2 TYR 676 HB2 TYR 676 -4.314 -11.426 4.794 624 HB3 TYR 676 HB3 TYR 676 -3.246 -10.269 4.017 625 HD1 TYR 676 HD1 TYR 676 -5.403 -10.735 7.037 626 HD2 TYR 676 HD2 TYR 676 -2.025 -8.663 5.320 627 HE1 TYR 676 HE1 TYR 676 -4.648 -10.119 9.301 628 HE2 TYR 676 HE2 TYR 676 -1.265 -8.039 7.596 629 HH TYR 676 HH TYR 676 -2.731 -9.364 10.515 630 H GLU 677 H GLU 677 -6.498 -12.089 3.951 631 HA GLU 677 HA GLU 677 -9.051 -11.053 4.893 632 HB2 GLU 677 HB2 GLU 677 -8.648 -12.391 2.824 633 HB3 GLU 677 HB3 GLU 677 -8.199 -13.778 3.830 634 HG2 GLU 677 HG2 GLU 677 -10.396 -13.932 4.718 635 HG3 GLU 677 HG3 GLU 677 -10.851 -12.346 4.067 636 H ALA 678 H ALA 678 -7.186 -14.006 5.545 637 HA ALA 678 HA ALA 678 -6.624 -15.200 7.313 638 HB1 ALA 678 HB1 ALA 678 -5.989 -14.117 9.389 639 HB2 ALA 678 HB2 ALA 678 -5.414 -13.185 7.991 640 HB3 ALA 678 HB3 ALA 678 -6.835 -12.633 8.913 641 H LYS 679 H LYS 679 -9.698 -13.474 7.702 642 HA LYS 679 HA LYS 679 -10.696 -15.986 8.867 643 HB2 LYS 679 HB2 LYS 679 -11.362 -13.222 10.008 644 HB3 LYS 679 HB3 LYS 679 -12.206 -14.707 10.434 645 HG2 LYS 679 HG2 LYS 679 -9.958 -15.637 11.224 646 HG3 LYS 679 HG3 LYS 679 -9.312 -13.995 11.026 647 HD2 LYS 679 HD2 LYS 679 -11.105 -13.178 12.615 648 HD3 LYS 679 HD3 LYS 679 -11.581 -14.876 12.863 649 HE2 LYS 679 HE2 LYS 679 -9.150 -15.334 13.530 650 HE3 LYS 679 HE3 LYS 679 -8.888 -13.584 13.470 651 HZ1 LYS 679 HZ1 LYS 679 -9.367 -13.957 15.674 652 HZ2 LYS 679 HZ2 LYS 679 -10.616 -15.042 15.374 653 HZ3 LYS 679 HZ3 LYS 679 -10.704 -13.389 15.162 654 HA PRO 680 HA PRO 680 -13.581 -15.550 5.665 655 HB2 PRO 680 HB2 PRO 680 -15.940 -16.636 6.640 656 HB3 PRO 680 HB3 PRO 680 -14.504 -17.585 6.150 657 HG2 PRO 680 HG2 PRO 680 -15.280 -16.681 8.937 658 HG3 PRO 680 HG3 PRO 680 -14.742 -18.309 8.409 659 HD2 PRO 680 HD2 PRO 680 -13.016 -16.573 9.555 660 HD3 PRO 680 HD3 PRO 680 -12.489 -17.580 8.175 661 H GLU 681 H GLU 681 -14.819 -14.027 4.828 662 HA GLU 681 HA GLU 681 -15.810 -12.121 4.463 663 HB2 GLU 681 HB2 GLU 681 -17.834 -11.799 5.207 664 HB3 GLU 681 HB3 GLU 681 -17.642 -13.310 6.021 665 HG2 GLU 681 HG2 GLU 681 -17.877 -12.380 8.064 666 HG3 GLU 681 HG3 GLU 681 -16.777 -11.059 7.769 667 H CYS 682 H CYS 682 -13.473 -12.357 6.853 668 HA CYS 682 HA CYS 682 -13.665 -9.480 7.578 669 HB2 CYS 682 HB2 CYS 682 -13.261 -11.765 9.118 670 HB3 CYS 682 HB3 CYS 682 -11.620 -11.196 8.826 671 H TYR 683 H TYR 683 -12.001 -8.073 7.043 672 HA TYR 683 HA TYR 683 -9.600 -9.231 5.766 673 HB2 TYR 683 HB2 TYR 683 -11.187 -6.888 4.649 674 HB3 TYR 683 HB3 TYR 683 -9.634 -7.484 4.053 675 HD1 TYR 683 HD2 TYR 683 -13.266 -8.262 4.334 676 HD2 TYR 683 HD1 TYR 683 -9.470 -9.477 2.684 677 HE1 TYR 683 HE2 TYR 683 -14.402 -10.056 3.044 678 HE2 TYR 683 HE1 TYR 683 -10.614 -11.249 1.378 679 HH TYR 683 HH TYR 683 -12.731 -12.708 1.900 680 H LYS 684 H LYS 684 -7.682 -7.996 6.167 681 HA LYS 684 HA LYS 684 -8.060 -5.578 7.854 682 HB2 LYS 684 HB2 LYS 684 -7.926 -7.561 9.327 683 HB3 LYS 684 HB3 LYS 684 -6.403 -8.016 8.627 684 HG2 LYS 684 HG2 LYS 684 -6.448 -5.186 9.558 685 HG3 LYS 684 HG3 LYS 684 -6.844 -6.305 10.850 686 HD2 LYS 684 HD2 LYS 684 -4.780 -7.440 10.729 687 HD3 LYS 684 HD3 LYS 684 -4.537 -6.988 9.050 688 HE2 LYS 684 HE2 LYS 684 -4.199 -4.566 9.952 689 HE3 LYS 684 HE3 LYS 684 -3.906 -5.377 11.508 690 HZ1 LYS 684 HZ1 LYS 684 -1.809 -5.160 10.261 691 HZ2 LYS 684 HZ2 LYS 684 -2.466 -5.764 8.932 692 HZ3 LYS 684 HZ3 LYS 684 -2.241 -6.769 10.186 693 H LYS 685 H LYS 685 -6.307 -4.134 7.620 694 HA LYS 685 HA LYS 685 -5.039 -4.200 5.095 695 HB2 LYS 685 HB2 LYS 685 -5.523 -2.253 6.887 696 HB3 LYS 685 HB3 LYS 685 -3.867 -2.640 7.389 697 HG2 LYS 685 HG2 LYS 685 -3.275 -2.373 4.838 698 HG3 LYS 685 HG3 LYS 685 -4.902 -1.674 4.701 699 HD2 LYS 685 HD2 LYS 685 -4.101 -0.222 6.769 700 HD3 LYS 685 HD3 LYS 685 -2.473 -0.688 6.210 701 HE2 LYS 685 HE2 LYS 685 -2.900 0.279 4.027 702 HE3 LYS 685 HE3 LYS 685 -4.612 0.452 4.387 703 HZ1 LYS 685 HZ1 LYS 685 -4.200 2.076 6.033 704 HZ2 LYS 685 HZ2 LYS 685 -3.482 2.577 4.648 705 HZ3 LYS 685 HZ3 LYS 685 -2.560 1.951 5.874 706 H VAL 686 H VAL 686 -2.581 -4.242 4.679 707 HA VAL 686 HA VAL 686 -1.328 -6.416 6.118 708 HB VAL 686 HB VAL 686 -0.725 -5.888 3.839 709 HG11 VAL 686 HG11 VAL 686 -0.823 -3.401 3.960 710 HG12 VAL 686 HG12 VAL 686 0.687 -3.420 4.888 711 HG13 VAL 686 HG13 VAL 686 0.653 -4.033 3.209 712 HG21 VAL 686 HG21 VAL 686 1.620 -5.613 5.758 713 HG22 VAL 686 HG22 VAL 686 0.835 -7.133 5.276 714 HG23 VAL 686 HG23 VAL 686 1.692 -6.162 4.067 Start of MODEL 9 1 H1 GLY 600 H1 GLY 600 -0.679 1.678 8.229 2 H2 GLY 600 H2 GLY 600 -1.683 0.528 8.816 3 H3 GLY 600 H3 GLY 600 -0.090 0.567 9.295 4 HA2 GLY 600 HA2 GLY 600 -0.349 -1.201 7.730 5 HA3 GLY 600 HA3 GLY 600 -1.158 -0.068 6.639 6 H SER 601 H SER 601 1.056 -1.588 5.899 7 HA SER 601 HA SER 601 2.989 -1.575 4.830 8 HB2 SER 601 HB2 SER 601 2.443 1.376 4.410 9 HB3 SER 601 HB3 SER 601 3.535 0.354 3.460 10 HG SER 601 HG SER 601 1.574 0.522 2.433 11 H HIS 602 H HIS 602 3.001 -0.961 7.721 12 HA HIS 602 HA HIS 602 5.854 -0.144 7.983 13 HB2 HIS 602 HB2 HIS 602 4.116 1.499 8.883 14 HB3 HIS 602 HB3 HIS 602 3.663 0.265 10.055 15 HD1 HIS 602 HD1 HIS 602 6.539 2.663 9.204 16 HD2 HIS 602 HD2 HIS 602 5.336 -0.098 12.149 17 HE1 HIS 602 HE1 HIS 602 8.082 3.009 11.219 18 H MET 603 H MET 603 3.897 -2.789 7.875 19 HA MET 603 HA MET 603 5.527 -4.406 9.645 20 HB2 MET 603 HB2 MET 603 2.474 -4.221 9.798 21 HB3 MET 603 HB3 MET 603 3.390 -5.589 10.418 22 HG2 MET 603 HG2 MET 603 3.669 -2.719 11.376 23 HG3 MET 603 HG3 MET 603 2.743 -3.975 12.181 24 HE1 MET 603 HE1 MET 603 4.571 -6.590 12.147 25 HE2 MET 603 HE2 MET 603 5.433 -6.342 13.679 26 HE3 MET 603 HE3 MET 603 3.706 -5.937 13.562 27 H GLY 604 H GLY 604 5.265 -6.686 8.939 28 HA2 GLY 604 HA2 GLY 604 4.905 -8.383 7.455 29 HA3 GLY 604 HA3 GLY 604 3.637 -7.426 6.684 30 H GLU 605 H GLU 605 4.412 -5.626 5.161 31 HA GLU 605 HA GLU 605 7.061 -5.759 4.144 32 HB2 GLU 605 HB2 GLU 605 6.732 -6.675 2.004 33 HB3 GLU 605 HB3 GLU 605 6.008 -7.814 3.110 34 HG2 GLU 605 HG2 GLU 605 4.397 -7.804 1.496 35 HG3 GLU 605 HG3 GLU 605 3.742 -6.541 2.532 36 H SER 606 H SER 606 7.061 -4.303 2.008 37 HA SER 606 HA SER 606 4.815 -2.528 1.739 38 HB2 SER 606 HB2 SER 606 6.014 -0.430 2.158 39 HB3 SER 606 HB3 SER 606 5.956 -1.408 3.635 40 HG SER 606 HG SER 606 8.090 -1.474 1.792 41 H GLY 607 H GLY 607 4.938 -3.683 -0.254 42 HA2 GLY 607 HA2 GLY 607 7.058 -4.086 -1.895 43 HA3 GLY 607 HA3 GLY 607 5.378 -4.062 -2.411 44 H LYS 608 H LYS 608 6.923 -1.150 -1.342 45 HA LYS 608 HA LYS 608 6.559 0.927 -2.292 46 HB2 LYS 608 HB2 LYS 608 9.006 0.067 -2.242 47 HB3 LYS 608 HB3 LYS 608 8.906 0.059 -3.995 48 HG2 LYS 608 HG2 LYS 608 7.821 2.583 -2.988 49 HG3 LYS 608 HG3 LYS 608 9.318 2.253 -2.141 50 HD2 LYS 608 HD2 LYS 608 9.730 3.669 -4.034 51 HD3 LYS 608 HD3 LYS 608 10.519 2.105 -4.326 52 HE2 LYS 608 HE2 LYS 608 8.913 1.464 -5.948 53 HE3 LYS 608 HE3 LYS 608 7.699 2.565 -5.304 54 HZ1 LYS 608 HZ1 LYS 608 8.472 3.350 -7.361 55 HZ2 LYS 608 HZ2 LYS 608 10.051 3.546 -6.790 56 HZ3 LYS 608 HZ3 LYS 608 8.682 4.388 -6.237 57 H ILE 609 H ILE 609 4.480 0.365 -3.270 58 HA ILE 609 HA ILE 609 4.343 0.633 -6.199 59 HB ILE 609 HB ILE 609 2.440 0.464 -3.865 60 HG12 ILE 609 HG12 ILE 609 1.208 -1.050 -5.371 61 HG13 ILE 609 HG13 ILE 609 2.336 -0.705 -6.682 62 HG21 ILE 609 HG21 ILE 609 1.565 1.702 -6.511 63 HG22 ILE 609 HG22 ILE 609 0.497 1.179 -5.195 64 HG23 ILE 609 HG23 ILE 609 1.603 2.524 -4.933 65 HD11 ILE 609 HD11 ILE 609 4.133 -1.846 -5.497 66 HD12 ILE 609 HD12 ILE 609 3.114 -2.026 -4.043 67 HD13 ILE 609 HD13 ILE 609 2.711 -2.896 -5.538 68 H ASP 610 H ASP 610 3.550 2.752 -7.080 69 HA ASP 610 HA ASP 610 4.327 5.130 -5.478 70 HB2 ASP 610 HB2 ASP 610 4.671 4.788 -8.487 71 HB3 ASP 610 HB3 ASP 610 5.000 6.246 -7.563 72 H ILE 611 H ILE 611 3.233 7.088 -6.627 73 HA ILE 611 HA ILE 611 0.407 6.513 -7.313 74 HB ILE 611 HB ILE 611 2.059 9.067 -7.008 75 HG12 ILE 611 HG12 ILE 611 0.260 9.636 -5.326 76 HG13 ILE 611 HG13 ILE 611 -0.390 8.009 -5.508 77 HG21 ILE 611 HG21 ILE 611 -0.010 10.348 -7.481 78 HG22 ILE 611 HG22 ILE 611 0.558 9.456 -8.882 79 HG23 ILE 611 HG23 ILE 611 -0.827 8.834 -7.947 80 HD11 ILE 611 HD11 ILE 611 1.586 7.059 -4.457 81 HD12 ILE 611 HD12 ILE 611 2.443 8.622 -4.550 82 HD13 ILE 611 HD13 ILE 611 1.048 8.419 -3.471 83 H ASP 612 H ASP 612 3.446 7.675 -8.687 84 HA ASP 612 HA ASP 612 2.690 8.471 -11.165 85 HB2 ASP 612 HB2 ASP 612 5.320 7.219 -10.281 86 HB3 ASP 612 HB3 ASP 612 5.092 8.355 -11.624 87 H THR 613 H THR 613 3.836 5.275 -10.165 88 HA THR 613 HA THR 613 4.019 3.991 -12.655 89 HB THR 613 HB THR 613 4.843 3.349 -10.314 90 HG1 THR 613 HG1 THR 613 5.229 1.971 -11.978 91 HG21 THR 613 HG21 THR 613 3.644 1.969 -8.895 92 HG22 THR 613 HG22 THR 613 2.309 1.777 -10.040 93 HG23 THR 613 HG23 THR 613 2.573 3.344 -9.234 94 H ILE 614 H ILE 614 1.175 4.942 -10.945 95 HA ILE 614 HA ILE 614 -0.582 3.160 -12.570 96 HB ILE 614 HB ILE 614 -0.968 4.701 -9.978 97 HG12 ILE 614 HG12 ILE 614 -1.412 1.724 -10.388 98 HG13 ILE 614 HG13 ILE 614 0.213 2.326 -10.185 99 HG21 ILE 614 HG21 ILE 614 -3.259 3.755 -9.869 100 HG22 ILE 614 HG22 ILE 614 -3.068 4.915 -11.181 101 HG23 ILE 614 HG23 ILE 614 -3.086 3.167 -11.534 102 HD11 ILE 614 HD11 ILE 614 -0.406 3.412 -8.051 103 HD12 ILE 614 HD12 ILE 614 -2.014 2.664 -8.167 104 HD13 ILE 614 HD13 ILE 614 -0.558 1.649 -8.041 105 H MET 615 H MET 615 -0.113 6.590 -11.480 106 HA MET 615 HA MET 615 -2.180 7.656 -13.102 107 HB2 MET 615 HB2 MET 615 0.275 8.872 -11.870 108 HB3 MET 615 HB3 MET 615 -0.968 9.798 -12.735 109 HG2 MET 615 HG2 MET 615 -1.378 8.147 -10.220 110 HG3 MET 615 HG3 MET 615 -1.320 9.906 -10.326 111 HE1 MET 615 HE1 MET 615 -4.618 10.619 -12.455 112 HE2 MET 615 HE2 MET 615 -3.014 11.239 -12.009 113 HE3 MET 615 HE3 MET 615 -3.182 10.002 -13.282 114 H THR 616 H THR 616 1.182 6.791 -13.912 115 HA THR 616 HA THR 616 1.312 8.280 -16.274 116 HB THR 616 HB THR 616 3.241 7.157 -15.204 117 HG1 THR 616 HG1 THR 616 2.603 6.766 -17.907 118 HG21 THR 616 HG21 THR 616 2.158 4.906 -14.787 119 HG22 THR 616 HG22 THR 616 3.736 4.818 -15.583 120 HG23 THR 616 HG23 THR 616 2.254 4.583 -16.528 121 H GLY 617 H GLY 617 -0.821 5.669 -15.629 122 HA2 GLY 617 HA2 GLY 617 -1.653 5.652 -18.478 123 HA3 GLY 617 HA3 GLY 617 -1.237 4.113 -17.724 124 H LYS 618 H LYS 618 -2.648 6.037 -15.277 125 HA LYS 618 HA LYS 618 -5.397 5.133 -15.956 126 HB2 LYS 618 HB2 LYS 618 -3.776 4.754 -13.405 127 HB3 LYS 618 HB3 LYS 618 -5.490 4.798 -13.362 128 HG2 LYS 618 HG2 LYS 618 -5.187 2.511 -13.596 129 HG3 LYS 618 HG3 LYS 618 -5.346 2.966 -15.290 130 HD2 LYS 618 HD2 LYS 618 -2.668 3.188 -15.104 131 HD3 LYS 618 HD3 LYS 618 -2.889 2.125 -13.731 132 HE2 LYS 618 HE2 LYS 618 -3.853 1.623 -16.588 133 HE3 LYS 618 HE3 LYS 618 -2.362 0.972 -15.894 134 HZ1 LYS 618 HZ1 LYS 618 -4.133 -0.633 -15.817 135 HZ2 LYS 618 HZ2 LYS 618 -5.082 0.374 -14.925 136 HZ3 LYS 618 HZ3 LYS 618 -3.684 -0.227 -14.287 137 HA PRO 619 HA PRO 619 -6.610 9.189 -14.556 138 HB2 PRO 619 HB2 PRO 619 -9.189 8.786 -13.765 139 HB3 PRO 619 HB3 PRO 619 -8.693 8.683 -15.486 140 HG2 PRO 619 HG2 PRO 619 -9.033 6.404 -13.497 141 HG3 PRO 619 HG3 PRO 619 -9.704 6.519 -15.158 142 HD2 PRO 619 HD2 PRO 619 -7.401 5.177 -14.595 143 HD3 PRO 619 HD3 PRO 619 -7.590 6.072 -16.127 144 H LYS 620 H LYS 620 -7.144 10.367 -12.612 145 HA LYS 620 HA LYS 620 -5.895 9.363 -10.315 146 HB2 LYS 620 HB2 LYS 620 -6.548 11.305 -9.162 147 HB3 LYS 620 HB3 LYS 620 -6.128 11.757 -10.804 148 HG2 LYS 620 HG2 LYS 620 -8.468 12.081 -11.399 149 HG3 LYS 620 HG3 LYS 620 -9.012 11.354 -9.881 150 HD2 LYS 620 HD2 LYS 620 -9.248 13.746 -9.738 151 HD3 LYS 620 HD3 LYS 620 -8.037 13.178 -8.581 152 HE2 LYS 620 HE2 LYS 620 -6.229 13.866 -10.159 153 HE3 LYS 620 HE3 LYS 620 -7.456 14.460 -11.292 154 HZ1 LYS 620 HZ1 LYS 620 -8.153 16.030 -9.598 155 HZ2 LYS 620 HZ2 LYS 620 -6.555 16.227 -9.933 156 HZ3 LYS 620 HZ3 LYS 620 -7.016 15.465 -8.550 157 H SER 621 H SER 621 -9.344 9.076 -11.177 158 HA SER 621 HA SER 621 -10.546 8.443 -8.870 159 HB2 SER 621 HB2 SER 621 -10.882 6.794 -11.395 160 HB3 SER 621 HB3 SER 621 -12.116 7.277 -10.210 161 HG SER 621 HG SER 621 -12.244 8.635 -12.003 162 H ALA 622 H ALA 622 -8.074 6.408 -10.455 163 HA ALA 622 HA ALA 622 -8.482 3.934 -9.111 164 HB1 ALA 622 HB1 ALA 622 -6.070 3.588 -9.582 165 HB2 ALA 622 HB2 ALA 622 -6.957 4.171 -11.006 166 HB3 ALA 622 HB3 ALA 622 -5.924 5.286 -10.090 167 H ARG 623 H ARG 623 -6.017 6.414 -8.229 168 HA ARG 623 HA ARG 623 -5.744 5.518 -5.489 169 HB2 ARG 623 HB2 ARG 623 -4.627 7.753 -5.156 170 HB3 ARG 623 HB3 ARG 623 -3.925 6.810 -6.468 171 HG2 ARG 623 HG2 ARG 623 -4.917 8.197 -8.113 172 HG3 ARG 623 HG3 ARG 623 -6.031 8.913 -6.944 173 HD2 ARG 623 HD2 ARG 623 -3.139 9.441 -6.529 174 HD3 ARG 623 HD3 ARG 623 -3.994 10.261 -7.851 175 HE ARG 623 HE ARG 623 -5.744 10.949 -6.254 176 HH11 ARG 623 HH11 ARG 623 -2.437 10.633 -5.034 177 HH12 ARG 623 HH12 ARG 623 -2.781 11.363 -3.498 178 HH21 ARG 623 HH21 ARG 623 -6.271 11.707 -4.243 179 HH22 ARG 623 HH22 ARG 623 -5.040 12.124 -3.072 180 H GLU 624 H GLU 624 -7.923 7.853 -7.047 181 HA GLU 624 HA GLU 624 -8.758 9.051 -4.612 182 HB2 GLU 624 HB2 GLU 624 -9.373 9.192 -7.427 183 HB3 GLU 624 HB3 GLU 624 -10.885 9.199 -6.549 184 HG2 GLU 624 HG2 GLU 624 -9.899 11.424 -7.117 185 HG3 GLU 624 HG3 GLU 624 -10.276 11.153 -5.426 186 H LYS 625 H LYS 625 -9.726 6.065 -6.071 187 HA LYS 625 HA LYS 625 -11.715 5.488 -3.922 188 HB2 LYS 625 HB2 LYS 625 -10.405 3.771 -6.077 189 HB3 LYS 625 HB3 LYS 625 -11.509 3.142 -4.854 190 HG2 LYS 625 HG2 LYS 625 -13.334 4.474 -5.686 191 HG3 LYS 625 HG3 LYS 625 -12.294 5.326 -6.837 192 HD2 LYS 625 HD2 LYS 625 -12.545 2.299 -6.822 193 HD3 LYS 625 HD3 LYS 625 -13.667 3.358 -7.722 194 HE2 LYS 625 HE2 LYS 625 -11.734 4.344 -8.935 195 HE3 LYS 625 HE3 LYS 625 -10.648 3.238 -8.089 196 HZ1 LYS 625 HZ1 LYS 625 -11.853 1.396 -9.091 197 HZ2 LYS 625 HZ2 LYS 625 -11.237 2.389 -10.252 198 HZ3 LYS 625 HZ3 LYS 625 -12.844 2.435 -9.895 199 H MET 626 H MET 626 -8.557 4.186 -4.993 200 HA MET 626 HA MET 626 -8.379 2.223 -3.030 201 HB2 MET 626 HB2 MET 626 -6.590 3.411 -4.908 202 HB3 MET 626 HB3 MET 626 -6.015 2.045 -3.932 203 HG2 MET 626 HG2 MET 626 -7.770 0.690 -4.997 204 HG3 MET 626 HG3 MET 626 -8.377 2.112 -5.849 205 HE1 MET 626 HE1 MET 626 -4.694 0.492 -5.342 206 HE2 MET 626 HE2 MET 626 -5.792 -0.813 -5.870 207 HE3 MET 626 HE3 MET 626 -4.524 -0.225 -6.957 208 H MET 627 H MET 627 -7.089 5.479 -3.039 209 HA MET 627 HA MET 627 -5.413 5.111 -0.832 210 HB2 MET 627 HB2 MET 627 -6.743 7.615 -1.958 211 HB3 MET 627 HB3 MET 627 -5.564 7.667 -0.664 212 HG2 MET 627 HG2 MET 627 -4.976 6.478 -3.392 213 HG3 MET 627 HG3 MET 627 -4.625 8.144 -2.935 214 HE1 MET 627 HE1 MET 627 -2.128 7.841 -3.681 215 HE2 MET 627 HE2 MET 627 -1.069 6.530 -3.117 216 HE3 MET 627 HE3 MET 627 -2.465 6.156 -4.152 217 H LYS 628 H LYS 628 -8.832 5.591 -1.206 218 HA LYS 628 HA LYS 628 -9.294 6.098 1.681 219 HB2 LYS 628 HB2 LYS 628 -11.380 5.313 -0.391 220 HB3 LYS 628 HB3 LYS 628 -11.641 5.965 1.212 221 HG2 LYS 628 HG2 LYS 628 -10.689 8.131 0.559 222 HG3 LYS 628 HG3 LYS 628 -10.265 7.498 -1.045 223 HD2 LYS 628 HD2 LYS 628 -12.643 7.060 -1.522 224 HD3 LYS 628 HD3 LYS 628 -13.086 7.771 0.055 225 HE2 LYS 628 HE2 LYS 628 -12.200 9.931 -0.608 226 HE3 LYS 628 HE3 LYS 628 -11.501 9.239 -2.087 227 HZ1 LYS 628 HZ1 LYS 628 -13.680 8.812 -2.894 228 HZ2 LYS 628 HZ2 LYS 628 -13.534 10.407 -2.534 229 HZ3 LYS 628 HZ3 LYS 628 -14.384 9.419 -1.528 230 H ILE 629 H ILE 629 -9.464 3.453 -0.722 231 HA ILE 629 HA ILE 629 -10.795 1.529 0.419 232 HB ILE 629 HB ILE 629 -8.393 0.754 -0.960 233 HG12 ILE 629 HG12 ILE 629 -10.360 2.234 -1.812 234 HG13 ILE 629 HG13 ILE 629 -9.562 0.826 -2.678 235 HG21 ILE 629 HG21 ILE 629 -9.108 -1.138 0.414 236 HG22 ILE 629 HG22 ILE 629 -10.799 -0.896 -0.075 237 HG23 ILE 629 HG23 ILE 629 -9.578 -1.403 -1.267 238 HD11 ILE 629 HD11 ILE 629 -11.441 -0.383 -2.662 239 HD12 ILE 629 HD12 ILE 629 -12.303 0.992 -1.800 240 HD13 ILE 629 HD13 ILE 629 -11.618 1.205 -3.439 241 H ILE 630 H ILE 630 -7.357 1.911 0.580 242 HA ILE 630 HA ILE 630 -6.501 -0.035 2.467 243 HB ILE 630 HB ILE 630 -4.499 1.552 2.756 244 HG12 ILE 630 HG12 ILE 630 -4.820 2.967 0.243 245 HG13 ILE 630 HG13 ILE 630 -6.079 3.457 1.363 246 HG21 ILE 630 HG21 ILE 630 -4.584 -0.445 1.222 247 HG22 ILE 630 HG22 ILE 630 -5.167 0.607 -0.074 248 HG23 ILE 630 HG23 ILE 630 -3.541 0.849 0.595 249 HD11 ILE 630 HD11 ILE 630 -3.101 3.491 1.935 250 HD12 ILE 630 HD12 ILE 630 -4.124 4.890 1.547 251 HD13 ILE 630 HD13 ILE 630 -4.384 4.005 3.063 252 H GLU 631 H GLU 631 -7.615 3.280 2.863 253 HA GLU 631 HA GLU 631 -6.514 3.558 5.519 254 HB2 GLU 631 HB2 GLU 631 -6.848 5.382 3.834 255 HB3 GLU 631 HB3 GLU 631 -8.593 5.276 4.081 256 HG2 GLU 631 HG2 GLU 631 -6.707 5.591 6.426 257 HG3 GLU 631 HG3 GLU 631 -7.061 6.977 5.399 258 H ILE 632 H ILE 632 -9.771 2.848 4.097 259 HA ILE 632 HA ILE 632 -11.048 2.570 6.624 260 HB ILE 632 HB ILE 632 -11.794 0.701 4.375 261 HG12 ILE 632 HG12 ILE 632 -11.711 2.550 3.023 262 HG13 ILE 632 HG13 ILE 632 -13.382 2.431 3.506 263 HG21 ILE 632 HG21 ILE 632 -14.060 1.067 5.294 264 HG22 ILE 632 HG22 ILE 632 -12.934 0.500 6.530 265 HG23 ILE 632 HG23 ILE 632 -13.392 2.212 6.482 266 HD11 ILE 632 HD11 ILE 632 -13.018 4.291 5.148 267 HD12 ILE 632 HD12 ILE 632 -11.364 4.477 4.516 268 HD13 ILE 632 HD13 ILE 632 -12.737 4.743 3.446 269 H ILE 633 H ILE 633 -9.214 0.146 4.646 270 HA ILE 633 HA ILE 633 -9.880 -2.007 6.416 271 HB ILE 633 HB ILE 633 -7.395 -1.908 4.676 272 HG12 ILE 633 HG12 ILE 633 -10.295 -2.251 3.955 273 HG13 ILE 633 HG13 ILE 633 -8.999 -1.408 3.130 274 HG21 ILE 633 HG21 ILE 633 -9.106 -4.286 5.532 275 HG22 ILE 633 HG22 ILE 633 -7.528 -4.324 4.718 276 HG23 ILE 633 HG23 ILE 633 -7.653 -3.779 6.395 277 HD11 ILE 633 HD11 ILE 633 -9.353 -4.398 3.081 278 HD12 ILE 633 HD12 ILE 633 -9.737 -3.236 1.799 279 HD13 ILE 633 HD13 ILE 633 -8.060 -3.455 2.291 280 H ASP 634 H ASP 634 -7.149 0.345 6.367 281 HA ASP 634 HA ASP 634 -5.771 -0.906 8.506 282 HB2 ASP 634 HB2 ASP 634 -4.970 0.806 6.688 283 HB3 ASP 634 HB3 ASP 634 -5.504 2.036 7.822 284 H SER 635 H SER 635 -8.177 1.764 8.349 285 HA SER 635 HA SER 635 -7.825 2.577 11.088 286 HB2 SER 635 HB2 SER 635 -9.785 3.257 8.857 287 HB3 SER 635 HB3 SER 635 -9.931 3.949 10.477 288 HG SER 635 HG SER 635 -8.540 5.049 8.664 289 H LEU 636 H LEU 636 -9.719 0.163 9.493 290 HA LEU 636 HA LEU 636 -11.427 -0.314 11.852 291 HB2 LEU 636 HB2 LEU 636 -11.069 -1.497 9.116 292 HB3 LEU 636 HB3 LEU 636 -11.881 -2.431 10.356 293 HG LEU 636 HG LEU 636 -13.241 -1.012 8.703 294 HD11 LEU 636 HD11 LEU 636 -14.110 -2.194 10.759 295 HD12 LEU 636 HD12 LEU 636 -15.027 -0.722 10.388 296 HD13 LEU 636 HD13 LEU 636 -13.826 -0.723 11.696 297 HD21 LEU 636 HD21 LEU 636 -12.210 1.207 8.966 298 HD22 LEU 636 HD22 LEU 636 -12.738 1.257 10.655 299 HD23 LEU 636 HD23 LEU 636 -13.931 1.217 9.343 300 H ALA 637 H ALA 637 -8.671 -1.965 10.103 301 HA ALA 637 HA ALA 637 -8.405 -4.078 11.970 302 HB1 ALA 637 HB1 ALA 637 -6.235 -4.470 10.901 303 HB2 ALA 637 HB2 ALA 637 -7.492 -4.157 9.688 304 HB3 ALA 637 HB3 ALA 637 -6.317 -2.882 10.107 305 H VAL 638 H VAL 638 -7.242 -0.752 12.251 306 HA VAL 638 HA VAL 638 -5.272 -1.142 14.218 307 HB VAL 638 HB VAL 638 -6.004 0.998 13.002 308 HG11 VAL 638 HG11 VAL 638 -7.803 1.412 15.421 309 HG12 VAL 638 HG12 VAL 638 -7.609 2.453 13.996 310 HG13 VAL 638 HG13 VAL 638 -8.407 0.879 13.845 311 HG21 VAL 638 HG21 VAL 638 -4.194 0.975 14.646 312 HG22 VAL 638 HG22 VAL 638 -5.134 2.474 14.729 313 HG23 VAL 638 HG23 VAL 638 -5.362 1.217 15.963 314 H SER 639 H SER 639 -8.671 -1.787 14.458 315 HA SER 639 HA SER 639 -8.450 -2.172 17.402 316 HB2 SER 639 HB2 SER 639 -9.777 -0.166 16.807 317 HB3 SER 639 HB3 SER 639 -10.831 -1.175 15.791 318 HG SER 639 HG SER 639 -11.116 -2.456 17.759 319 H SER 640 H SER 640 -8.159 -4.125 14.882 320 HA SER 640 HA SER 640 -9.550 -6.268 16.271 321 HB2 SER 640 HB2 SER 640 -10.516 -5.346 13.529 322 HB3 SER 640 HB3 SER 640 -10.820 -6.981 14.151 323 HG SER 640 HG SER 640 -11.381 -4.885 15.887 324 H GLU 641 H GLU 641 -9.179 -8.437 15.053 325 HA GLU 641 HA GLU 641 -6.440 -8.804 14.379 326 HB2 GLU 641 HB2 GLU 641 -8.873 -10.431 13.528 327 HB3 GLU 641 HB3 GLU 641 -7.203 -10.997 13.520 328 HG2 GLU 641 HG2 GLU 641 -7.109 -10.909 15.966 329 HG3 GLU 641 HG3 GLU 641 -8.736 -10.211 16.041 330 H CYS 642 H CYS 642 -9.288 -7.960 12.487 331 HA CYS 642 HA CYS 642 -7.851 -7.068 10.183 332 HB2 CYS 642 HB2 CYS 642 -9.297 -8.668 8.720 333 HB3 CYS 642 HB3 CYS 642 -7.821 -9.278 9.457 334 H ALA 643 H ALA 643 -9.309 -5.958 8.839 335 HA ALA 643 HA ALA 643 -11.817 -4.898 10.061 336 HB1 ALA 643 HB1 ALA 643 -10.608 -4.553 7.272 337 HB2 ALA 643 HB2 ALA 643 -11.904 -3.567 7.976 338 HB3 ALA 643 HB3 ALA 643 -10.248 -3.497 8.640 339 H LYS 644 H LYS 644 -14.006 -5.337 9.160 340 HA LYS 644 HA LYS 644 -14.063 -7.986 7.813 341 HB2 LYS 644 HB2 LYS 644 -16.377 -6.299 8.854 342 HB3 LYS 644 HB3 LYS 644 -16.465 -7.901 8.138 343 HG2 LYS 644 HG2 LYS 644 -16.464 -8.544 10.341 344 HG3 LYS 644 HG3 LYS 644 -14.723 -8.553 10.037 345 HD2 LYS 644 HD2 LYS 644 -14.988 -7.426 12.093 346 HD3 LYS 644 HD3 LYS 644 -14.695 -6.158 10.911 347 HE2 LYS 644 HE2 LYS 644 -17.372 -6.180 10.783 348 HE3 LYS 644 HE3 LYS 644 -17.210 -6.816 12.435 349 HZ1 LYS 644 HZ1 LYS 644 -17.320 -4.318 12.107 350 HZ2 LYS 644 HZ2 LYS 644 -15.938 -4.402 11.342 351 HZ3 LYS 644 HZ3 LYS 644 -15.950 -4.802 12.969 352 H VAL 645 H VAL 645 -14.729 -8.213 5.718 353 HA VAL 645 HA VAL 645 -14.699 -6.071 3.890 354 HB VAL 645 HB VAL 645 -14.418 -8.576 3.492 355 HG11 VAL 645 HG11 VAL 645 -16.587 -9.348 4.463 356 HG12 VAL 645 HG12 VAL 645 -17.436 -8.570 3.111 357 HG13 VAL 645 HG13 VAL 645 -16.303 -9.895 2.803 358 HG21 VAL 645 HG21 VAL 645 -15.093 -8.362 1.171 359 HG22 VAL 645 HG22 VAL 645 -16.183 -7.013 1.575 360 HG23 VAL 645 HG23 VAL 645 -14.434 -6.835 1.799 361 H LYS 646 H LYS 646 -17.257 -7.288 5.948 362 HA LYS 646 HA LYS 646 -19.504 -6.006 4.751 363 HB2 LYS 646 HB2 LYS 646 -18.819 -6.845 7.604 364 HB3 LYS 646 HB3 LYS 646 -20.346 -6.062 7.176 365 HG2 LYS 646 HG2 LYS 646 -20.909 -7.839 5.611 366 HG3 LYS 646 HG3 LYS 646 -19.363 -8.660 5.908 367 HD2 LYS 646 HD2 LYS 646 -19.956 -9.233 8.140 368 HD3 LYS 646 HD3 LYS 646 -21.255 -8.037 8.190 369 HE2 LYS 646 HE2 LYS 646 -22.249 -10.235 8.036 370 HE3 LYS 646 HE3 LYS 646 -22.579 -9.307 6.569 371 HZ1 LYS 646 HZ1 LYS 646 -20.677 -10.611 5.520 372 HZ2 LYS 646 HZ2 LYS 646 -21.967 -11.537 5.970 373 HZ3 LYS 646 HZ3 LYS 646 -20.546 -11.496 6.791 374 H ASP 647 H ASP 647 -16.905 -4.780 7.088 375 HA ASP 647 HA ASP 647 -18.361 -2.400 7.607 376 HB2 ASP 647 HB2 ASP 647 -15.325 -2.814 7.644 377 HB3 ASP 647 HB3 ASP 647 -16.222 -1.524 8.433 378 H ILE 648 H ILE 648 -15.858 -3.430 5.376 379 HA ILE 648 HA ILE 648 -15.243 -0.840 4.366 380 HB ILE 648 HB ILE 648 -14.631 -3.574 3.114 381 HG12 ILE 648 HG12 ILE 648 -12.834 -2.082 5.072 382 HG13 ILE 648 HG13 ILE 648 -13.898 -3.322 5.592 383 HG21 ILE 648 HG21 ILE 648 -12.673 -2.417 2.099 384 HG22 ILE 648 HG22 ILE 648 -14.173 -1.632 1.624 385 HG23 ILE 648 HG23 ILE 648 -13.160 -0.901 2.883 386 HD11 ILE 648 HD11 ILE 648 -12.841 -5.036 4.281 387 HD12 ILE 648 HD12 ILE 648 -11.778 -3.863 3.505 388 HD13 ILE 648 HD13 ILE 648 -11.626 -4.184 5.238 389 H LEU 649 H LEU 649 -17.176 -3.550 3.111 390 HA LEU 649 HA LEU 649 -18.031 -2.339 0.674 391 HB2 LEU 649 HB2 LEU 649 -19.209 -4.426 2.524 392 HB3 LEU 649 HB3 LEU 649 -20.157 -3.825 1.177 393 HG LEU 649 HG LEU 649 -17.359 -4.924 0.728 394 HD11 LEU 649 HD11 LEU 649 -19.989 -6.472 0.634 395 HD12 LEU 649 HD12 LEU 649 -18.694 -6.689 1.829 396 HD13 LEU 649 HD13 LEU 649 -18.398 -7.080 0.128 397 HD21 LEU 649 HD21 LEU 649 -18.422 -3.588 -1.117 398 HD22 LEU 649 HD22 LEU 649 -19.790 -4.710 -1.114 399 HD23 LEU 649 HD23 LEU 649 -18.169 -5.278 -1.565 400 H LYS 650 H LYS 650 -19.394 -2.171 4.012 401 HA LYS 650 HA LYS 650 -21.692 -0.664 3.284 402 HB2 LYS 650 HB2 LYS 650 -20.313 -1.452 5.768 403 HB3 LYS 650 HB3 LYS 650 -20.854 0.168 5.902 404 HG2 LYS 650 HG2 LYS 650 -23.007 -1.496 4.770 405 HG3 LYS 650 HG3 LYS 650 -22.340 -2.205 6.230 406 HD2 LYS 650 HD2 LYS 650 -24.104 -0.876 6.967 407 HD3 LYS 650 HD3 LYS 650 -22.665 0.033 7.400 408 HE2 LYS 650 HE2 LYS 650 -24.438 0.558 4.957 409 HE3 LYS 650 HE3 LYS 650 -24.567 1.386 6.511 410 HZ1 LYS 650 HZ1 LYS 650 -23.322 2.800 5.233 411 HZ2 LYS 650 HZ2 LYS 650 -22.384 1.640 4.552 412 HZ3 LYS 650 HZ3 LYS 650 -22.147 2.072 6.114 413 H GLU 651 H GLU 651 -18.486 0.465 4.450 414 HA GLU 651 HA GLU 651 -19.418 3.218 4.161 415 HB2 GLU 651 HB2 GLU 651 -16.740 2.107 5.065 416 HB3 GLU 651 HB3 GLU 651 -17.248 3.801 5.152 417 HG2 GLU 651 HG2 GLU 651 -18.447 1.431 6.644 418 HG3 GLU 651 HG3 GLU 651 -17.622 2.819 7.321 419 H ALA 652 H ALA 652 -17.326 1.104 2.188 420 HA ALA 652 HA ALA 652 -16.519 3.226 0.422 421 HB1 ALA 652 HB1 ALA 652 -16.107 1.390 -1.166 422 HB2 ALA 652 HB2 ALA 652 -15.399 1.070 0.430 423 HB3 ALA 652 HB3 ALA 652 -16.905 0.263 -0.047 424 H GLN 653 H GLN 653 -19.468 1.109 0.598 425 HA GLN 653 HA GLN 653 -20.712 2.255 -1.711 426 HB2 GLN 653 HB2 GLN 653 -21.764 0.818 0.728 427 HB3 GLN 653 HB3 GLN 653 -22.870 1.506 -0.433 428 HG2 GLN 653 HG2 GLN 653 -20.626 -0.345 -1.341 429 HG3 GLN 653 HG3 GLN 653 -22.113 -0.985 -0.681 430 HE21 GLN 653 HE21 GLN 653 -22.953 1.871 -2.431 431 HE22 GLN 653 HE22 GLN 653 -23.349 1.055 -3.926 432 H GLN 654 H GLN 654 -20.818 3.296 1.782 433 HA GLN 654 HA GLN 654 -22.437 5.589 1.218 434 HB2 GLN 654 HB2 GLN 654 -20.219 5.468 3.308 435 HB3 GLN 654 HB3 GLN 654 -21.514 6.655 3.192 436 HG2 GLN 654 HG2 GLN 654 -22.964 4.308 3.230 437 HG3 GLN 654 HG3 GLN 654 -21.565 3.897 4.230 438 HE21 GLN 654 HE21 GLN 654 -21.134 5.210 6.234 439 HE22 GLN 654 HE22 GLN 654 -22.506 6.098 6.904 440 H VAL 655 H VAL 655 -18.861 5.270 1.056 441 HA VAL 655 HA VAL 655 -18.302 7.936 0.281 442 HB VAL 655 HB VAL 655 -16.892 5.279 0.004 443 HG11 VAL 655 HG11 VAL 655 -16.064 6.497 -1.940 444 HG12 VAL 655 HG12 VAL 655 -15.716 7.910 -0.915 445 HG13 VAL 655 HG13 VAL 655 -14.832 6.370 -0.691 446 HG21 VAL 655 HG21 VAL 655 -15.390 6.218 1.683 447 HG22 VAL 655 HG22 VAL 655 -16.185 7.805 1.562 448 HG23 VAL 655 HG23 VAL 655 -17.052 6.423 2.242 449 H GLY 656 H GLY 656 -19.346 5.180 -1.704 450 HA2 GLY 656 HA2 GLY 656 -20.921 6.099 -3.453 451 HA3 GLY 656 HA3 GLY 656 -19.568 7.072 -4.030 452 H ILE 657 H ILE 657 -18.621 3.891 -3.004 453 HA ILE 657 HA ILE 657 -18.051 3.213 -5.830 454 HB ILE 657 HB ILE 657 -16.970 2.052 -3.230 455 HG12 ILE 657 HG12 ILE 657 -15.489 3.982 -5.070 456 HG13 ILE 657 HG13 ILE 657 -16.385 4.561 -3.681 457 HG21 ILE 657 HG21 ILE 657 -16.003 1.796 -6.121 458 HG22 ILE 657 HG22 ILE 657 -15.150 1.146 -4.701 459 HG23 ILE 657 HG23 ILE 657 -16.723 0.515 -5.125 460 HD11 ILE 657 HD11 ILE 657 -15.057 3.234 -2.141 461 HD12 ILE 657 HD12 ILE 657 -14.051 2.651 -3.492 462 HD13 ILE 657 HD13 ILE 657 -14.085 4.376 -3.080 463 H GLU 658 H GLU 658 -18.360 0.705 -6.353 464 HA GLU 658 HA GLU 658 -21.061 -0.002 -5.302 465 HB2 GLU 658 HB2 GLU 658 -20.765 0.740 -7.715 466 HB3 GLU 658 HB3 GLU 658 -19.797 -0.695 -7.990 467 HG2 GLU 658 HG2 GLU 658 -22.622 -0.842 -6.857 468 HG3 GLU 658 HG3 GLU 658 -22.348 -0.640 -8.586 469 H LYS 659 H LYS 659 -21.288 -2.091 -4.537 470 HA LYS 659 HA LYS 659 -19.842 -3.884 -3.412 471 HB2 LYS 659 HB2 LYS 659 -21.527 -4.722 -5.845 472 HB3 LYS 659 HB3 LYS 659 -20.816 -5.836 -4.698 473 HG2 LYS 659 HG2 LYS 659 -22.795 -5.778 -3.807 474 HG3 LYS 659 HG3 LYS 659 -22.102 -4.380 -2.946 475 HD2 LYS 659 HD2 LYS 659 -24.171 -3.504 -3.656 476 HD3 LYS 659 HD3 LYS 659 -23.115 -3.029 -4.998 477 HE2 LYS 659 HE2 LYS 659 -23.790 -5.452 -5.919 478 HE3 LYS 659 HE3 LYS 659 -25.184 -5.243 -4.841 479 HZ1 LYS 659 HZ1 LYS 659 -25.567 -3.116 -6.062 480 HZ2 LYS 659 HZ2 LYS 659 -25.650 -4.443 -7.055 481 HZ3 LYS 659 HZ3 LYS 659 -24.292 -3.515 -7.050 482 H SER 660 H SER 660 -19.861 -4.112 -6.942 483 HA SER 660 HA SER 660 -18.024 -6.317 -6.814 484 HB2 SER 660 HB2 SER 660 -18.717 -6.548 -9.084 485 HB3 SER 660 HB3 SER 660 -20.105 -6.020 -8.129 486 HG SER 660 HG SER 660 -19.926 -3.910 -8.865 487 H ASN 661 H ASN 661 -17.710 -2.921 -7.188 488 HA ASN 661 HA ASN 661 -15.017 -2.886 -8.317 489 HB2 ASN 661 HB2 ASN 661 -16.693 -0.764 -6.989 490 HB3 ASN 661 HB3 ASN 661 -14.995 -0.599 -7.335 491 HD21 ASN 661 HD21 ASN 661 -18.233 -0.773 -8.777 492 HD22 ASN 661 HD22 ASN 661 -17.722 -0.376 -10.396 493 H ILE 662 H ILE 662 -16.525 -3.065 -5.017 494 HA ILE 662 HA ILE 662 -14.022 -2.310 -3.686 495 HB ILE 662 HB ILE 662 -16.730 -3.387 -2.786 496 HG12 ILE 662 HG12 ILE 662 -15.633 -0.736 -1.927 497 HG13 ILE 662 HG13 ILE 662 -16.112 -0.876 -3.595 498 HG21 ILE 662 HG21 ILE 662 -14.326 -2.775 -1.043 499 HG22 ILE 662 HG22 ILE 662 -15.995 -2.821 -0.433 500 HG23 ILE 662 HG23 ILE 662 -15.292 -4.266 -1.142 501 HD11 ILE 662 HD11 ILE 662 -18.002 -0.022 -2.400 502 HD12 ILE 662 HD12 ILE 662 -18.377 -1.671 -2.924 503 HD13 ILE 662 HD13 ILE 662 -17.945 -1.356 -1.238 504 H GLU 663 H GLU 663 -15.865 -5.100 -4.701 505 HA GLU 663 HA GLU 663 -14.350 -7.131 -3.323 506 HB2 GLU 663 HB2 GLU 663 -16.190 -7.251 -5.748 507 HB3 GLU 663 HB3 GLU 663 -15.560 -8.665 -4.883 508 HG2 GLU 663 HG2 GLU 663 -16.626 -7.864 -2.792 509 HG3 GLU 663 HG3 GLU 663 -17.251 -6.484 -3.566 510 H LYS 664 H LYS 664 -14.278 -5.930 -6.754 511 HA LYS 664 HA LYS 664 -12.030 -7.592 -7.328 512 HB2 LYS 664 HB2 LYS 664 -11.983 -6.716 -9.456 513 HB3 LYS 664 HB3 LYS 664 -13.674 -6.613 -8.990 514 HG2 LYS 664 HG2 LYS 664 -13.055 -4.131 -8.331 515 HG3 LYS 664 HG3 LYS 664 -11.626 -4.409 -9.334 516 HD2 LYS 664 HD2 LYS 664 -13.290 -5.139 -11.182 517 HD3 LYS 664 HD3 LYS 664 -14.566 -4.505 -10.119 518 HE2 LYS 664 HE2 LYS 664 -13.050 -2.341 -10.055 519 HE3 LYS 664 HE3 LYS 664 -12.287 -3.046 -11.491 520 HZ1 LYS 664 HZ1 LYS 664 -14.807 -3.194 -12.209 521 HZ2 LYS 664 HZ2 LYS 664 -13.942 -1.800 -12.407 522 HZ3 LYS 664 HZ3 LYS 664 -14.940 -1.935 -11.123 523 H LEU 665 H LEU 665 -12.222 -4.205 -6.098 524 HA LEU 665 HA LEU 665 -9.398 -3.775 -6.240 525 HB2 LEU 665 HB2 LEU 665 -11.641 -2.492 -4.656 526 HB3 LEU 665 HB3 LEU 665 -10.010 -2.295 -4.077 527 HG LEU 665 HG LEU 665 -10.404 -0.381 -5.284 528 HD11 LEU 665 HD11 LEU 665 -8.192 -1.478 -5.754 529 HD12 LEU 665 HD12 LEU 665 -8.743 -0.323 -6.989 530 HD13 LEU 665 HD13 LEU 665 -8.856 -2.049 -7.299 531 HD21 LEU 665 HD21 LEU 665 -11.063 -0.278 -7.676 532 HD22 LEU 665 HD22 LEU 665 -12.332 -0.870 -6.596 533 HD23 LEU 665 HD23 LEU 665 -11.430 -2.019 -7.616 534 H LEU 666 H LEU 666 -11.390 -4.998 -3.478 535 HA LEU 666 HA LEU 666 -9.301 -5.526 -1.672 536 HB2 LEU 666 HB2 LEU 666 -11.871 -7.018 -2.309 537 HB3 LEU 666 HB3 LEU 666 -10.831 -7.507 -0.985 538 HG LEU 666 HG LEU 666 -11.826 -4.640 -1.095 539 HD11 LEU 666 HD11 LEU 666 -13.764 -5.395 0.260 540 HD12 LEU 666 HD12 LEU 666 -13.281 -7.098 -0.049 541 HD13 LEU 666 HD13 LEU 666 -13.816 -6.067 -1.373 542 HD21 LEU 666 HD21 LEU 666 -10.098 -5.275 0.577 543 HD22 LEU 666 HD22 LEU 666 -11.177 -6.538 1.202 544 HD23 LEU 666 HD23 LEU 666 -11.637 -4.832 1.341 545 H THR 667 H THR 667 -10.556 -7.550 -4.334 546 HA THR 667 HA THR 667 -8.905 -9.792 -3.828 547 HB THR 667 HB THR 667 -10.090 -8.891 -6.490 548 HG1 THR 667 HG1 THR 667 -11.731 -9.102 -5.000 549 HG21 THR 667 HG21 THR 667 -9.075 -11.557 -5.417 550 HG22 THR 667 HG22 THR 667 -8.390 -10.622 -6.759 551 HG23 THR 667 HG23 THR 667 -9.993 -11.362 -6.934 552 H ASP 668 H ASP 668 -8.394 -6.959 -6.069 553 HA ASP 668 HA ASP 668 -5.811 -7.758 -6.996 554 HB2 ASP 668 HB2 ASP 668 -6.732 -6.012 -8.192 555 HB3 ASP 668 HB3 ASP 668 -7.309 -5.171 -6.755 556 H MET 669 H MET 669 -6.755 -5.574 -4.303 557 HA MET 669 HA MET 669 -4.197 -5.044 -3.369 558 HB2 MET 669 HB2 MET 669 -6.784 -5.308 -1.786 559 HB3 MET 669 HB3 MET 669 -5.286 -4.605 -1.171 560 HG2 MET 669 HG2 MET 669 -5.660 -3.224 -3.544 561 HG3 MET 669 HG3 MET 669 -7.301 -3.441 -2.963 562 HE1 MET 669 HE1 MET 669 -5.495 -0.692 -3.398 563 HE2 MET 669 HE2 MET 669 -7.261 -0.759 -3.177 564 HE3 MET 669 HE3 MET 669 -6.267 0.288 -2.132 565 H ARG 670 H ARG 670 -6.233 -7.884 -2.401 566 HA ARG 670 HA ARG 670 -4.081 -8.841 -0.714 567 HB2 ARG 670 HB2 ARG 670 -5.379 -10.563 -0.031 568 HB3 ARG 670 HB3 ARG 670 -6.477 -9.197 -0.136 569 HG2 ARG 670 HG2 ARG 670 -7.827 -10.186 -1.654 570 HG3 ARG 670 HG3 ARG 670 -6.517 -11.011 -2.490 571 HD2 ARG 670 HD2 ARG 670 -6.573 -12.863 -1.107 572 HD3 ARG 670 HD3 ARG 670 -6.957 -11.921 0.320 573 HE ARG 670 HE ARG 670 -9.098 -12.540 0.160 574 HH11 ARG 670 HH11 ARG 670 -7.950 -12.602 -3.179 575 HH12 ARG 670 HH12 ARG 670 -9.405 -13.349 -3.777 576 HH21 ARG 670 HH21 ARG 670 -10.810 -13.487 -0.487 577 HH22 ARG 670 HH22 ARG 670 -11.174 -13.869 -2.168 578 H LYS 671 H LYS 671 -4.801 -9.310 -4.097 579 HA LYS 671 HA LYS 671 -3.001 -11.628 -4.238 580 HB2 LYS 671 HB2 LYS 671 -4.398 -9.876 -6.303 581 HB3 LYS 671 HB3 LYS 671 -3.174 -11.066 -6.757 582 HG2 LYS 671 HG2 LYS 671 -4.495 -12.882 -5.698 583 HG3 LYS 671 HG3 LYS 671 -5.719 -11.718 -5.199 584 HD2 LYS 671 HD2 LYS 671 -6.537 -12.812 -7.154 585 HD3 LYS 671 HD3 LYS 671 -6.110 -11.156 -7.625 586 HE2 LYS 671 HE2 LYS 671 -3.956 -11.971 -8.547 587 HE3 LYS 671 HE3 LYS 671 -4.336 -13.615 -8.013 588 HZ1 LYS 671 HZ1 LYS 671 -6.215 -13.602 -9.521 589 HZ2 LYS 671 HZ2 LYS 671 -4.819 -13.305 -10.338 590 HZ3 LYS 671 HZ3 LYS 671 -5.858 -12.071 -10.016 591 H SER 672 H SER 672 -2.866 -8.134 -4.781 592 HA SER 672 HA SER 672 -0.175 -8.093 -5.801 593 HB2 SER 672 HB2 SER 672 -2.156 -5.923 -4.970 594 HB3 SER 672 HB3 SER 672 -0.620 -5.633 -5.813 595 HG SER 672 HG SER 672 -2.905 -6.070 -7.035 596 H GLY 673 H GLY 673 -1.596 -7.940 -2.578 597 HA2 GLY 673 HA2 GLY 673 -0.203 -8.718 -0.798 598 HA3 GLY 673 HA3 GLY 673 1.193 -7.916 -1.522 599 H ILE 674 H ILE 674 -1.453 -5.884 -1.745 600 HA ILE 674 HA ILE 674 -0.393 -3.931 0.092 601 HB ILE 674 HB ILE 674 -3.109 -4.099 -1.303 602 HG12 ILE 674 HG12 ILE 674 -0.529 -2.797 -2.253 603 HG13 ILE 674 HG13 ILE 674 -1.313 -4.204 -2.956 604 HG21 ILE 674 HG21 ILE 674 -1.694 -1.680 -0.111 605 HG22 ILE 674 HG22 ILE 674 -3.252 -1.663 -0.969 606 HG23 ILE 674 HG23 ILE 674 -3.129 -2.490 0.564 607 HD11 ILE 674 HD11 ILE 674 -1.810 -2.372 -4.372 608 HD12 ILE 674 HD12 ILE 674 -3.307 -2.799 -3.523 609 HD13 ILE 674 HD13 ILE 674 -2.369 -1.366 -3.029 610 H ILE 675 H ILE 675 -3.036 -6.367 0.179 611 HA ILE 675 HA ILE 675 -3.240 -5.953 3.118 612 HB ILE 675 HB ILE 675 -5.588 -5.977 3.129 613 HG12 ILE 675 HG12 ILE 675 -5.439 -6.477 0.152 614 HG13 ILE 675 HG13 ILE 675 -6.072 -7.545 1.397 615 HG21 ILE 675 HG21 ILE 675 -4.235 -3.823 2.412 616 HG22 ILE 675 HG22 ILE 675 -5.112 -3.947 0.930 617 HG23 ILE 675 HG23 ILE 675 -5.961 -3.773 2.490 618 HD11 ILE 675 HD11 ILE 675 -7.318 -4.924 0.505 619 HD12 ILE 675 HD12 ILE 675 -7.897 -6.565 0.174 620 HD13 ILE 675 HD13 ILE 675 -7.904 -5.947 1.840 621 H TYR 676 H TYR 676 -4.427 -7.821 4.098 622 HA TYR 676 HA TYR 676 -3.932 -10.440 2.728 623 HB2 TYR 676 HB2 TYR 676 -4.350 -9.767 5.673 624 HB3 TYR 676 HB3 TYR 676 -3.953 -11.351 5.021 625 HD1 TYR 676 HD1 TYR 676 -1.586 -10.039 3.181 626 HD2 TYR 676 HD2 TYR 676 -2.705 -10.011 7.355 627 HE1 TYR 676 HE1 TYR 676 0.771 -9.819 3.815 628 HE2 TYR 676 HE2 TYR 676 -0.341 -9.798 8.005 629 HH TYR 676 HH TYR 676 2.310 -9.848 5.573 630 H GLU 677 H GLU 677 -5.751 -12.097 3.259 631 HA GLU 677 HA GLU 677 -8.201 -10.960 4.335 632 HB2 GLU 677 HB2 GLU 677 -8.510 -11.807 2.014 633 HB3 GLU 677 HB3 GLU 677 -7.919 -13.411 2.522 634 HG2 GLU 677 HG2 GLU 677 -9.716 -13.653 4.090 635 HG3 GLU 677 HG3 GLU 677 -10.082 -11.929 3.971 636 H ALA 678 H ALA 678 -7.646 -11.272 6.471 637 HA ALA 678 HA ALA 678 -5.663 -13.297 7.220 638 HB1 ALA 678 HB1 ALA 678 -5.715 -11.027 8.256 639 HB2 ALA 678 HB2 ALA 678 -7.325 -11.398 8.926 640 HB3 ALA 678 HB3 ALA 678 -5.911 -12.321 9.459 641 H LYS 679 H LYS 679 -9.170 -12.888 7.320 642 HA LYS 679 HA LYS 679 -9.521 -15.681 8.024 643 HB2 LYS 679 HB2 LYS 679 -10.523 -13.344 9.723 644 HB3 LYS 679 HB3 LYS 679 -11.485 -14.803 9.636 645 HG2 LYS 679 HG2 LYS 679 -9.530 -16.115 10.484 646 HG3 LYS 679 HG3 LYS 679 -8.604 -14.603 10.598 647 HD2 LYS 679 HD2 LYS 679 -10.359 -13.691 12.146 648 HD3 LYS 679 HD3 LYS 679 -11.139 -15.292 12.141 649 HE2 LYS 679 HE2 LYS 679 -9.016 -16.299 13.003 650 HE3 LYS 679 HE3 LYS 679 -8.258 -14.698 12.944 651 HZ1 LYS 679 HZ1 LYS 679 -10.061 -13.968 14.511 652 HZ2 LYS 679 HZ2 LYS 679 -8.880 -14.763 15.095 653 HZ3 LYS 679 HZ3 LYS 679 -10.333 -15.588 14.833 654 HA PRO 680 HA PRO 680 -12.659 -15.290 4.910 655 HB2 PRO 680 HB2 PRO 680 -14.982 -16.344 6.055 656 HB3 PRO 680 HB3 PRO 680 -13.652 -17.311 5.348 657 HG2 PRO 680 HG2 PRO 680 -14.091 -16.575 8.257 658 HG3 PRO 680 HG3 PRO 680 -13.678 -18.180 7.570 659 HD2 PRO 680 HD2 PRO 680 -11.752 -16.650 8.632 660 HD3 PRO 680 HD3 PRO 680 -11.435 -17.471 7.083 661 H GLU 681 H GLU 681 -13.685 -13.556 4.232 662 HA GLU 681 HA GLU 681 -14.862 -11.640 4.128 663 HB2 GLU 681 HB2 GLU 681 -16.180 -12.628 6.692 664 HB3 GLU 681 HB3 GLU 681 -16.477 -11.035 6.060 665 HG2 GLU 681 HG2 GLU 681 -17.096 -12.212 3.832 666 HG3 GLU 681 HG3 GLU 681 -17.272 -13.655 4.849 667 H CYS 682 H CYS 682 -12.203 -12.050 5.981 668 HA CYS 682 HA CYS 682 -12.452 -9.391 7.298 669 HB2 CYS 682 HB2 CYS 682 -12.929 -11.490 8.638 670 HB3 CYS 682 HB3 CYS 682 -11.210 -11.832 8.492 671 H TYR 683 H TYR 683 -11.091 -8.091 6.320 672 HA TYR 683 HA TYR 683 -8.594 -9.150 5.129 673 HB2 TYR 683 HB2 TYR 683 -10.235 -6.688 4.445 674 HB3 TYR 683 HB3 TYR 683 -8.631 -7.020 3.803 675 HD1 TYR 683 HD1 TYR 683 -12.117 -8.400 3.943 676 HD2 TYR 683 HD2 TYR 683 -8.280 -8.471 1.974 677 HE1 TYR 683 HE1 TYR 683 -13.034 -9.919 2.191 678 HE2 TYR 683 HE2 TYR 683 -9.219 -9.907 0.193 679 HH TYR 683 HH TYR 683 -11.318 -11.806 0.556 680 H LYS 684 H LYS 684 -6.647 -8.024 5.453 681 HA LYS 684 HA LYS 684 -6.744 -5.913 7.561 682 HB2 LYS 684 HB2 LYS 684 -6.227 -8.131 8.598 683 HB3 LYS 684 HB3 LYS 684 -4.765 -8.230 7.622 684 HG2 LYS 684 HG2 LYS 684 -5.074 -5.630 8.978 685 HG3 LYS 684 HG3 LYS 684 -5.141 -6.952 10.125 686 HD2 LYS 684 HD2 LYS 684 -2.920 -7.731 9.470 687 HD3 LYS 684 HD3 LYS 684 -2.933 -6.713 8.024 688 HE2 LYS 684 HE2 LYS 684 -3.135 -4.705 9.659 689 HE3 LYS 684 HE3 LYS 684 -2.651 -5.846 10.923 690 HZ1 LYS 684 HZ1 LYS 684 -1.110 -4.973 8.523 691 HZ2 LYS 684 HZ2 LYS 684 -0.634 -6.250 9.449 692 HZ3 LYS 684 HZ3 LYS 684 -0.724 -4.723 10.064 693 H LYS 685 H LYS 685 -5.635 -4.139 6.947 694 HA LYS 685 HA LYS 685 -4.202 -4.035 4.504 695 HB2 LYS 685 HB2 LYS 685 -5.272 -2.023 5.472 696 HB3 LYS 685 HB3 LYS 685 -4.346 -2.213 6.963 697 HG2 LYS 685 HG2 LYS 685 -3.401 -0.407 5.600 698 HG3 LYS 685 HG3 LYS 685 -2.255 -1.731 5.764 699 HD2 LYS 685 HD2 LYS 685 -3.137 -2.566 3.503 700 HD3 LYS 685 HD3 LYS 685 -4.003 -1.034 3.373 701 HE2 LYS 685 HE2 LYS 685 -2.000 -0.813 2.160 702 HE3 LYS 685 HE3 LYS 685 -1.732 0.007 3.700 703 HZ1 LYS 685 HZ1 LYS 685 -0.794 -2.688 2.900 704 HZ2 LYS 685 HZ2 LYS 685 -0.595 -2.146 4.428 705 HZ3 LYS 685 HZ3 LYS 685 0.180 -1.358 3.216 706 H VAL 686 H VAL 686 -1.996 -4.698 4.137 707 HA VAL 686 HA VAL 686 -0.687 -5.971 6.314 708 HB VAL 686 HB VAL 686 -0.280 -6.408 3.840 709 HG11 VAL 686 HG11 VAL 686 1.785 -4.166 4.112 710 HG12 VAL 686 HG12 VAL 686 1.686 -5.351 2.802 711 HG13 VAL 686 HG13 VAL 686 0.414 -4.175 2.994 712 HG21 VAL 686 HG21 VAL 686 0.973 -7.327 5.816 713 HG22 VAL 686 HG22 VAL 686 1.912 -7.265 4.305 714 HG23 VAL 686 HG23 VAL 686 2.170 -6.054 5.582 Start of MODEL 10 1 H1 GLY 600 H1 GLY 600 -8.970 8.922 1.482 2 H2 GLY 600 H2 GLY 600 -8.659 9.768 0.084 3 H3 GLY 600 H3 GLY 600 -7.795 8.403 0.464 4 HA2 GLY 600 HA2 GLY 600 -6.417 10.248 0.940 5 HA3 GLY 600 HA3 GLY 600 -7.731 10.948 1.925 6 H SER 601 H SER 601 -4.946 10.095 2.814 7 HA SER 601 HA SER 601 -5.772 8.099 4.814 8 HB2 SER 601 HB2 SER 601 -3.332 7.433 4.791 9 HB3 SER 601 HB3 SER 601 -4.223 7.043 3.313 10 HG SER 601 HG SER 601 -2.274 9.055 3.719 11 H HIS 602 H HIS 602 -4.915 8.413 6.910 12 HA HIS 602 HA HIS 602 -4.560 11.292 7.476 13 HB2 HIS 602 HB2 HIS 602 -5.243 10.900 9.595 14 HB3 HIS 602 HB3 HIS 602 -6.123 9.660 8.723 15 HD1 HIS 602 HD1 HIS 602 -2.955 10.037 10.856 16 HD2 HIS 602 HD2 HIS 602 -5.806 7.179 9.679 17 HE1 HIS 602 HE1 HIS 602 -2.619 7.979 12.394 18 H MET 603 H MET 603 -2.340 9.190 6.495 19 HA MET 603 HA MET 603 -0.171 10.154 8.292 20 HB2 MET 603 HB2 MET 603 -0.361 7.428 6.936 21 HB3 MET 603 HB3 MET 603 0.939 7.997 7.988 22 HG2 MET 603 HG2 MET 603 -0.678 8.103 9.884 23 HG3 MET 603 HG3 MET 603 -1.929 7.447 8.814 24 HE1 MET 603 HE1 MET 603 -1.611 5.879 11.376 25 HE2 MET 603 HE2 MET 603 -2.577 5.363 9.972 26 HE3 MET 603 HE3 MET 603 -1.466 4.217 10.756 27 H GLY 604 H GLY 604 1.947 10.054 7.221 28 HA2 GLY 604 HA2 GLY 604 1.955 10.961 4.419 29 HA3 GLY 604 HA3 GLY 604 3.308 10.973 5.567 30 H GLU 605 H GLU 605 4.393 9.990 3.543 31 HA GLU 605 HA GLU 605 4.204 7.065 3.547 32 HB2 GLU 605 HB2 GLU 605 4.039 7.061 1.077 33 HB3 GLU 605 HB3 GLU 605 2.611 7.755 1.849 34 HG2 GLU 605 HG2 GLU 605 3.443 10.055 1.336 35 HG3 GLU 605 HG3 GLU 605 4.899 9.362 0.608 36 H SER 606 H SER 606 6.023 6.170 2.072 37 HA SER 606 HA SER 606 8.197 7.765 1.319 38 HB2 SER 606 HB2 SER 606 8.496 7.861 3.846 39 HB3 SER 606 HB3 SER 606 8.695 6.101 3.835 40 HG SER 606 HG SER 606 10.634 7.523 3.722 41 H GLY 607 H GLY 607 10.156 5.989 1.282 42 HA2 GLY 607 HA2 GLY 607 11.051 4.085 0.370 43 HA3 GLY 607 HA3 GLY 607 9.586 3.243 0.900 44 H LYS 608 H LYS 608 8.121 2.588 -0.648 45 HA LYS 608 HA LYS 608 8.277 3.784 -3.266 46 HB2 LYS 608 HB2 LYS 608 10.015 1.775 -2.942 47 HB3 LYS 608 HB3 LYS 608 8.604 0.795 -3.307 48 HG2 LYS 608 HG2 LYS 608 9.905 1.187 -5.302 49 HG3 LYS 608 HG3 LYS 608 8.370 2.021 -5.497 50 HD2 LYS 608 HD2 LYS 608 10.837 3.484 -4.462 51 HD3 LYS 608 HD3 LYS 608 10.613 3.199 -6.188 52 HE2 LYS 608 HE2 LYS 608 9.070 4.808 -6.421 53 HE3 LYS 608 HE3 LYS 608 8.147 4.225 -5.063 54 HZ1 LYS 608 HZ1 LYS 608 10.401 6.125 -4.896 55 HZ2 LYS 608 HZ2 LYS 608 9.644 5.433 -3.578 56 HZ3 LYS 608 HZ3 LYS 608 8.786 6.388 -4.577 57 H ILE 609 H ILE 609 6.232 3.701 -1.305 58 HA ILE 609 HA ILE 609 4.039 2.353 -2.840 59 HB ILE 609 HB ILE 609 4.461 3.137 0.042 60 HG12 ILE 609 HG12 ILE 609 3.467 0.969 0.485 61 HG13 ILE 609 HG13 ILE 609 2.994 0.768 -1.202 62 HG21 ILE 609 HG21 ILE 609 2.033 2.972 0.542 63 HG22 ILE 609 HG22 ILE 609 2.431 4.395 -0.416 64 HG23 ILE 609 HG23 ILE 609 1.690 2.998 -1.207 65 HD11 ILE 609 HD11 ILE 609 5.905 0.965 -0.304 66 HD12 ILE 609 HD12 ILE 609 5.020 -0.566 -0.494 67 HD13 ILE 609 HD13 ILE 609 5.288 0.462 -1.896 68 H ASP 610 H ASP 610 5.666 5.273 -2.572 69 HA ASP 610 HA ASP 610 3.887 7.134 -1.901 70 HB2 ASP 610 HB2 ASP 610 5.422 8.621 -3.504 71 HB3 ASP 610 HB3 ASP 610 5.885 7.948 -1.948 72 H ILE 611 H ILE 611 3.073 8.939 -2.960 73 HA ILE 611 HA ILE 611 0.931 7.994 -4.597 74 HB ILE 611 HB ILE 611 1.903 10.865 -4.074 75 HG12 ILE 611 HG12 ILE 611 1.084 10.184 -2.036 76 HG13 ILE 611 HG13 ILE 611 -0.300 10.980 -2.724 77 HG21 ILE 611 HG21 ILE 611 -0.372 11.635 -4.863 78 HG22 ILE 611 HG22 ILE 611 0.716 11.069 -6.122 79 HG23 ILE 611 HG23 ILE 611 -0.578 10.002 -5.556 80 HD11 ILE 611 HD11 ILE 611 -1.022 8.944 -1.676 81 HD12 ILE 611 HD12 ILE 611 -1.168 8.717 -3.443 82 HD13 ILE 611 HD13 ILE 611 0.181 7.983 -2.542 83 H ASP 612 H ASP 612 3.917 9.371 -5.286 84 HA ASP 612 HA ASP 612 3.573 10.252 -8.042 85 HB2 ASP 612 HB2 ASP 612 5.367 11.221 -6.704 86 HB3 ASP 612 HB3 ASP 612 6.118 9.632 -6.493 87 H THR 613 H THR 613 5.096 7.476 -6.438 88 HA THR 613 HA THR 613 5.959 6.133 -8.720 89 HB THR 613 HB THR 613 6.354 5.929 -6.098 90 HG1 THR 613 HG1 THR 613 6.614 3.855 -8.026 91 HG21 THR 613 HG21 THR 613 4.131 4.629 -5.779 92 HG22 THR 613 HG22 THR 613 5.605 4.348 -4.873 93 HG23 THR 613 HG23 THR 613 5.151 3.263 -6.208 94 H ILE 614 H ILE 614 2.808 6.414 -7.531 95 HA ILE 614 HA ILE 614 1.749 4.127 -9.096 96 HB ILE 614 HB ILE 614 0.440 6.122 -7.193 97 HG12 ILE 614 HG12 ILE 614 0.573 3.144 -6.714 98 HG13 ILE 614 HG13 ILE 614 2.019 4.081 -6.397 99 HG21 ILE 614 HG21 ILE 614 -1.547 4.543 -7.344 100 HG22 ILE 614 HG22 ILE 614 -1.248 5.480 -8.818 101 HG23 ILE 614 HG23 ILE 614 -0.759 3.773 -8.720 102 HD11 ILE 614 HD11 ILE 614 0.685 3.823 -4.393 103 HD12 ILE 614 HD12 ILE 614 0.895 5.528 -4.846 104 HD13 ILE 614 HD13 ILE 614 -0.658 4.714 -5.145 105 H MET 615 H MET 615 1.171 7.719 -8.754 106 HA MET 615 HA MET 615 -0.552 7.631 -11.018 107 HB2 MET 615 HB2 MET 615 -0.756 10.034 -10.720 108 HB3 MET 615 HB3 MET 615 -0.761 9.231 -9.157 109 HG2 MET 615 HG2 MET 615 0.640 11.006 -8.716 110 HG3 MET 615 HG3 MET 615 1.784 9.740 -9.108 111 HE1 MET 615 HE1 MET 615 -0.346 12.102 -11.600 112 HE2 MET 615 HE2 MET 615 0.158 13.109 -10.216 113 HE3 MET 615 HE3 MET 615 0.869 13.376 -11.823 114 H THR 616 H THR 616 2.920 7.963 -10.814 115 HA THR 616 HA THR 616 3.355 9.243 -13.301 116 HB THR 616 HB THR 616 4.935 8.920 -11.371 117 HG1 THR 616 HG1 THR 616 6.616 9.118 -12.604 118 HG21 THR 616 HG21 THR 616 6.326 6.961 -11.221 119 HG22 THR 616 HG22 THR 616 5.566 6.225 -12.649 120 HG23 THR 616 HG23 THR 616 4.646 6.409 -11.143 121 H GLY 617 H GLY 617 2.245 6.013 -12.578 122 HA2 GLY 617 HA2 GLY 617 2.387 5.297 -15.482 123 HA3 GLY 617 HA3 GLY 617 2.893 4.163 -14.234 124 H LYS 618 H LYS 618 0.279 5.765 -12.854 125 HA LYS 618 HA LYS 618 -1.756 3.965 -14.063 126 HB2 LYS 618 HB2 LYS 618 -0.927 4.291 -11.151 127 HB3 LYS 618 HB3 LYS 618 -2.526 3.759 -11.567 128 HG2 LYS 618 HG2 LYS 618 -1.588 1.841 -12.849 129 HG3 LYS 618 HG3 LYS 618 0.056 2.392 -12.484 130 HD2 LYS 618 HD2 LYS 618 -0.294 2.018 -10.095 131 HD3 LYS 618 HD3 LYS 618 -1.984 1.532 -10.392 132 HE2 LYS 618 HE2 LYS 618 -1.170 -0.344 -11.815 133 HE3 LYS 618 HE3 LYS 618 0.501 0.149 -11.506 134 HZ1 LYS 618 HZ1 LYS 618 0.139 -0.313 -9.167 135 HZ2 LYS 618 HZ2 LYS 618 -0.169 -1.651 -10.069 136 HZ3 LYS 618 HZ3 LYS 618 -1.417 -0.778 -9.457 137 HA PRO 619 HA PRO 619 -4.284 7.586 -13.813 138 HB2 PRO 619 HB2 PRO 619 -6.820 6.599 -13.666 139 HB3 PRO 619 HB3 PRO 619 -5.796 6.376 -15.115 140 HG2 PRO 619 HG2 PRO 619 -6.183 4.417 -12.814 141 HG3 PRO 619 HG3 PRO 619 -6.363 4.096 -14.572 142 HD2 PRO 619 HD2 PRO 619 -4.065 3.537 -13.254 143 HD3 PRO 619 HD3 PRO 619 -4.026 4.199 -14.917 144 H LYS 620 H LYS 620 -5.536 8.873 -12.397 145 HA LYS 620 HA LYS 620 -5.026 8.802 -9.664 146 HB2 LYS 620 HB2 LYS 620 -5.720 10.773 -10.905 147 HB3 LYS 620 HB3 LYS 620 -7.315 10.108 -11.209 148 HG2 LYS 620 HG2 LYS 620 -6.332 10.553 -8.369 149 HG3 LYS 620 HG3 LYS 620 -6.897 11.912 -9.327 150 HD2 LYS 620 HD2 LYS 620 -8.604 9.477 -8.670 151 HD3 LYS 620 HD3 LYS 620 -8.623 11.013 -7.808 152 HE2 LYS 620 HE2 LYS 620 -9.312 12.154 -9.932 153 HE3 LYS 620 HE3 LYS 620 -9.352 10.572 -10.732 154 HZ1 LYS 620 HZ1 LYS 620 -11.047 11.411 -8.468 155 HZ2 LYS 620 HZ2 LYS 620 -11.011 9.880 -9.043 156 HZ3 LYS 620 HZ3 LYS 620 -11.539 11.106 -10.011 157 H SER 621 H SER 621 -7.781 7.316 -11.402 158 HA SER 621 HA SER 621 -9.487 6.758 -9.259 159 HB2 SER 621 HB2 SER 621 -10.207 4.884 -10.877 160 HB3 SER 621 HB3 SER 621 -10.356 6.573 -11.397 161 HG SER 621 HG SER 621 -9.372 5.166 -12.971 162 H ALA 622 H ALA 622 -6.523 5.050 -10.343 163 HA ALA 622 HA ALA 622 -7.016 2.575 -9.026 164 HB1 ALA 622 HB1 ALA 622 -4.355 3.933 -9.675 165 HB2 ALA 622 HB2 ALA 622 -4.581 2.231 -9.232 166 HB3 ALA 622 HB3 ALA 622 -5.271 2.852 -10.744 167 H ARG 623 H ARG 623 -4.787 5.206 -7.943 168 HA ARG 623 HA ARG 623 -4.756 4.232 -5.243 169 HB2 ARG 623 HB2 ARG 623 -3.582 6.190 -4.611 170 HB3 ARG 623 HB3 ARG 623 -2.993 5.708 -6.191 171 HG2 ARG 623 HG2 ARG 623 -4.607 7.491 -7.157 172 HG3 ARG 623 HG3 ARG 623 -4.776 8.060 -5.483 173 HD2 ARG 623 HD2 ARG 623 -2.229 8.247 -5.426 174 HD3 ARG 623 HD3 ARG 623 -2.223 7.850 -7.141 175 HE ARG 623 HE ARG 623 -2.983 9.930 -7.680 176 HH11 ARG 623 HH11 ARG 623 -3.151 9.587 -4.173 177 HH12 ARG 623 HH12 ARG 623 -3.415 11.266 -3.850 178 HH21 ARG 623 HH21 ARG 623 -3.319 12.188 -7.283 179 HH22 ARG 623 HH22 ARG 623 -3.525 12.765 -5.674 180 H GLU 624 H GLU 624 -6.952 6.614 -6.812 181 HA GLU 624 HA GLU 624 -8.169 7.612 -4.474 182 HB2 GLU 624 HB2 GLU 624 -8.641 8.494 -6.664 183 HB3 GLU 624 HB3 GLU 624 -9.197 6.922 -7.215 184 HG2 GLU 624 HG2 GLU 624 -11.059 7.449 -5.255 185 HG3 GLU 624 HG3 GLU 624 -10.692 9.065 -5.849 186 H LYS 625 H LYS 625 -8.712 4.510 -6.138 187 HA LYS 625 HA LYS 625 -10.944 3.838 -4.277 188 HB2 LYS 625 HB2 LYS 625 -9.756 2.352 -6.651 189 HB3 LYS 625 HB3 LYS 625 -11.113 1.770 -5.661 190 HG2 LYS 625 HG2 LYS 625 -12.417 3.802 -6.198 191 HG3 LYS 625 HG3 LYS 625 -11.073 4.440 -7.145 192 HD2 LYS 625 HD2 LYS 625 -11.263 2.283 -8.551 193 HD3 LYS 625 HD3 LYS 625 -12.846 2.084 -7.783 194 HE2 LYS 625 HE2 LYS 625 -11.839 4.338 -9.570 195 HE3 LYS 625 HE3 LYS 625 -13.180 3.231 -9.890 196 HZ1 LYS 625 HZ1 LYS 625 -14.312 4.360 -7.970 197 HZ2 LYS 625 HZ2 LYS 625 -14.037 5.344 -9.262 198 HZ3 LYS 625 HZ3 LYS 625 -13.082 5.478 -7.952 199 H MET 626 H MET 626 -7.741 2.496 -5.186 200 HA MET 626 HA MET 626 -7.693 0.374 -3.331 201 HB2 MET 626 HB2 MET 626 -5.414 2.055 -4.464 202 HB3 MET 626 HB3 MET 626 -5.220 0.523 -3.608 203 HG2 MET 626 HG2 MET 626 -6.334 -0.687 -5.354 204 HG3 MET 626 HG3 MET 626 -6.845 0.788 -6.163 205 HE1 MET 626 HE1 MET 626 -3.072 0.635 -4.759 206 HE2 MET 626 HE2 MET 626 -3.700 -1.021 -4.799 207 HE3 MET 626 HE3 MET 626 -2.411 -0.541 -5.921 208 H MET 627 H MET 627 -6.537 3.777 -3.067 209 HA MET 627 HA MET 627 -5.329 3.330 -0.562 210 HB2 MET 627 HB2 MET 627 -4.307 5.295 -0.834 211 HB3 MET 627 HB3 MET 627 -4.722 4.963 -2.488 212 HG2 MET 627 HG2 MET 627 -5.416 7.095 -2.486 213 HG3 MET 627 HG3 MET 627 -6.890 6.449 -1.794 214 HE1 MET 627 HE1 MET 627 -3.661 8.550 -1.340 215 HE2 MET 627 HE2 MET 627 -3.553 8.805 0.416 216 HE3 MET 627 HE3 MET 627 -3.237 7.201 -0.261 217 H LYS 628 H LYS 628 -8.470 4.201 -1.501 218 HA LYS 628 HA LYS 628 -9.344 5.155 1.181 219 HB2 LYS 628 HB2 LYS 628 -10.851 4.509 -1.386 220 HB3 LYS 628 HB3 LYS 628 -11.682 4.522 0.171 221 HG2 LYS 628 HG2 LYS 628 -10.746 6.827 0.587 222 HG3 LYS 628 HG3 LYS 628 -10.233 6.884 -1.097 223 HD2 LYS 628 HD2 LYS 628 -13.129 6.244 -0.397 224 HD3 LYS 628 HD3 LYS 628 -12.545 7.884 -0.233 225 HE2 LYS 628 HE2 LYS 628 -13.674 7.614 -2.350 226 HE3 LYS 628 HE3 LYS 628 -11.974 8.045 -2.579 227 HZ1 LYS 628 HZ1 LYS 628 -12.764 6.305 -4.076 228 HZ2 LYS 628 HZ2 LYS 628 -12.988 5.286 -2.790 229 HZ3 LYS 628 HZ3 LYS 628 -11.470 5.857 -3.176 230 H ILE 629 H ILE 629 -9.721 2.193 -0.834 231 HA ILE 629 HA ILE 629 -11.011 0.586 1.046 232 HB ILE 629 HB ILE 629 -9.029 -0.136 -1.138 233 HG12 ILE 629 HG12 ILE 629 -12.017 -0.710 -1.093 234 HG13 ILE 629 HG13 ILE 629 -11.422 0.865 -1.610 235 HG21 ILE 629 HG21 ILE 629 -10.720 -2.024 0.560 236 HG22 ILE 629 HG22 ILE 629 -9.871 -2.492 -0.927 237 HG23 ILE 629 HG23 ILE 629 -8.945 -1.976 0.470 238 HD11 ILE 629 HD11 ILE 629 -10.023 -0.233 -3.353 239 HD12 ILE 629 HD12 ILE 629 -10.737 -1.793 -2.889 240 HD13 ILE 629 HD13 ILE 629 -11.765 -0.507 -3.547 241 H ILE 630 H ILE 630 -7.402 0.684 0.547 242 HA ILE 630 HA ILE 630 -6.852 -0.983 2.728 243 HB ILE 630 HB ILE 630 -4.553 -0.050 2.663 244 HG12 ILE 630 HG12 ILE 630 -4.373 1.457 0.371 245 HG13 ILE 630 HG13 ILE 630 -5.832 2.109 1.118 246 HG21 ILE 630 HG21 ILE 630 -4.007 -0.893 0.478 247 HG22 ILE 630 HG22 ILE 630 -5.238 -1.907 1.242 248 HG23 ILE 630 HG23 ILE 630 -5.699 -0.771 -0.047 249 HD11 ILE 630 HD11 ILE 630 -3.104 1.909 2.419 250 HD12 ILE 630 HD12 ILE 630 -3.888 3.379 1.794 251 HD13 ILE 630 HD13 ILE 630 -4.574 2.545 3.202 252 H GLU 631 H GLU 631 -7.628 2.489 2.918 253 HA GLU 631 HA GLU 631 -6.568 2.737 5.642 254 HB2 GLU 631 HB2 GLU 631 -7.822 4.493 3.638 255 HB3 GLU 631 HB3 GLU 631 -8.476 4.770 5.232 256 HG2 GLU 631 HG2 GLU 631 -5.465 4.572 4.879 257 HG3 GLU 631 HG3 GLU 631 -6.313 6.022 4.363 258 H ILE 632 H ILE 632 -9.779 2.138 4.090 259 HA ILE 632 HA ILE 632 -11.198 1.909 6.579 260 HB ILE 632 HB ILE 632 -11.721 0.466 3.952 261 HG12 ILE 632 HG12 ILE 632 -13.263 2.874 4.988 262 HG13 ILE 632 HG13 ILE 632 -11.795 3.110 4.052 263 HG21 ILE 632 HG21 ILE 632 -13.484 0.841 6.421 264 HG22 ILE 632 HG22 ILE 632 -14.060 0.198 4.871 265 HG23 ILE 632 HG23 ILE 632 -12.859 -0.692 5.799 266 HD11 ILE 632 HD11 ILE 632 -14.226 1.583 3.054 267 HD12 ILE 632 HD12 ILE 632 -13.740 3.226 2.599 268 HD13 ILE 632 HD13 ILE 632 -12.712 1.849 2.162 269 H ILE 633 H ILE 633 -9.345 -0.507 4.632 270 HA ILE 633 HA ILE 633 -10.040 -2.715 6.301 271 HB ILE 633 HB ILE 633 -7.596 -2.398 4.521 272 HG12 ILE 633 HG12 ILE 633 -10.447 -3.071 3.921 273 HG13 ILE 633 HG13 ILE 633 -9.271 -2.167 3.006 274 HG21 ILE 633 HG21 ILE 633 -7.472 -4.269 6.237 275 HG22 ILE 633 HG22 ILE 633 -8.908 -4.972 5.484 276 HG23 ILE 633 HG23 ILE 633 -7.413 -4.813 4.558 277 HD11 ILE 633 HD11 ILE 633 -9.836 -4.142 1.777 278 HD12 ILE 633 HD12 ILE 633 -8.139 -4.156 2.255 279 HD13 ILE 633 HD13 ILE 633 -9.315 -5.184 3.109 280 H ASP 634 H ASP 634 -7.121 -0.500 6.309 281 HA ASP 634 HA ASP 634 -6.020 -2.040 8.438 282 HB2 ASP 634 HB2 ASP 634 -4.799 -0.512 6.724 283 HB3 ASP 634 HB3 ASP 634 -5.121 0.783 7.876 284 H SER 635 H SER 635 -8.059 0.895 8.331 285 HA SER 635 HA SER 635 -7.794 1.585 11.092 286 HB2 SER 635 HB2 SER 635 -8.634 3.084 9.308 287 HB3 SER 635 HB3 SER 635 -10.086 2.074 9.141 288 HG SER 635 HG SER 635 -10.197 4.007 10.517 289 H LEU 636 H LEU 636 -10.157 -0.477 9.298 290 HA LEU 636 HA LEU 636 -11.671 -1.372 11.538 291 HB2 LEU 636 HB2 LEU 636 -11.002 -2.430 8.804 292 HB3 LEU 636 HB3 LEU 636 -11.780 -3.484 9.941 293 HG LEU 636 HG LEU 636 -13.066 -1.990 8.149 294 HD11 LEU 636 HD11 LEU 636 -14.072 -3.778 9.453 295 HD12 LEU 636 HD12 LEU 636 -15.114 -2.358 9.630 296 HD13 LEU 636 HD13 LEU 636 -14.017 -2.800 10.941 297 HD21 LEU 636 HD21 LEU 636 -14.305 -0.164 9.096 298 HD22 LEU 636 HD22 LEU 636 -12.579 0.214 9.140 299 HD23 LEU 636 HD23 LEU 636 -13.426 -0.280 10.631 300 H ALA 637 H ALA 637 -8.648 -2.661 10.056 301 HA ALA 637 HA ALA 637 -8.484 -4.964 11.712 302 HB1 ALA 637 HB1 ALA 637 -6.193 -5.137 10.859 303 HB2 ALA 637 HB2 ALA 637 -7.339 -4.768 9.549 304 HB3 ALA 637 HB3 ALA 637 -6.286 -3.492 10.213 305 H VAL 638 H VAL 638 -7.588 -1.637 12.438 306 HA VAL 638 HA VAL 638 -5.363 -2.042 13.980 307 HB VAL 638 HB VAL 638 -6.554 0.113 13.108 308 HG11 VAL 638 HG11 VAL 638 -7.736 1.456 14.692 309 HG12 VAL 638 HG12 VAL 638 -8.554 -0.112 14.659 310 HG13 VAL 638 HG13 VAL 638 -7.475 0.292 16.007 311 HG21 VAL 638 HG21 VAL 638 -4.305 0.080 14.053 312 HG22 VAL 638 HG22 VAL 638 -5.197 1.519 14.568 313 HG23 VAL 638 HG23 VAL 638 -4.971 0.167 15.700 314 H SER 639 H SER 639 -8.510 -2.959 14.911 315 HA SER 639 HA SER 639 -7.567 -3.670 17.642 316 HB2 SER 639 HB2 SER 639 -8.979 -1.658 17.829 317 HB3 SER 639 HB3 SER 639 -10.276 -2.476 16.930 318 HG SER 639 HG SER 639 -10.080 -4.135 18.596 319 H SER 640 H SER 640 -7.811 -5.186 14.967 320 HA SER 640 HA SER 640 -9.568 -7.378 15.938 321 HB2 SER 640 HB2 SER 640 -10.872 -5.898 14.401 322 HB3 SER 640 HB3 SER 640 -9.625 -6.109 13.167 323 HG SER 640 HG SER 640 -10.940 -7.633 12.586 324 H GLU 641 H GLU 641 -9.244 -9.288 14.398 325 HA GLU 641 HA GLU 641 -6.421 -9.949 13.911 326 HB2 GLU 641 HB2 GLU 641 -8.964 -11.196 12.787 327 HB3 GLU 641 HB3 GLU 641 -7.356 -11.910 12.777 328 HG2 GLU 641 HG2 GLU 641 -7.474 -12.149 15.256 329 HG3 GLU 641 HG3 GLU 641 -9.102 -11.435 15.235 330 H CYS 642 H CYS 642 -9.219 -8.663 12.204 331 HA CYS 642 HA CYS 642 -7.845 -7.847 9.793 332 HB2 CYS 642 HB2 CYS 642 -9.245 -9.438 8.375 333 HB3 CYS 642 HB3 CYS 642 -7.925 -10.167 9.280 334 H ALA 643 H ALA 643 -9.351 -6.898 8.312 335 HA ALA 643 HA ALA 643 -11.690 -5.591 9.540 336 HB1 ALA 643 HB1 ALA 643 -10.156 -4.379 8.000 337 HB2 ALA 643 HB2 ALA 643 -10.590 -5.505 6.708 338 HB3 ALA 643 HB3 ALA 643 -11.824 -4.421 7.376 339 H LYS 644 H LYS 644 -13.683 -6.381 9.387 340 HA LYS 644 HA LYS 644 -14.404 -8.822 8.009 341 HB2 LYS 644 HB2 LYS 644 -16.762 -7.870 8.620 342 HB3 LYS 644 HB3 LYS 644 -15.716 -8.502 9.894 343 HG2 LYS 644 HG2 LYS 644 -15.254 -6.397 10.796 344 HG3 LYS 644 HG3 LYS 644 -15.609 -5.561 9.295 345 HD2 LYS 644 HD2 LYS 644 -17.413 -5.025 10.682 346 HD3 LYS 644 HD3 LYS 644 -18.031 -6.222 9.552 347 HE2 LYS 644 HE2 LYS 644 -18.890 -6.810 11.691 348 HE3 LYS 644 HE3 LYS 644 -17.606 -7.984 11.352 349 HZ1 LYS 644 HZ1 LYS 644 -17.477 -7.094 13.603 350 HZ2 LYS 644 HZ2 LYS 644 -17.331 -5.559 13.024 351 HZ3 LYS 644 HZ3 LYS 644 -16.140 -6.656 12.748 352 H VAL 645 H VAL 645 -14.849 -8.969 5.885 353 HA VAL 645 HA VAL 645 -14.722 -6.771 4.144 354 HB VAL 645 HB VAL 645 -14.330 -9.312 3.731 355 HG11 VAL 645 HG11 VAL 645 -16.685 -10.037 4.235 356 HG12 VAL 645 HG12 VAL 645 -17.223 -9.180 2.779 357 HG13 VAL 645 HG13 VAL 645 -16.102 -10.532 2.631 358 HG21 VAL 645 HG21 VAL 645 -15.630 -7.533 1.638 359 HG22 VAL 645 HG22 VAL 645 -13.906 -7.610 2.072 360 HG23 VAL 645 HG23 VAL 645 -14.695 -9.001 1.308 361 H LYS 646 H LYS 646 -17.392 -8.035 5.920 362 HA LYS 646 HA LYS 646 -19.607 -7.105 4.439 363 HB2 LYS 646 HB2 LYS 646 -19.308 -8.606 6.592 364 HB3 LYS 646 HB3 LYS 646 -19.443 -7.085 7.479 365 HG2 LYS 646 HG2 LYS 646 -21.660 -6.686 6.352 366 HG3 LYS 646 HG3 LYS 646 -21.474 -8.222 5.501 367 HD2 LYS 646 HD2 LYS 646 -21.888 -7.784 8.479 368 HD3 LYS 646 HD3 LYS 646 -22.959 -8.604 7.347 369 HE2 LYS 646 HE2 LYS 646 -20.228 -9.573 8.295 370 HE3 LYS 646 HE3 LYS 646 -21.787 -10.235 8.793 371 HZ1 LYS 646 HZ1 LYS 646 -22.000 -11.312 6.775 372 HZ2 LYS 646 HZ2 LYS 646 -20.336 -11.284 6.902 373 HZ3 LYS 646 HZ3 LYS 646 -21.084 -10.204 5.953 374 H ASP 647 H ASP 647 -17.368 -5.472 6.745 375 HA ASP 647 HA ASP 647 -18.933 -3.044 6.689 376 HB2 ASP 647 HB2 ASP 647 -16.792 -4.088 8.298 377 HB3 ASP 647 HB3 ASP 647 -16.182 -2.638 7.567 378 H ILE 648 H ILE 648 -16.038 -4.336 5.136 379 HA ILE 648 HA ILE 648 -15.219 -1.903 3.885 380 HB ILE 648 HB ILE 648 -14.794 -4.707 2.751 381 HG12 ILE 648 HG12 ILE 648 -13.019 -3.289 4.795 382 HG13 ILE 648 HG13 ILE 648 -14.091 -4.623 5.166 383 HG21 ILE 648 HG21 ILE 648 -13.079 -2.187 2.508 384 HG22 ILE 648 HG22 ILE 648 -12.797 -3.742 1.692 385 HG23 ILE 648 HG23 ILE 648 -14.195 -2.775 1.259 386 HD11 ILE 648 HD11 ILE 648 -11.704 -4.795 3.305 387 HD12 ILE 648 HD12 ILE 648 -11.878 -5.521 4.906 388 HD13 ILE 648 HD13 ILE 648 -12.852 -6.094 3.551 389 H LEU 649 H LEU 649 -17.259 -4.574 2.741 390 HA LEU 649 HA LEU 649 -18.136 -3.517 0.284 391 HB2 LEU 649 HB2 LEU 649 -19.413 -5.333 2.340 392 HB3 LEU 649 HB3 LEU 649 -20.211 -4.946 0.823 393 HG LEU 649 HG LEU 649 -17.409 -6.152 0.888 394 HD11 LEU 649 HD11 LEU 649 -18.967 -7.672 2.071 395 HD12 LEU 649 HD12 LEU 649 -18.469 -8.347 0.512 396 HD13 LEU 649 HD13 LEU 649 -20.082 -7.616 0.692 397 HD21 LEU 649 HD21 LEU 649 -17.940 -6.866 -1.393 398 HD22 LEU 649 HD22 LEU 649 -18.137 -5.119 -1.257 399 HD23 LEU 649 HD23 LEU 649 -19.571 -6.173 -1.242 400 H LYS 650 H LYS 650 -19.437 -3.045 3.608 401 HA LYS 650 HA LYS 650 -21.655 -1.465 2.770 402 HB2 LYS 650 HB2 LYS 650 -21.458 -2.501 5.002 403 HB3 LYS 650 HB3 LYS 650 -20.185 -1.372 5.452 404 HG2 LYS 650 HG2 LYS 650 -22.718 -0.153 4.416 405 HG3 LYS 650 HG3 LYS 650 -22.878 -1.016 5.930 406 HD2 LYS 650 HD2 LYS 650 -20.645 1.020 5.654 407 HD3 LYS 650 HD3 LYS 650 -22.302 1.563 5.865 408 HE2 LYS 650 HE2 LYS 650 -22.238 1.226 8.032 409 HE3 LYS 650 HE3 LYS 650 -21.929 -0.500 7.805 410 HZ1 LYS 650 HZ1 LYS 650 -19.766 1.522 7.757 411 HZ2 LYS 650 HZ2 LYS 650 -19.597 -0.122 7.979 412 HZ3 LYS 650 HZ3 LYS 650 -20.253 0.789 9.142 413 H GLU 651 H GLU 651 -18.437 -0.352 4.031 414 HA GLU 651 HA GLU 651 -19.130 2.398 3.567 415 HB2 GLU 651 HB2 GLU 651 -16.425 1.046 3.964 416 HB3 GLU 651 HB3 GLU 651 -16.631 2.791 3.841 417 HG2 GLU 651 HG2 GLU 651 -17.753 0.979 6.003 418 HG3 GLU 651 HG3 GLU 651 -16.462 2.169 6.170 419 H ALA 652 H ALA 652 -17.391 0.025 1.506 420 HA ALA 652 HA ALA 652 -16.700 2.011 -0.452 421 HB1 ALA 652 HB1 ALA 652 -15.520 -0.080 -0.360 422 HB2 ALA 652 HB2 ALA 652 -17.021 -0.976 -0.629 423 HB3 ALA 652 HB3 ALA 652 -16.344 0.040 -1.931 424 H GLN 653 H GLN 653 -19.686 -0.049 -0.035 425 HA GLN 653 HA GLN 653 -20.943 0.993 -2.406 426 HB2 GLN 653 HB2 GLN 653 -22.040 -0.278 0.113 427 HB3 GLN 653 HB3 GLN 653 -23.086 0.430 -1.120 428 HG2 GLN 653 HG2 GLN 653 -21.933 -0.996 -2.853 429 HG3 GLN 653 HG3 GLN 653 -21.124 -1.854 -1.535 430 HE21 GLN 653 HE21 GLN 653 -23.412 -2.701 -3.687 431 HE22 GLN 653 HE22 GLN 653 -24.660 -3.219 -2.562 432 H GLN 654 H GLN 654 -20.854 2.221 0.990 433 HA GLN 654 HA GLN 654 -22.510 4.491 0.454 434 HB2 GLN 654 HB2 GLN 654 -20.183 4.430 2.432 435 HB3 GLN 654 HB3 GLN 654 -21.465 5.630 2.327 436 HG2 GLN 654 HG2 GLN 654 -23.093 3.610 2.666 437 HG3 GLN 654 HG3 GLN 654 -21.670 2.773 3.280 438 HE21 GLN 654 HE21 GLN 654 -20.292 4.348 5.087 439 HE22 GLN 654 HE22 GLN 654 -21.456 5.031 6.182 440 H VAL 655 H VAL 655 -18.961 4.136 0.073 441 HA VAL 655 HA VAL 655 -18.479 6.746 -0.988 442 HB VAL 655 HB VAL 655 -17.012 4.092 -1.115 443 HG11 VAL 655 HG11 VAL 655 -15.969 6.742 -2.170 444 HG12 VAL 655 HG12 VAL 655 -14.998 5.272 -1.876 445 HG13 VAL 655 HG13 VAL 655 -16.256 5.263 -3.115 446 HG21 VAL 655 HG21 VAL 655 -17.149 5.301 1.086 447 HG22 VAL 655 HG22 VAL 655 -15.497 5.170 0.483 448 HG23 VAL 655 HG23 VAL 655 -16.385 6.706 0.334 449 H GLY 656 H GLY 656 -19.719 3.827 -2.549 450 HA2 GLY 656 HA2 GLY 656 -21.311 4.272 -4.338 451 HA3 GLY 656 HA3 GLY 656 -20.222 5.497 -4.993 452 H ILE 657 H ILE 657 -19.260 2.235 -3.832 453 HA ILE 657 HA ILE 657 -18.494 1.451 -6.608 454 HB ILE 657 HB ILE 657 -17.133 0.960 -3.925 455 HG12 ILE 657 HG12 ILE 657 -15.895 2.460 -6.269 456 HG13 ILE 657 HG13 ILE 657 -16.825 3.306 -5.038 457 HG21 ILE 657 HG21 ILE 657 -16.958 -0.964 -5.398 458 HG22 ILE 657 HG22 ILE 657 -16.348 0.039 -6.721 459 HG23 ILE 657 HG23 ILE 657 -15.380 -0.213 -5.240 460 HD11 ILE 657 HD11 ILE 657 -14.330 1.672 -4.480 461 HD12 ILE 657 HD12 ILE 657 -14.487 3.440 -4.474 462 HD13 ILE 657 HD13 ILE 657 -15.347 2.475 -3.260 463 H GLU 658 H GLU 658 -19.054 -0.813 -7.135 464 HA GLU 658 HA GLU 658 -21.243 -1.707 -5.408 465 HB2 GLU 658 HB2 GLU 658 -21.473 -1.626 -7.870 466 HB3 GLU 658 HB3 GLU 658 -20.136 -2.755 -8.035 467 HG2 GLU 658 HG2 GLU 658 -22.334 -3.802 -8.421 468 HG3 GLU 658 HG3 GLU 658 -21.390 -4.588 -7.178 469 H LYS 659 H LYS 659 -21.402 -3.766 -4.601 470 HA LYS 659 HA LYS 659 -19.641 -5.234 -3.144 471 HB2 LYS 659 HB2 LYS 659 -21.633 -6.357 -5.167 472 HB3 LYS 659 HB3 LYS 659 -20.814 -7.360 -3.972 473 HG2 LYS 659 HG2 LYS 659 -21.903 -6.415 -2.193 474 HG3 LYS 659 HG3 LYS 659 -22.401 -4.974 -3.110 475 HD2 LYS 659 HD2 LYS 659 -23.482 -7.770 -3.645 476 HD3 LYS 659 HD3 LYS 659 -24.279 -6.583 -2.588 477 HE2 LYS 659 HE2 LYS 659 -24.333 -4.945 -4.475 478 HE3 LYS 659 HE3 LYS 659 -23.595 -6.134 -5.530 479 HZ1 LYS 659 HZ1 LYS 659 -26.246 -6.386 -4.297 480 HZ2 LYS 659 HZ2 LYS 659 -25.533 -7.508 -5.284 481 HZ3 LYS 659 HZ3 LYS 659 -25.887 -6.000 -5.859 482 H SER 660 H SER 660 -20.191 -6.079 -6.535 483 HA SER 660 HA SER 660 -18.007 -7.893 -6.376 484 HB2 SER 660 HB2 SER 660 -20.278 -8.168 -7.357 485 HB3 SER 660 HB3 SER 660 -19.708 -7.260 -8.767 486 HG SER 660 HG SER 660 -18.548 -9.651 -7.546 487 H ASN 661 H ASN 661 -18.157 -4.598 -7.328 488 HA ASN 661 HA ASN 661 -15.699 -4.490 -8.866 489 HB2 ASN 661 HB2 ASN 661 -16.932 -2.469 -6.977 490 HB3 ASN 661 HB3 ASN 661 -15.547 -2.221 -7.955 491 HD21 ASN 661 HD21 ASN 661 -16.902 -3.620 -10.397 492 HD22 ASN 661 HD22 ASN 661 -18.079 -2.410 -10.877 493 H ILE 662 H ILE 662 -16.603 -4.704 -5.374 494 HA ILE 662 HA ILE 662 -13.930 -3.953 -4.453 495 HB ILE 662 HB ILE 662 -16.400 -4.962 -2.992 496 HG12 ILE 662 HG12 ILE 662 -15.431 -2.138 -2.674 497 HG13 ILE 662 HG13 ILE 662 -16.172 -2.525 -4.209 498 HG21 ILE 662 HG21 ILE 662 -13.839 -3.839 -1.822 499 HG22 ILE 662 HG22 ILE 662 -15.354 -4.108 -0.923 500 HG23 ILE 662 HG23 ILE 662 -14.505 -5.475 -1.633 501 HD11 ILE 662 HD11 ILE 662 -17.457 -2.903 -1.518 502 HD12 ILE 662 HD12 ILE 662 -17.913 -1.720 -2.761 503 HD13 ILE 662 HD13 ILE 662 -18.172 -3.450 -3.026 504 H GLU 663 H GLU 663 -15.878 -6.745 -5.235 505 HA GLU 663 HA GLU 663 -14.125 -8.759 -4.062 506 HB2 GLU 663 HB2 GLU 663 -15.826 -9.060 -6.561 507 HB3 GLU 663 HB3 GLU 663 -15.081 -10.357 -5.635 508 HG2 GLU 663 HG2 GLU 663 -16.457 -9.702 -3.658 509 HG3 GLU 663 HG3 GLU 663 -17.245 -8.498 -4.583 510 H LYS 664 H LYS 664 -14.239 -7.191 -7.318 511 HA LYS 664 HA LYS 664 -11.887 -8.517 -8.198 512 HB2 LYS 664 HB2 LYS 664 -12.181 -5.764 -9.302 513 HB3 LYS 664 HB3 LYS 664 -11.845 -7.296 -10.096 514 HG2 LYS 664 HG2 LYS 664 -14.390 -7.802 -9.501 515 HG3 LYS 664 HG3 LYS 664 -14.433 -6.045 -9.303 516 HD2 LYS 664 HD2 LYS 664 -15.162 -6.270 -11.463 517 HD3 LYS 664 HD3 LYS 664 -13.427 -5.975 -11.722 518 HE2 LYS 664 HE2 LYS 664 -13.064 -8.439 -11.820 519 HE3 LYS 664 HE3 LYS 664 -14.790 -8.699 -11.504 520 HZ1 LYS 664 HZ1 LYS 664 -13.693 -7.368 -13.901 521 HZ2 LYS 664 HZ2 LYS 664 -15.292 -7.629 -13.590 522 HZ3 LYS 664 HZ3 LYS 664 -14.285 -8.902 -13.842 523 H LEU 665 H LEU 665 -12.203 -5.247 -6.725 524 HA LEU 665 HA LEU 665 -9.432 -4.678 -6.651 525 HB2 LEU 665 HB2 LEU 665 -11.769 -3.622 -5.095 526 HB3 LEU 665 HB3 LEU 665 -10.202 -3.459 -4.335 527 HG LEU 665 HG LEU 665 -10.892 -1.473 -5.612 528 HD11 LEU 665 HD11 LEU 665 -8.329 -2.741 -6.658 529 HD12 LEU 665 HD12 LEU 665 -8.515 -1.922 -5.093 530 HD13 LEU 665 HD13 LEU 665 -8.722 -1.015 -6.599 531 HD21 LEU 665 HD21 LEU 665 -10.784 -1.382 -8.018 532 HD22 LEU 665 HD22 LEU 665 -11.995 -2.580 -7.519 533 HD23 LEU 665 HD23 LEU 665 -10.406 -3.113 -8.119 534 H LEU 666 H LEU 666 -11.353 -6.141 -3.928 535 HA LEU 666 HA LEU 666 -9.233 -6.667 -2.189 536 HB2 LEU 666 HB2 LEU 666 -11.697 -8.322 -2.831 537 HB3 LEU 666 HB3 LEU 666 -10.600 -8.733 -1.525 538 HG LEU 666 HG LEU 666 -11.991 -6.026 -1.633 539 HD11 LEU 666 HD11 LEU 666 -12.888 -8.589 -0.246 540 HD12 LEU 666 HD12 LEU 666 -13.665 -7.867 -1.670 541 HD13 LEU 666 HD13 LEU 666 -13.669 -6.989 -0.139 542 HD21 LEU 666 HD21 LEU 666 -10.091 -6.095 -0.103 543 HD22 LEU 666 HD22 LEU 666 -10.699 -7.595 0.637 544 HD23 LEU 666 HD23 LEU 666 -11.599 -6.076 0.817 545 H THR 667 H THR 667 -10.371 -8.665 -4.956 546 HA THR 667 HA THR 667 -8.562 -10.793 -4.520 547 HB THR 667 HB THR 667 -9.821 -9.905 -7.147 548 HG1 THR 667 HG1 THR 667 -11.418 -10.342 -5.767 549 HG21 THR 667 HG21 THR 667 -7.970 -11.473 -7.544 550 HG22 THR 667 HG22 THR 667 -9.513 -12.310 -7.758 551 HG23 THR 667 HG23 THR 667 -8.567 -12.550 -6.270 552 H ASP 668 H ASP 668 -8.126 -7.721 -6.386 553 HA ASP 668 HA ASP 668 -5.568 -8.600 -7.510 554 HB2 ASP 668 HB2 ASP 668 -6.805 -6.837 -8.611 555 HB3 ASP 668 HB3 ASP 668 -6.876 -5.885 -7.128 556 H MET 669 H MET 669 -6.685 -6.613 -4.762 557 HA MET 669 HA MET 669 -4.152 -5.895 -3.811 558 HB2 MET 669 HB2 MET 669 -6.739 -6.289 -2.286 559 HB3 MET 669 HB3 MET 669 -5.341 -5.373 -1.713 560 HG2 MET 669 HG2 MET 669 -6.876 -4.682 -4.234 561 HG3 MET 669 HG3 MET 669 -7.263 -4.037 -2.694 562 HE1 MET 669 HE1 MET 669 -4.748 -4.482 -5.581 563 HE2 MET 669 HE2 MET 669 -6.025 -3.315 -5.952 564 HE3 MET 669 HE3 MET 669 -4.333 -2.793 -5.887 565 H ARG 670 H ARG 670 -6.124 -8.737 -2.792 566 HA ARG 670 HA ARG 670 -4.068 -9.752 -1.036 567 HB2 ARG 670 HB2 ARG 670 -5.414 -11.779 -0.818 568 HB3 ARG 670 HB3 ARG 670 -6.356 -10.328 -0.530 569 HG2 ARG 670 HG2 ARG 670 -7.810 -10.780 -2.139 570 HG3 ARG 670 HG3 ARG 670 -6.555 -11.191 -3.313 571 HD2 ARG 670 HD2 ARG 670 -6.485 -13.478 -2.429 572 HD3 ARG 670 HD3 ARG 670 -7.718 -13.057 -1.225 573 HE ARG 670 HE ARG 670 -8.157 -12.771 -4.167 574 HH11 ARG 670 HH11 ARG 670 -9.418 -14.384 -1.176 575 HH12 ARG 670 HH12 ARG 670 -11.026 -14.199 -1.644 576 HH21 ARG 670 HH21 ARG 670 -10.484 -12.502 -4.717 577 HH22 ARG 670 HH22 ARG 670 -11.576 -13.430 -3.768 578 H LYS 671 H LYS 671 -4.671 -10.179 -4.512 579 HA LYS 671 HA LYS 671 -2.865 -12.465 -4.594 580 HB2 LYS 671 HB2 LYS 671 -4.854 -12.206 -6.057 581 HB3 LYS 671 HB3 LYS 671 -4.096 -10.797 -6.830 582 HG2 LYS 671 HG2 LYS 671 -2.297 -12.229 -7.689 583 HG3 LYS 671 HG3 LYS 671 -2.958 -13.626 -6.805 584 HD2 LYS 671 HD2 LYS 671 -4.965 -13.632 -8.164 585 HD3 LYS 671 HD3 LYS 671 -4.558 -12.072 -8.883 586 HE2 LYS 671 HE2 LYS 671 -4.135 -13.908 -10.452 587 HE3 LYS 671 HE3 LYS 671 -2.667 -13.000 -10.065 588 HZ1 LYS 671 HZ1 LYS 671 -2.052 -14.754 -8.541 589 HZ2 LYS 671 HZ2 LYS 671 -2.267 -15.364 -10.053 590 HZ3 LYS 671 HZ3 LYS 671 -3.414 -15.608 -8.897 591 H SER 672 H SER 672 -2.643 -8.982 -5.211 592 HA SER 672 HA SER 672 -0.025 -9.213 -6.458 593 HB2 SER 672 HB2 SER 672 -1.886 -6.856 -5.982 594 HB3 SER 672 HB3 SER 672 -0.401 -6.816 -6.947 595 HG SER 672 HG SER 672 -2.764 -7.345 -7.900 596 H GLY 673 H GLY 673 -1.301 -8.094 -3.269 597 HA2 GLY 673 HA2 GLY 673 0.425 -8.960 -1.624 598 HA3 GLY 673 HA3 GLY 673 1.588 -7.915 -2.437 599 H ILE 674 H ILE 674 -1.613 -6.626 -2.119 600 HA ILE 674 HA ILE 674 -0.508 -4.453 -0.473 601 HB ILE 674 HB ILE 674 -3.111 -4.785 -2.033 602 HG12 ILE 674 HG12 ILE 674 -1.796 -2.832 -3.337 603 HG13 ILE 674 HG13 ILE 674 -0.390 -3.683 -2.735 604 HG21 ILE 674 HG21 ILE 674 -3.464 -3.213 -0.223 605 HG22 ILE 674 HG22 ILE 674 -1.967 -2.348 -0.619 606 HG23 ILE 674 HG23 ILE 674 -3.354 -2.326 -1.731 607 HD11 ILE 674 HD11 ILE 674 -1.401 -5.747 -3.934 608 HD12 ILE 674 HD12 ILE 674 -2.597 -4.630 -4.606 609 HD13 ILE 674 HD13 ILE 674 -0.885 -4.412 -4.972 610 H ILE 675 H ILE 675 -2.926 -7.078 -0.317 611 HA ILE 675 HA ILE 675 -3.187 -6.622 2.578 612 HB ILE 675 HB ILE 675 -5.542 -6.710 2.626 613 HG12 ILE 675 HG12 ILE 675 -5.459 -7.310 -0.330 614 HG13 ILE 675 HG13 ILE 675 -6.027 -8.363 0.958 615 HG21 ILE 675 HG21 ILE 675 -5.071 -4.787 0.326 616 HG22 ILE 675 HG22 ILE 675 -6.162 -4.624 1.701 617 HG23 ILE 675 HG23 ILE 675 -4.439 -4.451 1.915 618 HD11 ILE 675 HD11 ILE 675 -7.919 -7.485 -0.233 619 HD12 ILE 675 HD12 ILE 675 -7.903 -6.773 1.398 620 HD13 ILE 675 HD13 ILE 675 -7.380 -5.816 -0.008 621 H TYR 676 H TYR 676 -4.401 -8.707 3.476 622 HA TYR 676 HA TYR 676 -4.256 -10.998 1.646 623 HB2 TYR 676 HB2 TYR 676 -3.506 -12.324 3.886 624 HB3 TYR 676 HB3 TYR 676 -2.453 -11.851 2.574 625 HD1 TYR 676 HD2 TYR 676 -3.768 -9.851 5.496 626 HD2 TYR 676 HD1 TYR 676 -0.344 -11.568 3.524 627 HE1 TYR 676 HE2 TYR 676 -2.253 -8.705 7.102 628 HE2 TYR 676 HE1 TYR 676 1.155 -10.473 5.164 629 HH TYR 676 HH TYR 676 0.223 -7.808 7.074 630 H GLU 677 H GLU 677 -5.512 -12.915 2.645 631 HA GLU 677 HA GLU 677 -8.018 -11.897 3.752 632 HB2 GLU 677 HB2 GLU 677 -7.845 -12.822 1.458 633 HB3 GLU 677 HB3 GLU 677 -7.246 -14.352 2.122 634 HG2 GLU 677 HG2 GLU 677 -9.382 -14.739 3.230 635 HG3 GLU 677 HG3 GLU 677 -9.888 -13.089 2.796 636 H ALA 678 H ALA 678 -8.307 -12.426 5.915 637 HA ALA 678 HA ALA 678 -6.638 -14.553 7.146 638 HB1 ALA 678 HB1 ALA 678 -7.562 -13.663 9.252 639 HB2 ALA 678 HB2 ALA 678 -6.820 -12.368 8.292 640 HB3 ALA 678 HB3 ALA 678 -8.591 -12.544 8.331 641 H LYS 679 H LYS 679 -9.962 -13.831 6.141 642 HA LYS 679 HA LYS 679 -10.657 -16.648 6.332 643 HB2 LYS 679 HB2 LYS 679 -12.348 -14.473 7.708 644 HB3 LYS 679 HB3 LYS 679 -12.946 -16.057 7.280 645 HG2 LYS 679 HG2 LYS 679 -12.439 -16.540 9.423 646 HG3 LYS 679 HG3 LYS 679 -10.875 -16.916 8.715 647 HD2 LYS 679 HD2 LYS 679 -10.301 -14.398 9.287 648 HD3 LYS 679 HD3 LYS 679 -11.741 -14.468 10.307 649 HE2 LYS 679 HE2 LYS 679 -10.785 -16.366 11.563 650 HE3 LYS 679 HE3 LYS 679 -9.396 -16.416 10.455 651 HZ1 LYS 679 HZ1 LYS 679 -8.842 -15.182 12.520 652 HZ2 LYS 679 HZ2 LYS 679 -10.047 -14.202 12.346 653 HZ3 LYS 679 HZ3 LYS 679 -8.825 -14.166 11.230 654 HA PRO 680 HA PRO 680 -12.609 -15.168 2.514 655 HB2 PRO 680 HB2 PRO 680 -14.665 -16.941 2.099 656 HB3 PRO 680 HB3 PRO 680 -12.945 -17.389 1.943 657 HG2 PRO 680 HG2 PRO 680 -14.745 -17.746 4.362 658 HG3 PRO 680 HG3 PRO 680 -13.710 -18.977 3.565 659 HD2 PRO 680 HD2 PRO 680 -12.851 -17.647 5.754 660 HD3 PRO 680 HD3 PRO 680 -11.727 -17.987 4.408 661 H GLU 681 H GLU 681 -13.371 -13.921 4.992 662 HA GLU 681 HA GLU 681 -15.111 -12.209 3.721 663 HB2 GLU 681 HB2 GLU 681 -17.080 -12.220 4.706 664 HB3 GLU 681 HB3 GLU 681 -16.749 -13.925 4.717 665 HG2 GLU 681 HG2 GLU 681 -16.533 -14.058 7.034 666 HG3 GLU 681 HG3 GLU 681 -16.247 -12.340 7.266 667 H CYS 682 H CYS 682 -12.414 -12.484 5.316 668 HA CYS 682 HA CYS 682 -12.678 -9.943 6.739 669 HB2 CYS 682 HB2 CYS 682 -13.212 -11.927 8.284 670 HB3 CYS 682 HB3 CYS 682 -11.505 -12.344 8.155 671 H TYR 683 H TYR 683 -10.944 -8.762 6.053 672 HA TYR 683 HA TYR 683 -8.537 -10.161 4.945 673 HB2 TYR 683 HB2 TYR 683 -10.000 -7.717 3.866 674 HB3 TYR 683 HB3 TYR 683 -8.440 -8.291 3.296 675 HD1 TYR 683 HD2 TYR 683 -12.042 -9.234 3.578 676 HD2 TYR 683 HD1 TYR 683 -8.271 -9.964 1.620 677 HE1 TYR 683 HE2 TYR 683 -13.169 -10.787 1.985 678 HE2 TYR 683 HE1 TYR 683 -9.405 -11.471 0.003 679 HH TYR 683 HH TYR 683 -11.615 -13.060 0.376 680 H LYS 684 H LYS 684 -6.528 -8.885 5.105 681 HA LYS 684 HA LYS 684 -6.723 -6.600 7.015 682 HB2 LYS 684 HB2 LYS 684 -6.225 -8.874 8.115 683 HB3 LYS 684 HB3 LYS 684 -4.653 -8.798 7.342 684 HG2 LYS 684 HG2 LYS 684 -5.834 -6.722 9.240 685 HG3 LYS 684 HG3 LYS 684 -4.712 -7.999 9.707 686 HD2 LYS 684 HD2 LYS 684 -3.315 -6.864 7.649 687 HD3 LYS 684 HD3 LYS 684 -4.213 -5.455 8.238 688 HE2 LYS 684 HE2 LYS 684 -3.160 -5.641 10.401 689 HE3 LYS 684 HE3 LYS 684 -2.372 -7.167 9.942 690 HZ1 LYS 684 HZ1 LYS 684 -1.950 -4.697 8.392 691 HZ2 LYS 684 HZ2 LYS 684 -1.030 -5.997 8.330 692 HZ3 LYS 684 HZ3 LYS 684 -0.980 -5.058 9.696 693 H LYS 685 H LYS 685 -5.544 -4.929 6.409 694 HA LYS 685 HA LYS 685 -4.221 -4.785 3.874 695 HB2 LYS 685 HB2 LYS 685 -5.531 -2.973 4.906 696 HB3 LYS 685 HB3 LYS 685 -4.432 -2.895 6.266 697 HG2 LYS 685 HG2 LYS 685 -3.676 -2.274 3.377 698 HG3 LYS 685 HG3 LYS 685 -4.253 -1.095 4.547 699 HD2 LYS 685 HD2 LYS 685 -2.180 -0.711 5.199 700 HD3 LYS 685 HD3 LYS 685 -2.137 -2.320 5.910 701 HE2 LYS 685 HE2 LYS 685 -1.518 -3.129 3.510 702 HE3 LYS 685 HE3 LYS 685 -1.256 -1.446 3.130 703 HZ1 LYS 685 HZ1 LYS 685 0.141 -3.099 5.200 704 HZ2 LYS 685 HZ2 LYS 685 0.323 -1.461 5.114 705 HZ3 LYS 685 HZ3 LYS 685 0.809 -2.445 3.872 706 H VAL 686 H VAL 686 -2.054 -5.214 3.457 707 HA VAL 686 HA VAL 686 -0.967 -7.117 4.943 708 HB VAL 686 HB VAL 686 -0.358 -6.636 2.660 709 HG11 VAL 686 HG11 VAL 686 0.189 -4.236 2.714 710 HG12 VAL 686 HG12 VAL 686 1.651 -4.595 3.680 711 HG13 VAL 686 HG13 VAL 686 1.485 -5.195 2.021 712 HG21 VAL 686 HG21 VAL 686 1.956 -7.425 2.737 713 HG22 VAL 686 HG22 VAL 686 2.052 -7.021 4.468 714 HG23 VAL 686 HG23 VAL 686 0.929 -8.272 3.888 Start of MODEL 11 1 H1 GLY 600 H1 GLY 600 5.750 20.651 -2.344 2 H2 GLY 600 H2 GLY 600 7.321 21.176 -2.385 3 H3 GLY 600 H3 GLY 600 6.797 19.978 -3.406 4 HA2 GLY 600 HA2 GLY 600 8.107 19.056 -1.618 5 HA3 GLY 600 HA3 GLY 600 6.914 19.734 -0.485 6 H SER 601 H SER 601 6.661 17.356 0.167 7 HA SER 601 HA SER 601 4.313 16.333 -1.082 8 HB2 SER 601 HB2 SER 601 6.194 15.227 -2.412 9 HB3 SER 601 HB3 SER 601 6.742 14.492 -0.889 10 HG SER 601 HG SER 601 5.355 13.096 -1.987 11 H HIS 602 H HIS 602 4.047 14.110 0.302 12 HA HIS 602 HA HIS 602 4.208 14.756 3.188 13 HB2 HIS 602 HB2 HIS 602 3.220 12.269 1.715 14 HB3 HIS 602 HB3 HIS 602 3.120 12.532 3.454 15 HD1 HIS 602 HD1 HIS 602 1.250 14.314 4.304 16 HD2 HIS 602 HD2 HIS 602 1.417 13.551 0.164 17 HE1 HIS 602 HE1 HIS 602 -0.880 15.296 3.285 18 H MET 603 H MET 603 5.142 12.847 4.552 19 HA MET 603 HA MET 603 7.201 11.246 3.315 20 HB2 MET 603 HB2 MET 603 7.829 13.195 5.584 21 HB3 MET 603 HB3 MET 603 8.811 11.785 5.185 22 HG2 MET 603 HG2 MET 603 8.984 12.708 2.808 23 HG3 MET 603 HG3 MET 603 8.276 14.197 3.435 24 HE1 MET 603 HE1 MET 603 12.496 12.512 4.253 25 HE2 MET 603 HE2 MET 603 11.035 11.581 4.650 26 HE3 MET 603 HE3 MET 603 11.380 12.008 2.964 27 H GLY 604 H GLY 604 7.975 9.731 5.130 28 HA2 GLY 604 HA2 GLY 604 7.237 8.317 7.014 29 HA3 GLY 604 HA3 GLY 604 5.542 8.684 6.552 30 H GLU 605 H GLU 605 8.086 8.192 4.244 31 HA GLU 605 HA GLU 605 6.895 6.052 2.827 32 HB2 GLU 605 HB2 GLU 605 9.211 5.817 1.991 33 HB3 GLU 605 HB3 GLU 605 8.430 7.346 1.641 34 HG2 GLU 605 HG2 GLU 605 10.417 7.053 3.934 35 HG3 GLU 605 HG3 GLU 605 10.951 7.284 2.280 36 H SER 606 H SER 606 6.715 3.924 3.361 37 HA SER 606 HA SER 606 8.743 2.364 4.552 38 HB2 SER 606 HB2 SER 606 6.397 3.245 6.298 39 HB3 SER 606 HB3 SER 606 7.291 1.740 6.599 40 HG SER 606 HG SER 606 8.690 4.160 6.225 41 H GLY 607 H GLY 607 7.697 0.091 4.985 42 HA2 GLY 607 HA2 GLY 607 6.300 -1.644 4.246 43 HA3 GLY 607 HA3 GLY 607 5.341 -0.489 3.299 44 H LYS 608 H LYS 608 5.609 -2.132 1.567 45 HA LYS 608 HA LYS 608 8.193 -1.794 0.125 46 HB2 LYS 608 HB2 LYS 608 8.346 -3.975 -0.496 47 HB3 LYS 608 HB3 LYS 608 7.886 -4.084 1.189 48 HG2 LYS 608 HG2 LYS 608 6.014 -4.481 -1.202 49 HG3 LYS 608 HG3 LYS 608 6.826 -5.759 -0.322 50 HD2 LYS 608 HD2 LYS 608 5.571 -5.287 1.705 51 HD3 LYS 608 HD3 LYS 608 4.781 -3.884 0.939 52 HE2 LYS 608 HE2 LYS 608 3.746 -5.281 -0.745 53 HE3 LYS 608 HE3 LYS 608 4.629 -6.709 -0.189 54 HZ1 LYS 608 HZ1 LYS 608 2.653 -5.249 1.499 55 HZ2 LYS 608 HZ2 LYS 608 3.354 -6.709 1.805 56 HZ3 LYS 608 HZ3 LYS 608 2.277 -6.510 0.564 57 H ILE 609 H ILE 609 5.243 -0.578 -0.084 58 HA ILE 609 HA ILE 609 5.113 -0.808 -3.028 59 HB ILE 609 HB ILE 609 2.604 -0.548 -1.374 60 HG12 ILE 609 HG12 ILE 609 2.611 -3.214 -2.472 61 HG13 ILE 609 HG13 ILE 609 4.035 -3.083 -1.472 62 HG21 ILE 609 HG21 ILE 609 2.575 0.056 -3.762 63 HG22 ILE 609 HG22 ILE 609 3.085 -1.587 -4.190 64 HG23 ILE 609 HG23 ILE 609 1.508 -1.306 -3.417 65 HD11 ILE 609 HD11 ILE 609 2.664 -2.344 0.440 66 HD12 ILE 609 HD12 ILE 609 1.212 -2.312 -0.593 67 HD13 ILE 609 HD13 ILE 609 2.004 -3.851 -0.238 68 H ASP 610 H ASP 610 5.369 1.236 -3.827 69 HA ASP 610 HA ASP 610 4.920 3.638 -2.192 70 HB2 ASP 610 HB2 ASP 610 6.697 3.289 -4.105 71 HB3 ASP 610 HB3 ASP 610 5.304 3.659 -5.161 72 H ILE 611 H ILE 611 3.942 5.125 -4.143 73 HA ILE 611 HA ILE 611 1.119 4.413 -4.728 74 HB ILE 611 HB ILE 611 2.526 7.085 -5.180 75 HG12 ILE 611 HG12 ILE 611 2.763 6.976 -2.870 76 HG13 ILE 611 HG13 ILE 611 1.316 7.930 -3.140 77 HG21 ILE 611 HG21 ILE 611 0.552 6.771 -6.493 78 HG22 ILE 611 HG22 ILE 611 -0.356 6.183 -5.088 79 HG23 ILE 611 HG23 ILE 611 0.161 7.904 -5.192 80 HD11 ILE 611 HD11 ILE 611 0.943 6.422 -1.317 81 HD12 ILE 611 HD12 ILE 611 -0.043 5.843 -2.701 82 HD13 ILE 611 HD13 ILE 611 1.470 5.026 -2.248 83 H ASP 612 H ASP 612 4.269 5.533 -6.073 84 HA ASP 612 HA ASP 612 3.444 5.980 -8.689 85 HB2 ASP 612 HB2 ASP 612 5.606 6.304 -9.213 86 HB3 ASP 612 HB3 ASP 612 5.756 6.392 -7.465 87 H THR 613 H THR 613 4.743 3.048 -7.330 88 HA THR 613 HA THR 613 4.730 1.341 -9.483 89 HB THR 613 HB THR 613 5.679 1.045 -7.159 90 HG1 THR 613 HG1 THR 613 4.337 -1.008 -8.548 91 HG21 THR 613 HG21 THR 613 3.101 -0.312 -6.428 92 HG22 THR 613 HG22 THR 613 3.565 1.318 -5.867 93 HG23 THR 613 HG23 THR 613 4.564 -0.091 -5.460 94 H ILE 614 H ILE 614 1.923 2.623 -8.148 95 HA ILE 614 HA ILE 614 0.160 0.432 -9.158 96 HB ILE 614 HB ILE 614 -0.328 2.697 -7.182 97 HG12 ILE 614 HG12 ILE 614 -0.606 -0.228 -6.441 98 HG13 ILE 614 HG13 ILE 614 1.012 0.418 -6.572 99 HG21 ILE 614 HG21 ILE 614 -2.394 2.218 -8.459 100 HG22 ILE 614 HG22 ILE 614 -2.282 0.511 -7.972 101 HG23 ILE 614 HG23 ILE 614 -2.534 1.769 -6.757 102 HD11 ILE 614 HD11 ILE 614 0.472 2.249 -5.036 103 HD12 ILE 614 HD12 ILE 614 -1.135 1.536 -4.768 104 HD13 ILE 614 HD13 ILE 614 0.332 0.644 -4.303 105 H MET 615 H MET 615 0.485 4.050 -8.930 106 HA MET 615 HA MET 615 -1.534 4.388 -10.956 107 HB2 MET 615 HB2 MET 615 -1.042 6.776 -10.789 108 HB3 MET 615 HB3 MET 615 -1.254 6.017 -9.221 109 HG2 MET 615 HG2 MET 615 0.507 7.566 -8.990 110 HG3 MET 615 HG3 MET 615 1.201 5.969 -8.907 111 HE1 MET 615 HE1 MET 615 0.704 9.133 -11.191 112 HE2 MET 615 HE2 MET 615 1.792 8.776 -12.555 113 HE3 MET 615 HE3 MET 615 0.297 7.839 -12.358 114 H THR 616 H THR 616 1.902 3.821 -11.217 115 HA THR 616 HA THR 616 2.223 4.852 -13.841 116 HB THR 616 HB THR 616 4.015 4.179 -12.221 117 HG1 THR 616 HG1 THR 616 5.405 3.594 -13.810 118 HG21 THR 616 HG21 THR 616 3.116 1.862 -11.675 119 HG22 THR 616 HG22 THR 616 4.829 1.914 -12.114 120 HG23 THR 616 HG23 THR 616 3.629 1.350 -13.295 121 H GLY 617 H GLY 617 0.571 1.971 -12.672 122 HA2 GLY 617 HA2 GLY 617 0.233 0.970 -15.483 123 HA3 GLY 617 HA3 GLY 617 0.405 -0.064 -14.068 124 H LYS 618 H LYS 618 -1.462 2.293 -12.793 125 HA LYS 618 HA LYS 618 -4.036 1.202 -13.803 126 HB2 LYS 618 HB2 LYS 618 -3.042 1.556 -10.949 127 HB3 LYS 618 HB3 LYS 618 -4.742 1.437 -11.321 128 HG2 LYS 618 HG2 LYS 618 -4.533 -0.787 -12.211 129 HG3 LYS 618 HG3 LYS 618 -2.770 -0.682 -12.286 130 HD2 LYS 618 HD2 LYS 618 -2.601 -0.655 -9.863 131 HD3 LYS 618 HD3 LYS 618 -4.377 -0.750 -9.707 132 HE2 LYS 618 HE2 LYS 618 -4.385 -2.918 -10.856 133 HE3 LYS 618 HE3 LYS 618 -2.650 -2.799 -11.180 134 HZ1 LYS 618 HZ1 LYS 618 -3.286 -4.251 -9.282 135 HZ2 LYS 618 HZ2 LYS 618 -3.888 -3.074 -8.485 136 HZ3 LYS 618 HZ3 LYS 618 -2.241 -3.035 -8.808 137 HA PRO 619 HA PRO 619 -5.081 5.372 -14.320 138 HB2 PRO 619 HB2 PRO 619 -7.814 5.442 -14.003 139 HB3 PRO 619 HB3 PRO 619 -7.007 4.588 -15.355 140 HG2 PRO 619 HG2 PRO 619 -7.945 3.415 -12.713 141 HG3 PRO 619 HG3 PRO 619 -8.298 2.808 -14.367 142 HD2 PRO 619 HD2 PRO 619 -6.314 1.751 -12.892 143 HD3 PRO 619 HD3 PRO 619 -6.079 2.019 -14.640 144 H LYS 620 H LYS 620 -5.850 7.359 -13.333 145 HA LYS 620 HA LYS 620 -5.022 7.806 -10.722 146 HB2 LYS 620 HB2 LYS 620 -7.193 9.369 -12.188 147 HB3 LYS 620 HB3 LYS 620 -6.218 9.958 -10.850 148 HG2 LYS 620 HG2 LYS 620 -5.156 9.231 -13.622 149 HG3 LYS 620 HG3 LYS 620 -5.549 10.850 -13.056 150 HD2 LYS 620 HD2 LYS 620 -3.812 10.657 -11.279 151 HD3 LYS 620 HD3 LYS 620 -3.355 9.060 -11.929 152 HE2 LYS 620 HE2 LYS 620 -2.852 10.078 -14.122 153 HE3 LYS 620 HE3 LYS 620 -3.375 11.661 -13.530 154 HZ1 LYS 620 HZ1 LYS 620 -0.996 11.454 -13.486 155 HZ2 LYS 620 HZ2 LYS 620 -1.066 10.135 -12.511 156 HZ3 LYS 620 HZ3 LYS 620 -1.559 11.607 -11.951 157 H SER 621 H SER 621 -8.463 7.383 -11.788 158 HA SER 621 HA SER 621 -9.384 7.573 -9.184 159 HB2 SER 621 HB2 SER 621 -10.756 6.555 -11.644 160 HB3 SER 621 HB3 SER 621 -11.561 6.747 -10.066 161 HG SER 621 HG SER 621 -10.985 8.941 -9.982 162 H ALA 622 H ALA 622 -7.810 4.827 -10.558 163 HA ALA 622 HA ALA 622 -9.088 2.759 -9.011 164 HB1 ALA 622 HB1 ALA 622 -7.518 2.189 -10.837 165 HB2 ALA 622 HB2 ALA 622 -6.180 2.940 -9.930 166 HB3 ALA 622 HB3 ALA 622 -6.995 1.514 -9.286 167 H ARG 623 H ARG 623 -6.084 4.722 -8.423 168 HA ARG 623 HA ARG 623 -6.087 3.922 -5.636 169 HB2 ARG 623 HB2 ARG 623 -4.320 5.444 -5.258 170 HB3 ARG 623 HB3 ARG 623 -3.995 4.561 -6.742 171 HG2 ARG 623 HG2 ARG 623 -4.603 6.473 -8.101 172 HG3 ARG 623 HG3 ARG 623 -5.170 7.380 -6.687 173 HD2 ARG 623 HD2 ARG 623 -2.320 6.478 -7.212 174 HD3 ARG 623 HD3 ARG 623 -2.930 8.118 -7.442 175 HE ARG 623 HE ARG 623 -2.074 6.859 -5.012 176 HH11 ARG 623 HH11 ARG 623 -4.301 9.356 -6.130 177 HH12 ARG 623 HH12 ARG 623 -4.355 10.199 -4.618 178 HH21 ARG 623 HH21 ARG 623 -2.155 7.928 -2.986 179 HH22 ARG 623 HH22 ARG 623 -3.103 9.349 -2.794 180 H GLU 624 H GLU 624 -7.530 6.746 -7.278 181 HA GLU 624 HA GLU 624 -8.231 8.247 -5.051 182 HB2 GLU 624 HB2 GLU 624 -8.689 8.653 -7.519 183 HB3 GLU 624 HB3 GLU 624 -10.078 7.547 -7.303 184 HG2 GLU 624 HG2 GLU 624 -10.845 9.247 -5.502 185 HG3 GLU 624 HG3 GLU 624 -9.745 10.358 -6.328 186 H LYS 625 H LYS 625 -9.888 5.251 -6.222 187 HA LYS 625 HA LYS 625 -11.578 5.394 -3.753 188 HB2 LYS 625 HB2 LYS 625 -13.207 4.093 -4.805 189 HB3 LYS 625 HB3 LYS 625 -12.722 5.379 -5.894 190 HG2 LYS 625 HG2 LYS 625 -11.099 3.299 -6.742 191 HG3 LYS 625 HG3 LYS 625 -12.527 2.427 -6.186 192 HD2 LYS 625 HD2 LYS 625 -12.443 4.679 -8.238 193 HD3 LYS 625 HD3 LYS 625 -12.626 2.972 -8.611 194 HE2 LYS 625 HE2 LYS 625 -14.611 4.619 -6.979 195 HE3 LYS 625 HE3 LYS 625 -14.726 4.384 -8.724 196 HZ1 LYS 625 HZ1 LYS 625 -15.035 2.035 -8.394 197 HZ2 LYS 625 HZ2 LYS 625 -16.100 2.859 -7.470 198 HZ3 LYS 625 HZ3 LYS 625 -14.770 2.186 -6.766 199 H MET 626 H MET 626 -9.043 3.317 -5.147 200 HA MET 626 HA MET 626 -9.563 1.236 -3.212 201 HB2 MET 626 HB2 MET 626 -8.090 -0.006 -4.289 202 HB3 MET 626 HB3 MET 626 -8.355 1.137 -5.563 203 HG2 MET 626 HG2 MET 626 -6.356 2.425 -4.439 204 HG3 MET 626 HG3 MET 626 -5.992 0.885 -3.720 205 HE1 MET 626 HE1 MET 626 -5.152 -1.277 -5.118 206 HE2 MET 626 HE2 MET 626 -6.729 -1.228 -5.945 207 HE3 MET 626 HE3 MET 626 -5.233 -1.354 -6.889 208 H MET 627 H MET 627 -7.532 4.192 -3.197 209 HA MET 627 HA MET 627 -6.131 3.513 -0.784 210 HB2 MET 627 HB2 MET 627 -6.799 6.205 -2.016 211 HB3 MET 627 HB3 MET 627 -5.750 5.973 -0.622 212 HG2 MET 627 HG2 MET 627 -5.245 4.667 -3.320 213 HG3 MET 627 HG3 MET 627 -4.533 6.196 -2.824 214 HE1 MET 627 HE1 MET 627 -1.675 3.374 -2.891 215 HE2 MET 627 HE2 MET 627 -3.169 3.310 -3.853 216 HE3 MET 627 HE3 MET 627 -2.274 4.842 -3.693 217 H LYS 628 H LYS 628 -9.316 4.722 -1.534 218 HA LYS 628 HA LYS 628 -10.016 5.387 1.253 219 HB2 LYS 628 HB2 LYS 628 -11.916 4.744 -1.047 220 HB3 LYS 628 HB3 LYS 628 -12.379 5.271 0.566 221 HG2 LYS 628 HG2 LYS 628 -11.094 7.385 0.243 222 HG3 LYS 628 HG3 LYS 628 -10.713 6.876 -1.407 223 HD2 LYS 628 HD2 LYS 628 -13.217 6.759 -1.872 224 HD3 LYS 628 HD3 LYS 628 -13.484 7.374 -0.236 225 HE2 LYS 628 HE2 LYS 628 -13.624 9.320 -1.503 226 HE3 LYS 628 HE3 LYS 628 -11.960 9.354 -0.906 227 HZ1 LYS 628 HZ1 LYS 628 -12.870 8.582 -3.612 228 HZ2 LYS 628 HZ2 LYS 628 -11.329 8.346 -3.103 229 HZ3 LYS 628 HZ3 LYS 628 -11.947 9.873 -3.213 230 H ILE 629 H ILE 629 -10.619 2.526 -0.876 231 HA ILE 629 HA ILE 629 -11.814 0.867 0.991 232 HB ILE 629 HB ILE 629 -9.955 0.167 -1.273 233 HG12 ILE 629 HG12 ILE 629 -12.928 -0.413 -0.934 234 HG13 ILE 629 HG13 ILE 629 -12.367 1.137 -1.555 235 HG21 ILE 629 HG21 ILE 629 -9.675 -1.674 0.297 236 HG22 ILE 629 HG22 ILE 629 -11.431 -1.775 0.554 237 HG23 ILE 629 HG23 ILE 629 -10.712 -2.210 -1.009 238 HD11 ILE 629 HD11 ILE 629 -11.760 -1.554 -2.849 239 HD12 ILE 629 HD12 ILE 629 -12.926 -0.334 -3.408 240 HD13 ILE 629 HD13 ILE 629 -11.203 0.027 -3.403 241 H ILE 630 H ILE 630 -8.221 1.100 0.562 242 HA ILE 630 HA ILE 630 -7.700 -0.682 2.741 243 HB ILE 630 HB ILE 630 -5.396 0.272 2.822 244 HG12 ILE 630 HG12 ILE 630 -4.921 1.420 0.418 245 HG13 ILE 630 HG13 ILE 630 -6.499 2.107 0.738 246 HG21 ILE 630 HG21 ILE 630 -6.020 -1.751 1.647 247 HG22 ILE 630 HG22 ILE 630 -6.531 -0.792 0.247 248 HG23 ILE 630 HG23 ILE 630 -4.812 -0.869 0.701 249 HD11 ILE 630 HD11 ILE 630 -4.684 3.576 1.502 250 HD12 ILE 630 HD12 ILE 630 -5.647 3.036 2.888 251 HD13 ILE 630 HD13 ILE 630 -4.065 2.291 2.559 252 H GLU 631 H GLU 631 -8.486 2.730 2.782 253 HA GLU 631 HA GLU 631 -7.611 3.242 5.499 254 HB2 GLU 631 HB2 GLU 631 -8.921 4.717 3.344 255 HB3 GLU 631 HB3 GLU 631 -9.826 4.916 4.842 256 HG2 GLU 631 HG2 GLU 631 -7.811 5.696 5.994 257 HG3 GLU 631 HG3 GLU 631 -6.825 5.357 4.564 258 H ILE 632 H ILE 632 -10.640 2.065 3.925 259 HA ILE 632 HA ILE 632 -12.128 1.949 6.398 260 HB ILE 632 HB ILE 632 -12.573 -0.044 4.194 261 HG12 ILE 632 HG12 ILE 632 -12.491 1.797 2.773 262 HG13 ILE 632 HG13 ILE 632 -14.177 1.500 3.051 263 HG21 ILE 632 HG21 ILE 632 -13.938 -0.162 6.247 264 HG22 ILE 632 HG22 ILE 632 -14.504 1.492 5.989 265 HG23 ILE 632 HG23 ILE 632 -14.934 0.208 4.839 266 HD11 ILE 632 HD11 ILE 632 -14.246 3.432 4.636 267 HD12 ILE 632 HD12 ILE 632 -12.527 3.749 4.288 268 HD13 ILE 632 HD13 ILE 632 -13.723 3.882 2.997 269 H ILE 633 H ILE 633 -9.903 -0.275 4.702 270 HA ILE 633 HA ILE 633 -10.465 -2.579 6.235 271 HB ILE 633 HB ILE 633 -7.933 -1.812 4.713 272 HG12 ILE 633 HG12 ILE 633 -10.519 -3.209 4.047 273 HG13 ILE 633 HG13 ILE 633 -9.730 -1.914 3.224 274 HG21 ILE 633 HG21 ILE 633 -8.650 -4.562 5.783 275 HG22 ILE 633 HG22 ILE 633 -7.251 -4.140 4.774 276 HG23 ILE 633 HG23 ILE 633 -7.368 -3.508 6.408 277 HD11 ILE 633 HD11 ILE 633 -8.048 -3.323 2.285 278 HD12 ILE 633 HD12 ILE 633 -8.746 -4.755 3.099 279 HD13 ILE 633 HD13 ILE 633 -9.669 -3.892 1.862 280 H ASP 634 H ASP 634 -7.849 -0.135 6.542 281 HA ASP 634 HA ASP 634 -7.040 -1.512 8.960 282 HB2 ASP 634 HB2 ASP 634 -5.812 0.524 7.258 283 HB3 ASP 634 HB3 ASP 634 -5.531 0.800 8.979 284 H SER 635 H SER 635 -9.195 1.161 8.337 285 HA SER 635 HA SER 635 -9.400 2.080 11.048 286 HB2 SER 635 HB2 SER 635 -10.307 3.299 9.100 287 HB3 SER 635 HB3 SER 635 -11.484 1.998 8.825 288 HG SER 635 HG SER 635 -12.297 3.798 10.030 289 H LEU 636 H LEU 636 -11.278 -0.435 9.181 290 HA LEU 636 HA LEU 636 -12.814 -1.292 11.418 291 HB2 LEU 636 HB2 LEU 636 -11.925 -2.691 8.877 292 HB3 LEU 636 HB3 LEU 636 -12.983 -3.473 10.050 293 HG LEU 636 HG LEU 636 -13.690 -0.794 8.779 294 HD11 LEU 636 HD11 LEU 636 -13.397 -2.412 6.996 295 HD12 LEU 636 HD12 LEU 636 -15.126 -2.116 7.232 296 HD13 LEU 636 HD13 LEU 636 -14.387 -3.614 7.853 297 HD21 LEU 636 HD21 LEU 636 -14.930 -1.344 10.852 298 HD22 LEU 636 HD22 LEU 636 -15.403 -2.910 10.160 299 HD23 LEU 636 HD23 LEU 636 -15.980 -1.395 9.439 300 H ALA 637 H ALA 637 -9.599 -2.389 10.261 301 HA ALA 637 HA ALA 637 -9.285 -4.441 12.222 302 HB1 ALA 637 HB1 ALA 637 -7.127 -2.778 10.877 303 HB2 ALA 637 HB2 ALA 637 -6.944 -4.374 11.637 304 HB3 ALA 637 HB3 ALA 637 -7.916 -4.208 10.158 305 H VAL 638 H VAL 638 -9.373 -0.987 12.775 306 HA VAL 638 HA VAL 638 -7.790 -1.190 15.223 307 HB VAL 638 HB VAL 638 -8.405 0.885 13.514 308 HG11 VAL 638 HG11 VAL 638 -10.724 1.138 14.542 309 HG12 VAL 638 HG12 VAL 638 -9.917 1.597 16.054 310 HG13 VAL 638 HG13 VAL 638 -9.685 2.567 14.589 311 HG21 VAL 638 HG21 VAL 638 -6.467 0.721 14.968 312 HG22 VAL 638 HG22 VAL 638 -7.247 2.300 15.136 313 HG23 VAL 638 HG23 VAL 638 -7.474 1.063 16.395 314 H SER 639 H SER 639 -10.869 -2.309 14.351 315 HA SER 639 HA SER 639 -11.531 -2.725 17.183 316 HB2 SER 639 HB2 SER 639 -13.316 -1.130 15.305 317 HB3 SER 639 HB3 SER 639 -13.851 -1.818 16.856 318 HG SER 639 HG SER 639 -11.473 -0.450 17.040 319 H SER 640 H SER 640 -10.635 -4.449 15.001 320 HA SER 640 HA SER 640 -12.297 -6.630 15.637 321 HB2 SER 640 HB2 SER 640 -12.387 -5.564 12.770 322 HB3 SER 640 HB3 SER 640 -12.741 -7.255 13.179 323 HG SER 640 HG SER 640 -13.994 -5.178 14.612 324 H GLU 641 H GLU 641 -11.191 -8.647 14.635 325 HA GLU 641 HA GLU 641 -8.367 -8.504 14.880 326 HB2 GLU 641 HB2 GLU 641 -10.108 -10.540 13.423 327 HB3 GLU 641 HB3 GLU 641 -8.434 -10.798 13.921 328 HG2 GLU 641 HG2 GLU 641 -9.069 -10.676 16.287 329 HG3 GLU 641 HG3 GLU 641 -10.746 -10.296 15.852 330 H CYS 642 H CYS 642 -10.517 -8.055 12.129 331 HA CYS 642 HA CYS 642 -8.546 -7.055 10.336 332 HB2 CYS 642 HB2 CYS 642 -9.075 -8.968 8.653 333 HB3 CYS 642 HB3 CYS 642 -7.872 -9.231 9.900 334 H ALA 643 H ALA 643 -9.688 -6.645 8.214 335 HA ALA 643 HA ALA 643 -12.297 -5.443 8.821 336 HB1 ALA 643 HB1 ALA 643 -12.028 -4.317 6.707 337 HB2 ALA 643 HB2 ALA 643 -10.509 -4.247 7.630 338 HB3 ALA 643 HB3 ALA 643 -10.671 -5.369 6.262 339 H LYS 644 H LYS 644 -13.923 -6.847 8.802 340 HA LYS 644 HA LYS 644 -14.350 -9.049 7.055 341 HB2 LYS 644 HB2 LYS 644 -16.740 -7.643 8.189 342 HB3 LYS 644 HB3 LYS 644 -16.338 -9.340 8.140 343 HG2 LYS 644 HG2 LYS 644 -16.315 -8.835 10.415 344 HG3 LYS 644 HG3 LYS 644 -14.608 -8.836 9.999 345 HD2 LYS 644 HD2 LYS 644 -14.453 -6.746 10.904 346 HD3 LYS 644 HD3 LYS 644 -15.465 -6.147 9.592 347 HE2 LYS 644 HE2 LYS 644 -16.574 -5.389 11.455 348 HE3 LYS 644 HE3 LYS 644 -17.498 -6.804 10.973 349 HZ1 LYS 644 HZ1 LYS 644 -17.107 -6.755 13.330 350 HZ2 LYS 644 HZ2 LYS 644 -15.478 -6.641 13.141 351 HZ3 LYS 644 HZ3 LYS 644 -16.266 -8.035 12.707 352 H VAL 645 H VAL 645 -14.875 -8.992 4.901 353 HA VAL 645 HA VAL 645 -15.125 -6.808 3.339 354 HB VAL 645 HB VAL 645 -14.925 -9.322 2.710 355 HG11 VAL 645 HG11 VAL 645 -17.203 -9.989 3.532 356 HG12 VAL 645 HG12 VAL 645 -17.892 -9.126 2.141 357 HG13 VAL 645 HG13 VAL 645 -16.802 -10.490 1.878 358 HG21 VAL 645 HG21 VAL 645 -15.486 -8.856 0.394 359 HG22 VAL 645 HG22 VAL 645 -16.554 -7.521 0.867 360 HG23 VAL 645 HG23 VAL 645 -14.811 -7.389 1.123 361 H LYS 646 H LYS 646 -17.717 -8.273 5.117 362 HA LYS 646 HA LYS 646 -19.967 -7.137 3.850 363 HB2 LYS 646 HB2 LYS 646 -19.437 -8.970 5.880 364 HB3 LYS 646 HB3 LYS 646 -19.970 -7.606 6.835 365 HG2 LYS 646 HG2 LYS 646 -21.740 -9.253 6.303 366 HG3 LYS 646 HG3 LYS 646 -22.135 -7.623 5.761 367 HD2 LYS 646 HD2 LYS 646 -22.736 -9.488 4.181 368 HD3 LYS 646 HD3 LYS 646 -21.842 -8.146 3.505 369 HE2 LYS 646 HE2 LYS 646 -21.074 -10.257 2.556 370 HE3 LYS 646 HE3 LYS 646 -19.771 -9.454 3.425 371 HZ1 LYS 646 HZ1 LYS 646 -19.995 -11.913 3.740 372 HZ2 LYS 646 HZ2 LYS 646 -21.314 -11.622 4.713 373 HZ3 LYS 646 HZ3 LYS 646 -19.741 -11.105 5.025 374 H ASP 647 H ASP 647 -17.824 -5.943 6.462 375 HA ASP 647 HA ASP 647 -19.476 -3.691 7.028 376 HB2 ASP 647 HB2 ASP 647 -16.564 -4.380 7.679 377 HB3 ASP 647 HB3 ASP 647 -17.355 -2.918 8.243 378 H ILE 648 H ILE 648 -16.610 -4.403 5.043 379 HA ILE 648 HA ILE 648 -16.033 -1.709 4.279 380 HB ILE 648 HB ILE 648 -15.508 -4.201 2.584 381 HG12 ILE 648 HG12 ILE 648 -13.769 -3.018 4.787 382 HG13 ILE 648 HG13 ILE 648 -14.608 -4.550 4.858 383 HG21 ILE 648 HG21 ILE 648 -13.724 -2.880 1.558 384 HG22 ILE 648 HG22 ILE 648 -15.211 -1.965 1.452 385 HG23 ILE 648 HG23 ILE 648 -14.013 -1.538 2.687 386 HD11 ILE 648 HD11 ILE 648 -13.291 -5.429 2.964 387 HD12 ILE 648 HD12 ILE 648 -12.346 -3.927 2.937 388 HD13 ILE 648 HD13 ILE 648 -12.299 -4.967 4.362 389 H LEU 649 H LEU 649 -17.957 -4.271 2.722 390 HA LEU 649 HA LEU 649 -18.888 -2.780 0.526 391 HB2 LEU 649 HB2 LEU 649 -19.975 -5.099 2.151 392 HB3 LEU 649 HB3 LEU 649 -20.897 -4.460 0.794 393 HG LEU 649 HG LEU 649 -17.980 -5.276 0.458 394 HD11 LEU 649 HD11 LEU 649 -20.431 -7.047 0.094 395 HD12 LEU 649 HD12 LEU 649 -19.187 -7.225 1.345 396 HD13 LEU 649 HD13 LEU 649 -18.762 -7.459 -0.353 397 HD21 LEU 649 HD21 LEU 649 -18.598 -5.494 -1.888 398 HD22 LEU 649 HD22 LEU 649 -19.076 -3.882 -1.328 399 HD23 LEU 649 HD23 LEU 649 -20.302 -5.137 -1.513 400 H LYS 650 H LYS 650 -20.214 -2.946 3.891 401 HA LYS 650 HA LYS 650 -22.424 -1.173 3.263 402 HB2 LYS 650 HB2 LYS 650 -22.487 -2.408 5.371 403 HB3 LYS 650 HB3 LYS 650 -21.019 -1.593 5.937 404 HG2 LYS 650 HG2 LYS 650 -22.185 0.609 5.778 405 HG3 LYS 650 HG3 LYS 650 -23.660 -0.203 5.253 406 HD2 LYS 650 HD2 LYS 650 -23.954 -1.234 7.391 407 HD3 LYS 650 HD3 LYS 650 -22.314 -0.848 7.906 408 HE2 LYS 650 HE2 LYS 650 -24.534 1.195 7.403 409 HE3 LYS 650 HE3 LYS 650 -23.985 0.605 8.980 410 HZ1 LYS 650 HZ1 LYS 650 -21.695 1.466 8.118 411 HZ2 LYS 650 HZ2 LYS 650 -22.776 2.529 8.766 412 HZ3 LYS 650 HZ3 LYS 650 -22.597 2.432 7.145 413 H GLU 651 H GLU 651 -19.274 -0.428 4.907 414 HA GLU 651 HA GLU 651 -19.917 2.317 5.033 415 HB2 GLU 651 HB2 GLU 651 -17.123 1.114 5.096 416 HB3 GLU 651 HB3 GLU 651 -17.587 2.715 5.650 417 HG2 GLU 651 HG2 GLU 651 -18.091 0.054 6.959 418 HG3 GLU 651 HG3 GLU 651 -17.344 1.492 7.617 419 H ALA 652 H ALA 652 -18.237 0.487 2.507 420 HA ALA 652 HA ALA 652 -17.402 2.904 1.117 421 HB1 ALA 652 HB1 ALA 652 -16.035 0.868 1.221 422 HB2 ALA 652 HB2 ALA 652 -17.289 0.041 0.255 423 HB3 ALA 652 HB3 ALA 652 -16.388 1.428 -0.426 424 H GLN 653 H GLN 653 -20.273 0.663 0.822 425 HA GLN 653 HA GLN 653 -20.769 1.802 -1.870 426 HB2 GLN 653 HB2 GLN 653 -22.468 0.073 -0.062 427 HB3 GLN 653 HB3 GLN 653 -23.017 0.724 -1.614 428 HG2 GLN 653 HG2 GLN 653 -21.254 -0.385 -2.844 429 HG3 GLN 653 HG3 GLN 653 -20.450 -0.922 -1.379 430 HE21 GLN 653 HE21 GLN 653 -22.025 -2.135 0.142 431 HE22 GLN 653 HE22 GLN 653 -22.996 -3.422 -0.612 432 H GLN 654 H GLN 654 -21.575 2.337 1.498 433 HA GLN 654 HA GLN 654 -23.105 4.693 1.326 434 HB2 GLN 654 HB2 GLN 654 -22.961 3.330 3.264 435 HB3 GLN 654 HB3 GLN 654 -21.213 3.364 3.251 436 HG2 GLN 654 HG2 GLN 654 -21.256 5.760 3.793 437 HG3 GLN 654 HG3 GLN 654 -23.026 5.572 4.034 438 HE21 GLN 654 HE21 GLN 654 -19.881 5.191 5.459 439 HE22 GLN 654 HE22 GLN 654 -20.303 4.077 6.760 440 H VAL 655 H VAL 655 -19.378 4.402 1.480 441 HA VAL 655 HA VAL 655 -19.128 7.201 1.139 442 HB VAL 655 HB VAL 655 -16.915 7.072 0.643 443 HG11 VAL 655 HG11 VAL 655 -16.863 4.632 2.305 444 HG12 VAL 655 HG12 VAL 655 -15.949 6.127 2.416 445 HG13 VAL 655 HG13 VAL 655 -17.646 6.110 2.924 446 HG21 VAL 655 HG21 VAL 655 -16.966 4.270 -0.355 447 HG22 VAL 655 HG22 VAL 655 -16.649 5.755 -1.246 448 HG23 VAL 655 HG23 VAL 655 -15.524 5.222 0.004 449 H GLY 656 H GLY 656 -19.824 4.794 -1.286 450 HA2 GLY 656 HA2 GLY 656 -21.256 5.753 -3.094 451 HA3 GLY 656 HA3 GLY 656 -20.030 7.005 -3.326 452 H ILE 657 H ILE 657 -19.813 3.454 -2.870 453 HA ILE 657 HA ILE 657 -18.532 3.147 -5.522 454 HB ILE 657 HB ILE 657 -17.622 1.981 -2.856 455 HG12 ILE 657 HG12 ILE 657 -16.106 3.807 -4.781 456 HG13 ILE 657 HG13 ILE 657 -16.931 4.371 -3.335 457 HG21 ILE 657 HG21 ILE 657 -15.704 1.005 -4.241 458 HG22 ILE 657 HG22 ILE 657 -17.249 0.234 -4.415 459 HG23 ILE 657 HG23 ILE 657 -16.690 1.355 -5.675 460 HD11 ILE 657 HD11 ILE 657 -14.498 2.574 -3.377 461 HD12 ILE 657 HD12 ILE 657 -14.658 4.224 -2.767 462 HD13 ILE 657 HD13 ILE 657 -15.482 2.900 -1.931 463 H GLU 658 H GLU 658 -18.573 0.445 -5.817 464 HA GLU 658 HA GLU 658 -21.320 -0.460 -5.168 465 HB2 GLU 658 HB2 GLU 658 -21.429 0.327 -7.403 466 HB3 GLU 658 HB3 GLU 658 -19.855 -0.361 -7.815 467 HG2 GLU 658 HG2 GLU 658 -22.023 -2.252 -6.961 468 HG3 GLU 658 HG3 GLU 658 -22.269 -1.429 -8.489 469 H LYS 659 H LYS 659 -21.386 -2.575 -4.620 470 HA LYS 659 HA LYS 659 -19.687 -4.227 -3.640 471 HB2 LYS 659 HB2 LYS 659 -22.114 -4.629 -4.235 472 HB3 LYS 659 HB3 LYS 659 -21.663 -4.833 -5.923 473 HG2 LYS 659 HG2 LYS 659 -20.257 -6.860 -5.075 474 HG3 LYS 659 HG3 LYS 659 -21.238 -6.703 -3.605 475 HD2 LYS 659 HD2 LYS 659 -22.118 -7.267 -6.464 476 HD3 LYS 659 HD3 LYS 659 -22.275 -8.342 -5.081 477 HE2 LYS 659 HE2 LYS 659 -23.790 -5.730 -5.547 478 HE3 LYS 659 HE3 LYS 659 -24.436 -7.357 -5.767 479 HZ1 LYS 659 HZ1 LYS 659 -25.094 -6.421 -3.662 480 HZ2 LYS 659 HZ2 LYS 659 -23.529 -6.216 -3.203 481 HZ3 LYS 659 HZ3 LYS 659 -24.136 -7.736 -3.407 482 H SER 660 H SER 660 -19.851 -4.213 -7.309 483 HA SER 660 HA SER 660 -17.905 -6.409 -7.326 484 HB2 SER 660 HB2 SER 660 -19.718 -6.109 -9.043 485 HB3 SER 660 HB3 SER 660 -18.823 -4.710 -9.676 486 HG SER 660 HG SER 660 -18.380 -6.721 -10.734 487 H ASN 661 H ASN 661 -17.897 -2.901 -7.823 488 HA ASN 661 HA ASN 661 -15.127 -2.558 -8.408 489 HB2 ASN 661 HB2 ASN 661 -17.098 -0.754 -6.985 490 HB3 ASN 661 HB3 ASN 661 -15.391 -0.418 -7.058 491 HD21 ASN 661 HD21 ASN 661 -18.148 -1.398 -9.309 492 HD22 ASN 661 HD22 ASN 661 -17.620 -0.283 -10.556 493 H ILE 662 H ILE 662 -16.770 -2.931 -5.212 494 HA ILE 662 HA ILE 662 -14.427 -2.363 -3.626 495 HB ILE 662 HB ILE 662 -16.859 -4.120 -3.009 496 HG12 ILE 662 HG12 ILE 662 -17.492 -1.791 -3.484 497 HG13 ILE 662 HG13 ILE 662 -17.809 -2.227 -1.828 498 HG21 ILE 662 HG21 ILE 662 -15.233 -4.777 -1.437 499 HG22 ILE 662 HG22 ILE 662 -14.695 -3.108 -1.147 500 HG23 ILE 662 HG23 ILE 662 -16.293 -3.654 -0.589 501 HD11 ILE 662 HD11 ILE 662 -15.820 -1.064 -1.094 502 HD12 ILE 662 HD12 ILE 662 -15.424 -0.652 -2.782 503 HD13 ILE 662 HD13 ILE 662 -16.920 -0.031 -2.049 504 H GLU 663 H GLU 663 -15.904 -5.227 -4.923 505 HA GLU 663 HA GLU 663 -14.190 -7.128 -3.617 506 HB2 GLU 663 HB2 GLU 663 -16.248 -7.268 -5.839 507 HB3 GLU 663 HB3 GLU 663 -15.396 -8.705 -5.278 508 HG2 GLU 663 HG2 GLU 663 -16.796 -6.846 -3.299 509 HG3 GLU 663 HG3 GLU 663 -17.696 -8.028 -4.199 510 H LYS 664 H LYS 664 -14.357 -5.921 -7.028 511 HA LYS 664 HA LYS 664 -12.154 -7.536 -7.821 512 HB2 LYS 664 HB2 LYS 664 -12.247 -6.497 -9.913 513 HB3 LYS 664 HB3 LYS 664 -13.904 -6.547 -9.329 514 HG2 LYS 664 HG2 LYS 664 -13.427 -4.077 -8.536 515 HG3 LYS 664 HG3 LYS 664 -12.042 -4.180 -9.631 516 HD2 LYS 664 HD2 LYS 664 -13.696 -4.854 -11.467 517 HD3 LYS 664 HD3 LYS 664 -14.994 -4.531 -10.313 518 HE2 LYS 664 HE2 LYS 664 -14.791 -2.592 -11.684 519 HE3 LYS 664 HE3 LYS 664 -14.159 -2.168 -10.089 520 HZ1 LYS 664 HZ1 LYS 664 -11.936 -2.493 -10.952 521 HZ2 LYS 664 HZ2 LYS 664 -12.743 -1.369 -11.847 522 HZ3 LYS 664 HZ3 LYS 664 -12.528 -2.889 -12.438 523 H LEU 665 H LEU 665 -12.296 -4.165 -6.530 524 HA LEU 665 HA LEU 665 -9.471 -3.713 -6.891 525 HB2 LEU 665 HB2 LEU 665 -11.644 -2.376 -5.294 526 HB3 LEU 665 HB3 LEU 665 -9.979 -2.087 -4.844 527 HG LEU 665 HG LEU 665 -9.372 -1.194 -6.959 528 HD11 LEU 665 HD11 LEU 665 -10.612 -2.573 -8.549 529 HD12 LEU 665 HD12 LEU 665 -10.922 -0.861 -8.847 530 HD13 LEU 665 HD13 LEU 665 -12.150 -1.845 -8.015 531 HD21 LEU 665 HD21 LEU 665 -10.531 0.355 -5.447 532 HD22 LEU 665 HD22 LEU 665 -12.091 -0.070 -6.173 533 HD23 LEU 665 HD23 LEU 665 -10.839 0.772 -7.127 534 H LEU 666 H LEU 666 -11.307 -4.729 -3.866 535 HA LEU 666 HA LEU 666 -8.834 -5.176 -2.524 536 HB2 LEU 666 HB2 LEU 666 -10.026 -6.197 -0.760 537 HB3 LEU 666 HB3 LEU 666 -10.891 -4.800 -1.356 538 HG LEU 666 HG LEU 666 -12.350 -6.487 -2.682 539 HD11 LEU 666 HD11 LEU 666 -12.611 -8.691 -1.434 540 HD12 LEU 666 HD12 LEU 666 -10.970 -8.399 -0.796 541 HD13 LEU 666 HD13 LEU 666 -11.258 -8.580 -2.536 542 HD21 LEU 666 HD21 LEU 666 -13.824 -6.746 -0.790 543 HD22 LEU 666 HD22 LEU 666 -13.036 -5.168 -0.677 544 HD23 LEU 666 HD23 LEU 666 -12.478 -6.500 0.356 545 H THR 667 H THR 667 -10.521 -7.250 -4.822 546 HA THR 667 HA THR 667 -8.998 -9.597 -4.223 547 HB THR 667 HB THR 667 -10.390 -8.781 -6.785 548 HG1 THR 667 HG1 THR 667 -11.815 -8.974 -5.221 549 HG21 THR 667 HG21 THR 667 -8.770 -10.530 -7.305 550 HG22 THR 667 HG22 THR 667 -10.394 -11.229 -7.262 551 HG23 THR 667 HG23 THR 667 -9.286 -11.485 -5.892 552 H ASP 668 H ASP 668 -8.384 -6.782 -6.416 553 HA ASP 668 HA ASP 668 -5.941 -7.840 -7.534 554 HB2 ASP 668 HB2 ASP 668 -7.003 -6.109 -8.716 555 HB3 ASP 668 HB3 ASP 668 -7.254 -5.124 -7.285 556 H MET 669 H MET 669 -6.828 -5.926 -4.663 557 HA MET 669 HA MET 669 -4.196 -5.471 -3.734 558 HB2 MET 669 HB2 MET 669 -6.723 -5.815 -2.072 559 HB3 MET 669 HB3 MET 669 -5.202 -5.119 -1.538 560 HG2 MET 669 HG2 MET 669 -5.468 -3.481 -3.499 561 HG3 MET 669 HG3 MET 669 -7.119 -4.005 -3.568 562 HE1 MET 669 HE1 MET 669 -6.747 -1.351 -3.436 563 HE2 MET 669 HE2 MET 669 -6.847 -0.446 -1.908 564 HE3 MET 669 HE3 MET 669 -5.297 -1.137 -2.439 565 H ARG 670 H ARG 670 -6.448 -8.114 -2.615 566 HA ARG 670 HA ARG 670 -4.372 -9.267 -0.980 567 HB2 ARG 670 HB2 ARG 670 -5.866 -11.117 -0.532 568 HB3 ARG 670 HB3 ARG 670 -6.765 -9.624 -0.448 569 HG2 ARG 670 HG2 ARG 670 -7.552 -9.998 -2.798 570 HG3 ARG 670 HG3 ARG 670 -6.740 -11.558 -2.825 571 HD2 ARG 670 HD2 ARG 670 -8.151 -12.479 -1.207 572 HD3 ARG 670 HD3 ARG 670 -8.689 -10.890 -0.657 573 HE ARG 670 HE ARG 670 -9.431 -11.152 -3.369 574 HH11 ARG 670 HH11 ARG 670 -10.567 -12.685 -0.368 575 HH12 ARG 670 HH12 ARG 670 -12.224 -12.643 -0.869 576 HH21 ARG 670 HH21 ARG 670 -11.635 -10.861 -3.887 577 HH22 ARG 670 HH22 ARG 670 -12.850 -11.345 -2.768 578 H LYS 671 H LYS 671 -5.232 -9.694 -4.401 579 HA LYS 671 HA LYS 671 -3.535 -11.987 -4.672 580 HB2 LYS 671 HB2 LYS 671 -4.700 -10.001 -6.671 581 HB3 LYS 671 HB3 LYS 671 -3.548 -11.239 -7.174 582 HG2 LYS 671 HG2 LYS 671 -4.976 -13.027 -6.313 583 HG3 LYS 671 HG3 LYS 671 -6.174 -11.853 -5.747 584 HD2 LYS 671 HD2 LYS 671 -6.538 -11.070 -8.056 585 HD3 LYS 671 HD3 LYS 671 -5.316 -12.192 -8.664 586 HE2 LYS 671 HE2 LYS 671 -7.868 -13.010 -7.200 587 HE3 LYS 671 HE3 LYS 671 -7.686 -12.981 -8.960 588 HZ1 LYS 671 HZ1 LYS 671 -7.325 -15.181 -8.075 589 HZ2 LYS 671 HZ2 LYS 671 -6.097 -14.650 -7.118 590 HZ3 LYS 671 HZ3 LYS 671 -5.937 -14.619 -8.755 591 H SER 672 H SER 672 -3.035 -8.437 -5.258 592 HA SER 672 HA SER 672 -0.311 -8.814 -6.128 593 HB2 SER 672 HB2 SER 672 -1.771 -6.974 -6.939 594 HB3 SER 672 HB3 SER 672 -1.802 -6.291 -5.301 595 HG SER 672 HG SER 672 0.642 -6.464 -5.592 596 H GLY 673 H GLY 673 -1.733 -8.594 -2.972 597 HA2 GLY 673 HA2 GLY 673 -0.584 -9.124 -0.998 598 HA3 GLY 673 HA3 GLY 673 0.966 -8.778 -1.786 599 H ILE 674 H ILE 674 -1.750 -6.571 -2.056 600 HA ILE 674 HA ILE 674 -0.377 -4.417 -0.546 601 HB ILE 674 HB ILE 674 -3.096 -4.652 -1.938 602 HG12 ILE 674 HG12 ILE 674 -0.486 -3.467 -2.884 603 HG13 ILE 674 HG13 ILE 674 -1.386 -4.800 -3.569 604 HG21 ILE 674 HG21 ILE 674 -1.896 -2.100 -0.816 605 HG22 ILE 674 HG22 ILE 674 -3.431 -2.257 -1.710 606 HG23 ILE 674 HG23 ILE 674 -3.278 -2.985 -0.140 607 HD11 ILE 674 HD11 ILE 674 -2.231 -1.889 -3.672 608 HD12 ILE 674 HD12 ILE 674 -1.681 -2.915 -5.006 609 HD13 ILE 674 HD13 ILE 674 -3.231 -3.261 -4.218 610 H ILE 675 H ILE 675 -3.033 -6.734 -0.277 611 HA ILE 675 HA ILE 675 -3.113 -6.267 2.613 612 HB ILE 675 HB ILE 675 -5.486 -6.394 2.770 613 HG12 ILE 675 HG12 ILE 675 -5.483 -6.986 -0.187 614 HG13 ILE 675 HG13 ILE 675 -6.035 -8.020 1.125 615 HG21 ILE 675 HG21 ILE 675 -5.068 -4.415 0.502 616 HG22 ILE 675 HG22 ILE 675 -6.196 -4.327 1.858 617 HG23 ILE 675 HG23 ILE 675 -4.478 -4.135 2.128 618 HD11 ILE 675 HD11 ILE 675 -7.940 -7.169 -0.037 619 HD12 ILE 675 HD12 ILE 675 -7.891 -6.418 1.570 620 HD13 ILE 675 HD13 ILE 675 -7.397 -5.491 0.140 621 H TYR 676 H TYR 676 -4.308 -8.319 3.555 622 HA TYR 676 HA TYR 676 -4.190 -10.677 1.782 623 HB2 TYR 676 HB2 TYR 676 -3.059 -11.991 3.518 624 HB3 TYR 676 HB3 TYR 676 -2.016 -10.667 2.997 625 HD1 TYR 676 HD2 TYR 676 -1.796 -8.602 4.501 626 HD2 TYR 676 HD1 TYR 676 -3.611 -12.281 5.826 627 HE1 TYR 676 HE2 TYR 676 -1.510 -7.888 6.851 628 HE2 TYR 676 HE1 TYR 676 -3.327 -11.585 8.172 629 HH TYR 676 HH TYR 676 -2.546 -9.912 9.616 630 H GLU 677 H GLU 677 -5.493 -12.451 2.722 631 HA GLU 677 HA GLU 677 -7.630 -11.439 4.430 632 HB2 GLU 677 HB2 GLU 677 -7.365 -13.735 2.554 633 HB3 GLU 677 HB3 GLU 677 -8.208 -14.121 4.080 634 HG2 GLU 677 HG2 GLU 677 -9.692 -12.246 3.853 635 HG3 GLU 677 HG3 GLU 677 -8.753 -11.642 2.488 636 H ALA 678 H ALA 678 -7.367 -11.596 6.586 637 HA ALA 678 HA ALA 678 -5.287 -13.336 7.702 638 HB1 ALA 678 HB1 ALA 678 -5.689 -11.067 8.677 639 HB2 ALA 678 HB2 ALA 678 -7.359 -11.545 9.046 640 HB3 ALA 678 HB3 ALA 678 -6.012 -12.354 9.867 641 H LYS 679 H LYS 679 -8.773 -13.145 7.309 642 HA LYS 679 HA LYS 679 -9.071 -15.986 7.825 643 HB2 LYS 679 HB2 LYS 679 -10.833 -13.892 9.219 644 HB3 LYS 679 HB3 LYS 679 -11.174 -15.606 9.168 645 HG2 LYS 679 HG2 LYS 679 -9.022 -16.042 10.392 646 HG3 LYS 679 HG3 LYS 679 -8.793 -14.286 10.523 647 HD2 LYS 679 HD2 LYS 679 -10.982 -14.118 11.723 648 HD3 LYS 679 HD3 LYS 679 -11.095 -15.897 11.699 649 HE2 LYS 679 HE2 LYS 679 -8.922 -16.028 12.929 650 HE3 LYS 679 HE3 LYS 679 -8.825 -14.259 12.910 651 HZ1 LYS 679 HZ1 LYS 679 -10.914 -14.214 14.187 652 HZ2 LYS 679 HZ2 LYS 679 -9.685 -14.712 14.970 653 HZ3 LYS 679 HZ3 LYS 679 -10.786 -15.870 14.427 654 HA PRO 680 HA PRO 680 -11.553 -15.302 4.147 655 HB2 PRO 680 HB2 PRO 680 -13.938 -16.672 4.609 656 HB3 PRO 680 HB3 PRO 680 -12.408 -17.417 4.053 657 HG2 PRO 680 HG2 PRO 680 -13.491 -17.237 6.874 658 HG3 PRO 680 HG3 PRO 680 -12.748 -18.650 6.057 659 HD2 PRO 680 HD2 PRO 680 -11.305 -17.140 7.760 660 HD3 PRO 680 HD3 PRO 680 -10.557 -17.699 6.243 661 H GLU 681 H GLU 681 -12.574 -13.724 3.403 662 HA GLU 681 HA GLU 681 -13.816 -11.881 3.118 663 HB2 GLU 681 HB2 GLU 681 -15.289 -12.619 5.680 664 HB3 GLU 681 HB3 GLU 681 -15.580 -11.190 4.710 665 HG2 GLU 681 HG2 GLU 681 -16.109 -12.756 2.765 666 HG3 GLU 681 HG3 GLU 681 -16.182 -14.048 3.970 667 H CYS 682 H CYS 682 -11.529 -12.372 5.568 668 HA CYS 682 HA CYS 682 -12.043 -9.713 6.804 669 HB2 CYS 682 HB2 CYS 682 -12.561 -11.935 7.954 670 HB3 CYS 682 HB3 CYS 682 -10.817 -12.125 8.087 671 H TYR 683 H TYR 683 -10.691 -8.382 5.788 672 HA TYR 683 HA TYR 683 -8.060 -9.309 4.958 673 HB2 TYR 683 HB2 TYR 683 -9.365 -6.599 4.579 674 HB3 TYR 683 HB3 TYR 683 -7.983 -7.240 3.686 675 HD1 TYR 683 HD2 TYR 683 -8.359 -9.369 2.255 676 HD2 TYR 683 HD1 TYR 683 -11.568 -7.011 3.887 677 HE1 TYR 683 HE2 TYR 683 -10.003 -10.604 0.866 678 HE2 TYR 683 HE1 TYR 683 -13.169 -8.174 2.469 679 HH TYR 683 HH TYR 683 -12.165 -10.884 0.312 680 H LYS 684 H LYS 684 -6.011 -8.148 5.319 681 HA LYS 684 HA LYS 684 -6.264 -5.723 6.967 682 HB2 LYS 684 HB2 LYS 684 -5.330 -8.150 8.123 683 HB3 LYS 684 HB3 LYS 684 -3.899 -7.193 7.875 684 HG2 LYS 684 HG2 LYS 684 -6.441 -6.307 9.332 685 HG3 LYS 684 HG3 LYS 684 -4.979 -6.886 10.119 686 HD2 LYS 684 HD2 LYS 684 -5.339 -4.330 8.533 687 HD3 LYS 684 HD3 LYS 684 -5.034 -4.460 10.260 688 HE2 LYS 684 HE2 LYS 684 -2.757 -5.120 9.956 689 HE3 LYS 684 HE3 LYS 684 -3.021 -5.495 8.250 690 HZ1 LYS 684 HZ1 LYS 684 -3.610 -3.014 8.078 691 HZ2 LYS 684 HZ2 LYS 684 -2.044 -3.524 8.052 692 HZ3 LYS 684 HZ3 LYS 684 -2.785 -2.793 9.391 693 H LYS 685 H LYS 685 -4.713 -4.151 6.462 694 HA LYS 685 HA LYS 685 -3.475 -4.514 3.872 695 HB2 LYS 685 HB2 LYS 685 -4.679 -2.435 4.803 696 HB3 LYS 685 HB3 LYS 685 -3.199 -2.088 5.699 697 HG2 LYS 685 HG2 LYS 685 -3.090 -2.538 2.710 698 HG3 LYS 685 HG3 LYS 685 -3.712 -1.023 3.329 699 HD2 LYS 685 HD2 LYS 685 -1.691 -0.324 4.220 700 HD3 LYS 685 HD3 LYS 685 -1.031 -1.957 4.313 701 HE2 LYS 685 HE2 LYS 685 -1.099 -2.080 1.798 702 HE3 LYS 685 HE3 LYS 685 -1.567 -0.374 1.762 703 HZ1 LYS 685 HZ1 LYS 685 0.896 -1.491 2.976 704 HZ2 LYS 685 HZ2 LYS 685 0.538 0.115 2.898 705 HZ3 LYS 685 HZ3 LYS 685 0.848 -0.736 1.510 706 H VAL 686 H VAL 686 -1.284 -4.478 3.292 707 HA VAL 686 HA VAL 686 0.710 -4.556 5.462 708 HB VAL 686 HB VAL 686 0.166 -6.834 5.163 709 HG11 VAL 686 HG11 VAL 686 0.480 -6.505 2.170 710 HG12 VAL 686 HG12 VAL 686 0.347 -8.065 3.008 711 HG13 VAL 686 HG13 VAL 686 -0.988 -6.914 3.051 712 HG21 VAL 686 HG21 VAL 686 2.519 -6.373 5.439 713 HG22 VAL 686 HG22 VAL 686 2.290 -7.801 4.404 714 HG23 VAL 686 HG23 VAL 686 2.750 -6.240 3.695 Start of MODEL 12 1 H1 GLY 600 H1 GLY 600 22.992 5.242 10.299 2 H2 GLY 600 H2 GLY 600 21.663 5.022 11.261 3 H3 GLY 600 H3 GLY 600 22.398 3.723 10.587 4 HA2 GLY 600 HA2 GLY 600 20.972 5.835 9.130 5 HA3 GLY 600 HA3 GLY 600 21.802 4.451 8.382 6 H SER 601 H SER 601 19.113 4.770 7.839 7 HA SER 601 HA SER 601 17.266 3.734 9.642 8 HB2 SER 601 HB2 SER 601 16.727 4.965 7.565 9 HB3 SER 601 HB3 SER 601 17.259 3.576 6.598 10 HG SER 601 HG SER 601 15.085 3.635 8.437 11 H HIS 602 H HIS 602 19.182 1.978 7.239 12 HA HIS 602 HA HIS 602 19.659 -0.091 6.754 13 HB2 HIS 602 HB2 HIS 602 20.808 -1.299 8.401 14 HB3 HIS 602 HB3 HIS 602 21.076 0.412 8.674 15 HD1 HIS 602 HD1 HIS 602 19.713 1.455 10.901 16 HD2 HIS 602 HD2 HIS 602 19.856 -2.731 10.383 17 HE1 HIS 602 HE1 HIS 602 19.131 0.402 13.164 18 H MET 603 H MET 603 16.645 0.054 8.288 19 HA MET 603 HA MET 603 15.929 -2.746 7.925 20 HB2 MET 603 HB2 MET 603 14.257 -0.191 8.027 21 HB3 MET 603 HB3 MET 603 13.598 -1.826 8.060 22 HG2 MET 603 HG2 MET 603 15.396 -0.610 10.194 23 HG3 MET 603 HG3 MET 603 13.652 -0.805 10.269 24 HE1 MET 603 HE1 MET 603 17.045 -2.917 9.877 25 HE2 MET 603 HE2 MET 603 16.864 -2.120 11.456 26 HE3 MET 603 HE3 MET 603 16.809 -3.892 11.342 27 H GLY 604 H GLY 604 14.165 -3.337 6.297 28 HA2 GLY 604 HA2 GLY 604 13.733 -1.676 4.019 29 HA3 GLY 604 HA3 GLY 604 14.581 -3.198 3.628 30 H GLU 605 H GLU 605 11.815 -2.687 2.776 31 HA GLU 605 HA GLU 605 10.424 -4.870 4.008 32 HB2 GLU 605 HB2 GLU 605 10.127 -2.808 5.554 33 HB3 GLU 605 HB3 GLU 605 9.168 -2.099 4.255 34 HG2 GLU 605 HG2 GLU 605 7.497 -3.847 4.473 35 HG3 GLU 605 HG3 GLU 605 8.582 -4.846 5.444 36 H SER 606 H SER 606 7.996 -4.666 2.917 37 HA SER 606 HA SER 606 8.319 -3.984 0.051 38 HB2 SER 606 HB2 SER 606 7.417 -6.659 1.211 39 HB3 SER 606 HB3 SER 606 7.372 -6.217 -0.505 40 HG SER 606 HG SER 606 9.252 -7.430 0.125 41 H GLY 607 H GLY 607 6.058 -4.358 -1.052 42 HA2 GLY 607 HA2 GLY 607 3.758 -4.199 -1.098 43 HA3 GLY 607 HA3 GLY 607 3.719 -4.223 0.664 44 H LYS 608 H LYS 608 5.850 -1.786 -0.048 45 HA LYS 608 HA LYS 608 4.012 0.318 0.574 46 HB2 LYS 608 HB2 LYS 608 6.446 0.259 1.168 47 HB3 LYS 608 HB3 LYS 608 6.851 0.540 -0.519 48 HG2 LYS 608 HG2 LYS 608 4.888 2.529 0.359 49 HG3 LYS 608 HG3 LYS 608 6.168 2.424 1.554 50 HD2 LYS 608 HD2 LYS 608 6.655 4.171 -0.046 51 HD3 LYS 608 HD3 LYS 608 7.870 2.883 -0.194 52 HE2 LYS 608 HE2 LYS 608 6.800 2.015 -2.200 53 HE3 LYS 608 HE3 LYS 608 5.385 3.042 -1.945 54 HZ1 LYS 608 HZ1 LYS 608 6.703 3.950 -3.638 55 HZ2 LYS 608 HZ2 LYS 608 8.057 4.106 -2.641 56 HZ3 LYS 608 HZ3 LYS 608 6.599 4.950 -2.466 57 H ILE 609 H ILE 609 2.405 0.656 -0.861 58 HA ILE 609 HA ILE 609 2.922 1.162 -3.727 59 HB ILE 609 HB ILE 609 0.572 0.613 -1.960 60 HG12 ILE 609 HG12 ILE 609 -0.233 -0.551 -4.018 61 HG13 ILE 609 HG13 ILE 609 1.177 0.037 -4.895 62 HG21 ILE 609 HG21 ILE 609 0.047 2.283 -4.436 63 HG22 ILE 609 HG22 ILE 609 -1.141 1.510 -3.377 64 HG23 ILE 609 HG23 ILE 609 -0.161 2.829 -2.750 65 HD11 ILE 609 HD11 ILE 609 2.653 -1.312 -3.435 66 HD12 ILE 609 HD12 ILE 609 1.239 -1.819 -2.476 67 HD13 ILE 609 HD13 ILE 609 1.396 -2.319 -4.171 68 H ASP 610 H ASP 610 1.761 3.381 -4.462 69 HA ASP 610 HA ASP 610 2.439 5.597 -2.644 70 HB2 ASP 610 HB2 ASP 610 3.257 5.430 -5.581 71 HB3 ASP 610 HB3 ASP 610 3.364 6.869 -4.574 72 H ILE 611 H ILE 611 1.530 7.651 -3.827 73 HA ILE 611 HA ILE 611 -1.204 7.196 -4.868 74 HB ILE 611 HB ILE 611 0.497 9.653 -4.229 75 HG12 ILE 611 HG12 ILE 611 -1.523 10.240 -2.807 76 HG13 ILE 611 HG13 ILE 611 -2.175 8.638 -3.134 77 HG21 ILE 611 HG21 ILE 611 -2.139 9.560 -5.722 78 HG22 ILE 611 HG22 ILE 611 -1.512 11.029 -4.925 79 HG23 ILE 611 HG23 ILE 611 -0.609 10.296 -6.240 80 HD11 ILE 611 HD11 ILE 611 0.514 9.168 -1.783 81 HD12 ILE 611 HD12 ILE 611 -1.013 8.926 -0.913 82 HD13 ILE 611 HD13 ILE 611 -0.347 7.609 -1.880 83 H ASP 612 H ASP 612 1.949 8.453 -5.813 84 HA ASP 612 HA ASP 612 1.558 9.366 -8.297 85 HB2 ASP 612 HB2 ASP 612 4.018 7.969 -7.180 86 HB3 ASP 612 HB3 ASP 612 3.998 9.166 -8.485 87 H THR 613 H THR 613 2.638 6.098 -7.445 88 HA THR 613 HA THR 613 2.976 4.959 -9.976 89 HB THR 613 HB THR 613 3.585 4.119 -7.648 90 HG1 THR 613 HG1 THR 613 4.031 2.765 -9.282 91 HG21 THR 613 HG21 THR 613 2.177 2.647 -6.446 92 HG22 THR 613 HG22 THR 613 0.879 2.787 -7.644 93 HG23 THR 613 HG23 THR 613 1.326 4.190 -6.647 94 H ILE 614 H ILE 614 0.000 5.795 -8.377 95 HA ILE 614 HA ILE 614 -1.642 4.112 -10.134 96 HB ILE 614 HB ILE 614 -2.543 6.100 -8.014 97 HG12 ILE 614 HG12 ILE 614 -1.103 4.459 -6.925 98 HG13 ILE 614 HG13 ILE 614 -2.772 4.290 -6.442 99 HG21 ILE 614 HG21 ILE 614 -4.629 4.763 -8.038 100 HG22 ILE 614 HG22 ILE 614 -4.313 5.620 -9.553 101 HG23 ILE 614 HG23 ILE 614 -4.018 3.872 -9.446 102 HD11 ILE 614 HD11 ILE 614 -3.039 2.376 -7.995 103 HD12 ILE 614 HD12 ILE 614 -1.343 2.561 -8.499 104 HD13 ILE 614 HD13 ILE 614 -1.725 2.120 -6.821 105 H MET 615 H MET 615 -1.415 7.526 -9.197 106 HA MET 615 HA MET 615 -3.167 8.258 -11.339 107 HB2 MET 615 HB2 MET 615 -2.861 10.580 -10.635 108 HB3 MET 615 HB3 MET 615 -3.183 9.498 -9.293 109 HG2 MET 615 HG2 MET 615 -1.569 11.095 -8.581 110 HG3 MET 615 HG3 MET 615 -0.797 9.526 -8.667 111 HE1 MET 615 HE1 MET 615 0.042 13.007 -11.629 112 HE2 MET 615 HE2 MET 615 -1.452 12.056 -11.741 113 HE3 MET 615 HE3 MET 615 -1.151 13.084 -10.314 114 H THR 616 H THR 616 0.254 7.852 -11.362 115 HA THR 616 HA THR 616 0.871 9.587 -13.485 116 HB THR 616 HB THR 616 2.567 8.451 -12.093 117 HG1 THR 616 HG1 THR 616 2.609 8.254 -14.892 118 HG21 THR 616 HG21 THR 616 3.262 6.174 -12.501 119 HG22 THR 616 HG22 THR 616 2.081 5.965 -13.808 120 HG23 THR 616 HG23 THR 616 1.530 6.126 -12.133 121 H GLY 617 H GLY 617 -1.191 6.915 -13.598 122 HA2 GLY 617 HA2 GLY 617 -1.506 7.263 -16.486 123 HA3 GLY 617 HA3 GLY 617 -0.931 5.655 -16.046 124 H LYS 618 H LYS 618 -2.936 6.626 -13.460 125 HA LYS 618 HA LYS 618 -5.368 5.530 -14.771 126 HB2 LYS 618 HB2 LYS 618 -4.226 5.130 -11.972 127 HB3 LYS 618 HB3 LYS 618 -5.916 4.990 -12.286 128 HG2 LYS 618 HG2 LYS 618 -5.129 2.777 -12.390 129 HG3 LYS 618 HG3 LYS 618 -5.448 3.251 -14.052 130 HD2 LYS 618 HD2 LYS 618 -3.408 1.984 -14.022 131 HD3 LYS 618 HD3 LYS 618 -2.978 3.652 -14.360 132 HE2 LYS 618 HE2 LYS 618 -2.740 3.734 -11.691 133 HE3 LYS 618 HE3 LYS 618 -2.511 1.991 -11.877 134 HZ1 LYS 618 HZ1 LYS 618 -0.936 4.146 -13.138 135 HZ2 LYS 618 HZ2 LYS 618 -0.664 2.527 -13.402 136 HZ3 LYS 618 HZ3 LYS 618 -0.408 3.225 -11.922 137 HA PRO 619 HA PRO 619 -7.146 9.413 -13.806 138 HB2 PRO 619 HB2 PRO 619 -9.784 8.858 -13.267 139 HB3 PRO 619 HB3 PRO 619 -9.058 8.710 -14.896 140 HG2 PRO 619 HG2 PRO 619 -9.463 6.510 -12.834 141 HG3 PRO 619 HG3 PRO 619 -9.933 6.495 -14.566 142 HD2 PRO 619 HD2 PRO 619 -7.628 5.358 -13.736 143 HD3 PRO 619 HD3 PRO 619 -7.669 6.291 -15.261 144 H LYS 620 H LYS 620 -8.109 10.756 -12.149 145 HA LYS 620 HA LYS 620 -7.188 10.374 -9.548 146 HB2 LYS 620 HB2 LYS 620 -8.731 12.215 -8.908 147 HB3 LYS 620 HB3 LYS 620 -7.718 12.566 -10.292 148 HG2 LYS 620 HG2 LYS 620 -9.453 12.997 -11.621 149 HG3 LYS 620 HG3 LYS 620 -10.251 11.478 -11.259 150 HD2 LYS 620 HD2 LYS 620 -10.436 13.970 -9.511 151 HD3 LYS 620 HD3 LYS 620 -11.623 13.484 -10.737 152 HE2 LYS 620 HE2 LYS 620 -11.962 11.312 -9.537 153 HE3 LYS 620 HE3 LYS 620 -10.836 11.840 -8.290 154 HZ1 LYS 620 HZ1 LYS 620 -13.454 13.052 -8.895 155 HZ2 LYS 620 HZ2 LYS 620 -12.366 13.643 -7.772 156 HZ3 LYS 620 HZ3 LYS 620 -12.994 12.161 -7.578 157 H SER 621 H SER 621 -10.317 9.242 -10.888 158 HA SER 621 HA SER 621 -11.655 8.644 -8.480 159 HB2 SER 621 HB2 SER 621 -12.819 6.990 -10.053 160 HB3 SER 621 HB3 SER 621 -12.929 8.727 -10.383 161 HG SER 621 HG SER 621 -12.426 7.535 -12.260 162 H ALA 622 H ALA 622 -9.043 6.923 -10.234 163 HA ALA 622 HA ALA 622 -9.556 4.327 -9.147 164 HB1 ALA 622 HB1 ALA 622 -7.298 3.780 -9.925 165 HB2 ALA 622 HB2 ALA 622 -8.182 4.687 -11.167 166 HB3 ALA 622 HB3 ALA 622 -6.937 5.497 -10.188 167 H ARG 623 H ARG 623 -6.989 6.722 -8.264 168 HA ARG 623 HA ARG 623 -6.442 5.449 -5.725 169 HB2 ARG 623 HB2 ARG 623 -5.209 7.390 -5.112 170 HB3 ARG 623 HB3 ARG 623 -4.883 7.067 -6.814 171 HG2 ARG 623 HG2 ARG 623 -6.580 8.841 -7.398 172 HG3 ARG 623 HG3 ARG 623 -6.713 9.228 -5.660 173 HD2 ARG 623 HD2 ARG 623 -4.313 9.763 -5.617 174 HD3 ARG 623 HD3 ARG 623 -4.171 9.320 -7.324 175 HE ARG 623 HE ARG 623 -5.026 11.320 -7.955 176 HH11 ARG 623 HH11 ARG 623 -5.646 10.984 -4.490 177 HH12 ARG 623 HH12 ARG 623 -6.133 12.625 -4.250 178 HH21 ARG 623 HH21 ARG 623 -5.656 13.522 -7.660 179 HH22 ARG 623 HH22 ARG 623 -6.145 14.086 -6.108 180 H GLU 624 H GLU 624 -8.805 8.006 -6.632 181 HA GLU 624 HA GLU 624 -9.611 8.620 -4.012 182 HB2 GLU 624 HB2 GLU 624 -10.201 10.067 -5.735 183 HB3 GLU 624 HB3 GLU 624 -10.830 8.757 -6.716 184 HG2 GLU 624 HG2 GLU 624 -12.850 8.579 -5.398 185 HG3 GLU 624 HG3 GLU 624 -12.233 9.828 -4.304 186 H LYS 625 H LYS 625 -10.379 5.713 -5.855 187 HA LYS 625 HA LYS 625 -12.153 4.928 -3.565 188 HB2 LYS 625 HB2 LYS 625 -12.992 3.106 -4.786 189 HB3 LYS 625 HB3 LYS 625 -13.181 4.594 -5.709 190 HG2 LYS 625 HG2 LYS 625 -11.195 3.875 -7.107 191 HG3 LYS 625 HG3 LYS 625 -11.190 2.335 -6.224 192 HD2 LYS 625 HD2 LYS 625 -13.493 1.871 -6.986 193 HD3 LYS 625 HD3 LYS 625 -13.567 3.467 -7.767 194 HE2 LYS 625 HE2 LYS 625 -11.592 2.792 -9.180 195 HE3 LYS 625 HE3 LYS 625 -11.729 1.155 -8.515 196 HZ1 LYS 625 HZ1 LYS 625 -13.872 2.560 -9.998 197 HZ2 LYS 625 HZ2 LYS 625 -13.948 1.001 -9.487 198 HZ3 LYS 625 HZ3 LYS 625 -12.875 1.430 -10.648 199 H MET 626 H MET 626 -9.112 3.847 -5.206 200 HA MET 626 HA MET 626 -8.741 1.491 -3.643 201 HB2 MET 626 HB2 MET 626 -6.737 3.410 -4.912 202 HB3 MET 626 HB3 MET 626 -6.304 1.867 -4.181 203 HG2 MET 626 HG2 MET 626 -7.657 0.671 -5.795 204 HG3 MET 626 HG3 MET 626 -8.222 2.173 -6.515 205 HE1 MET 626 HE1 MET 626 -4.543 0.999 -5.358 206 HE2 MET 626 HE2 MET 626 -5.376 -0.398 -6.080 207 HE3 MET 626 HE3 MET 626 -3.988 0.339 -6.908 208 H MET 627 H MET 627 -7.686 4.857 -3.182 209 HA MET 627 HA MET 627 -6.140 4.376 -0.881 210 HB2 MET 627 HB2 MET 627 -5.619 6.600 -0.960 211 HB3 MET 627 HB3 MET 627 -5.952 6.195 -2.627 212 HG2 MET 627 HG2 MET 627 -7.080 8.086 -2.685 213 HG3 MET 627 HG3 MET 627 -8.378 7.202 -1.918 214 HE1 MET 627 HE1 MET 627 -5.506 10.232 0.107 215 HE2 MET 627 HE2 MET 627 -4.916 8.646 -0.420 216 HE3 MET 627 HE3 MET 627 -5.517 9.812 -1.622 217 H LYS 628 H LYS 628 -9.483 5.238 -1.412 218 HA LYS 628 HA LYS 628 -10.131 5.656 1.426 219 HB2 LYS 628 HB2 LYS 628 -11.875 5.041 -0.994 220 HB3 LYS 628 HB3 LYS 628 -12.516 5.071 0.656 221 HG2 LYS 628 HG2 LYS 628 -11.736 7.397 0.960 222 HG3 LYS 628 HG3 LYS 628 -11.083 7.380 -0.691 223 HD2 LYS 628 HD2 LYS 628 -13.443 6.800 -1.498 224 HD3 LYS 628 HD3 LYS 628 -14.008 7.036 0.159 225 HE2 LYS 628 HE2 LYS 628 -14.421 8.990 -1.288 226 HE3 LYS 628 HE3 LYS 628 -13.384 9.396 0.092 227 HZ1 LYS 628 HZ1 LYS 628 -11.527 9.448 -1.286 228 HZ2 LYS 628 HZ2 LYS 628 -12.677 10.209 -2.202 229 HZ3 LYS 628 HZ3 LYS 628 -12.245 8.630 -2.508 230 H ILE 629 H ILE 629 -10.449 2.842 -0.838 231 HA ILE 629 HA ILE 629 -11.533 1.060 1.023 232 HB ILE 629 HB ILE 629 -9.743 0.574 -1.370 233 HG12 ILE 629 HG12 ILE 629 -12.682 -0.156 -1.038 234 HG13 ILE 629 HG13 ILE 629 -12.234 1.484 -1.463 235 HG21 ILE 629 HG21 ILE 629 -11.144 -1.518 0.361 236 HG22 ILE 629 HG22 ILE 629 -10.449 -1.837 -1.242 237 HG23 ILE 629 HG23 ILE 629 -9.396 -1.366 0.086 238 HD11 ILE 629 HD11 ILE 629 -10.971 0.624 -3.450 239 HD12 ILE 629 HD12 ILE 629 -11.581 -1.002 -3.071 240 HD13 ILE 629 HD13 ILE 629 -12.712 0.296 -3.497 241 H ILE 630 H ILE 630 -8.021 1.601 0.362 242 HA ILE 630 HA ILE 630 -7.225 -0.209 2.455 243 HB ILE 630 HB ILE 630 -4.975 0.812 2.371 244 HG12 ILE 630 HG12 ILE 630 -4.710 2.244 0.098 245 HG13 ILE 630 HG13 ILE 630 -6.309 2.785 0.553 246 HG21 ILE 630 HG21 ILE 630 -4.433 -0.080 0.193 247 HG22 ILE 630 HG22 ILE 630 -5.652 -1.091 0.981 248 HG23 ILE 630 HG23 ILE 630 -6.135 0.039 -0.309 249 HD11 ILE 630 HD11 ILE 630 -3.783 2.993 2.241 250 HD12 ILE 630 HD12 ILE 630 -4.593 4.317 1.376 251 HD13 ILE 630 HD13 ILE 630 -5.384 3.553 2.759 252 H GLU 631 H GLU 631 -8.168 3.279 2.654 253 HA GLU 631 HA GLU 631 -7.111 3.668 5.270 254 HB2 GLU 631 HB2 GLU 631 -9.142 4.944 3.444 255 HB3 GLU 631 HB3 GLU 631 -9.107 5.393 5.126 256 HG2 GLU 631 HG2 GLU 631 -6.854 6.204 4.978 257 HG3 GLU 631 HG3 GLU 631 -6.624 5.500 3.383 258 H ILE 632 H ILE 632 -10.253 2.454 3.948 259 HA ILE 632 HA ILE 632 -11.439 2.059 6.522 260 HB ILE 632 HB ILE 632 -12.027 0.108 4.297 261 HG12 ILE 632 HG12 ILE 632 -12.299 1.909 2.918 262 HG13 ILE 632 HG13 ILE 632 -13.896 1.578 3.501 263 HG21 ILE 632 HG21 ILE 632 -13.050 -0.222 6.500 264 HG22 ILE 632 HG22 ILE 632 -13.734 1.412 6.455 265 HG23 ILE 632 HG23 ILE 632 -14.284 0.177 5.306 266 HD11 ILE 632 HD11 ILE 632 -13.725 3.505 5.080 267 HD12 ILE 632 HD12 ILE 632 -12.114 3.879 4.418 268 HD13 ILE 632 HD13 ILE 632 -13.528 3.966 3.371 269 H ILE 633 H ILE 633 -9.466 -0.163 4.431 270 HA ILE 633 HA ILE 633 -9.874 -2.345 6.196 271 HB ILE 633 HB ILE 633 -7.452 -2.187 4.383 272 HG12 ILE 633 HG12 ILE 633 -10.372 -2.421 3.697 273 HG13 ILE 633 HG13 ILE 633 -9.018 -1.726 2.802 274 HG21 ILE 633 HG21 ILE 633 -7.556 -4.041 6.035 275 HG22 ILE 633 HG22 ILE 633 -9.066 -4.587 5.289 276 HG23 ILE 633 HG23 ILE 633 -7.557 -4.589 4.363 277 HD11 ILE 633 HD11 ILE 633 -9.579 -4.688 2.933 278 HD12 ILE 633 HD12 ILE 633 -10.025 -3.571 1.628 279 HD13 ILE 633 HD13 ILE 633 -8.330 -3.832 1.983 280 H ASP 634 H ASP 634 -7.236 0.105 5.972 281 HA ASP 634 HA ASP 634 -5.646 -1.166 7.932 282 HB2 ASP 634 HB2 ASP 634 -5.041 0.677 6.168 283 HB3 ASP 634 HB3 ASP 634 -5.532 1.814 7.426 284 H SER 635 H SER 635 -8.180 1.396 8.103 285 HA SER 635 HA SER 635 -7.785 2.062 10.833 286 HB2 SER 635 HB2 SER 635 -9.042 3.439 9.214 287 HB3 SER 635 HB3 SER 635 -10.298 2.192 9.105 288 HG SER 635 HG SER 635 -10.789 3.914 10.562 289 H LEU 636 H LEU 636 -10.044 -0.224 9.233 290 HA LEU 636 HA LEU 636 -11.224 -1.302 11.596 291 HB2 LEU 636 HB2 LEU 636 -10.810 -2.290 8.769 292 HB3 LEU 636 HB3 LEU 636 -11.520 -3.314 9.991 293 HG LEU 636 HG LEU 636 -12.947 -1.860 8.286 294 HD11 LEU 636 HD11 LEU 636 -14.880 -2.097 9.830 295 HD12 LEU 636 HD12 LEU 636 -13.763 -2.357 11.185 296 HD13 LEU 636 HD13 LEU 636 -13.857 -3.533 9.861 297 HD21 LEU 636 HD21 LEU 636 -12.300 0.385 9.060 298 HD22 LEU 636 HD22 LEU 636 -12.930 0.016 10.678 299 HD23 LEU 636 HD23 LEU 636 -14.020 0.079 9.282 300 H ALA 637 H ALA 637 -8.322 -2.313 9.696 301 HA ALA 637 HA ALA 637 -7.792 -4.661 11.233 302 HB1 ALA 637 HB1 ALA 637 -7.000 -4.406 8.951 303 HB2 ALA 637 HB2 ALA 637 -6.078 -2.942 9.391 304 HB3 ALA 637 HB3 ALA 637 -5.584 -4.499 10.024 305 H VAL 638 H VAL 638 -6.878 -1.274 11.771 306 HA VAL 638 HA VAL 638 -5.005 -2.031 13.923 307 HB VAL 638 HB VAL 638 -6.020 0.622 12.830 308 HG11 VAL 638 HG11 VAL 638 -4.054 0.153 15.122 309 HG12 VAL 638 HG12 VAL 638 -4.319 1.707 14.300 310 HG13 VAL 638 HG13 VAL 638 -5.627 0.973 15.232 311 HG21 VAL 638 HG21 VAL 638 -3.236 -0.657 12.863 312 HG22 VAL 638 HG22 VAL 638 -4.317 -0.634 11.461 313 HG23 VAL 638 HG23 VAL 638 -3.686 0.882 12.092 314 H SER 639 H SER 639 -8.343 -0.686 13.592 315 HA SER 639 HA SER 639 -8.704 -0.537 16.455 316 HB2 SER 639 HB2 SER 639 -9.817 0.967 14.800 317 HB3 SER 639 HB3 SER 639 -10.753 -0.422 14.205 318 HG SER 639 HG SER 639 -11.280 -0.655 16.573 319 H SER 640 H SER 640 -8.818 -3.299 14.367 320 HA SER 640 HA SER 640 -10.111 -4.925 16.389 321 HB2 SER 640 HB2 SER 640 -11.953 -3.767 14.943 322 HB3 SER 640 HB3 SER 640 -11.366 -4.784 13.615 323 HG SER 640 HG SER 640 -12.574 -5.511 16.060 324 H GLU 641 H GLU 641 -10.566 -7.155 15.021 325 HA GLU 641 HA GLU 641 -7.964 -8.279 14.570 326 HB2 GLU 641 HB2 GLU 641 -10.755 -9.324 13.915 327 HB3 GLU 641 HB3 GLU 641 -9.269 -10.273 13.774 328 HG2 GLU 641 HG2 GLU 641 -8.831 -9.964 16.198 329 HG3 GLU 641 HG3 GLU 641 -10.334 -9.041 16.353 330 H CYS 642 H CYS 642 -10.636 -7.390 12.299 331 HA CYS 642 HA CYS 642 -8.789 -7.044 10.093 332 HB2 CYS 642 HB2 CYS 642 -9.928 -8.694 8.660 333 HB3 CYS 642 HB3 CYS 642 -9.161 -9.476 10.026 334 H ALA 643 H ALA 643 -10.053 -6.401 8.147 335 HA ALA 643 HA ALA 643 -12.399 -4.749 8.752 336 HB1 ALA 643 HB1 ALA 643 -10.554 -4.000 7.238 337 HB2 ALA 643 HB2 ALA 643 -11.029 -5.279 6.107 338 HB3 ALA 643 HB3 ALA 643 -12.176 -3.974 6.509 339 H LYS 644 H LYS 644 -14.080 -5.973 9.182 340 HA LYS 644 HA LYS 644 -15.032 -8.263 7.750 341 HB2 LYS 644 HB2 LYS 644 -17.330 -7.247 8.307 342 HB3 LYS 644 HB3 LYS 644 -16.322 -7.820 9.633 343 HG2 LYS 644 HG2 LYS 644 -15.805 -4.999 9.130 344 HG3 LYS 644 HG3 LYS 644 -17.538 -5.305 9.217 345 HD2 LYS 644 HD2 LYS 644 -15.805 -6.564 11.301 346 HD3 LYS 644 HD3 LYS 644 -15.929 -4.806 11.331 347 HE2 LYS 644 HE2 LYS 644 -18.394 -6.589 11.183 348 HE3 LYS 644 HE3 LYS 644 -17.640 -6.128 12.729 349 HZ1 LYS 644 HZ1 LYS 644 -19.170 -4.433 12.470 350 HZ2 LYS 644 HZ2 LYS 644 -19.058 -4.401 10.805 351 HZ3 LYS 644 HZ3 LYS 644 -17.915 -3.740 11.609 352 H VAL 645 H VAL 645 -15.444 -8.351 5.767 353 HA VAL 645 HA VAL 645 -15.365 -6.219 3.848 354 HB VAL 645 HB VAL 645 -16.475 -9.036 3.655 355 HG11 VAL 645 HG11 VAL 645 -16.095 -7.013 1.408 356 HG12 VAL 645 HG12 VAL 645 -16.272 -8.767 1.161 357 HG13 VAL 645 HG13 VAL 645 -17.591 -7.844 1.876 358 HG21 VAL 645 HG21 VAL 645 -14.010 -8.761 4.038 359 HG22 VAL 645 HG22 VAL 645 -14.381 -9.454 2.447 360 HG23 VAL 645 HG23 VAL 645 -13.912 -7.748 2.597 361 H LYS 646 H LYS 646 -18.022 -7.361 5.841 362 HA LYS 646 HA LYS 646 -20.181 -6.235 4.347 363 HB2 LYS 646 HB2 LYS 646 -20.284 -7.931 6.256 364 HB3 LYS 646 HB3 LYS 646 -19.991 -6.588 7.375 365 HG2 LYS 646 HG2 LYS 646 -22.056 -5.467 6.537 366 HG3 LYS 646 HG3 LYS 646 -22.306 -6.802 5.394 367 HD2 LYS 646 HD2 LYS 646 -22.402 -8.387 7.357 368 HD3 LYS 646 HD3 LYS 646 -22.343 -6.994 8.444 369 HE2 LYS 646 HE2 LYS 646 -24.469 -7.528 6.314 370 HE3 LYS 646 HE3 LYS 646 -24.654 -7.866 8.040 371 HZ1 LYS 646 HZ1 LYS 646 -25.660 -5.774 7.420 372 HZ2 LYS 646 HZ2 LYS 646 -24.220 -5.190 6.876 373 HZ3 LYS 646 HZ3 LYS 646 -24.424 -5.517 8.477 374 H ASP 647 H ASP 647 -17.952 -4.893 6.904 375 HA ASP 647 HA ASP 647 -19.296 -2.374 7.002 376 HB2 ASP 647 HB2 ASP 647 -16.646 -3.472 7.936 377 HB3 ASP 647 HB3 ASP 647 -16.899 -1.754 7.972 378 H ILE 648 H ILE 648 -16.563 -3.707 5.138 379 HA ILE 648 HA ILE 648 -15.767 -1.194 4.003 380 HB ILE 648 HB ILE 648 -15.421 -3.874 2.593 381 HG12 ILE 648 HG12 ILE 648 -13.608 -2.787 4.793 382 HG13 ILE 648 HG13 ILE 648 -14.655 -4.180 4.906 383 HG21 ILE 648 HG21 ILE 648 -13.669 -1.372 2.619 384 HG22 ILE 648 HG22 ILE 648 -13.428 -2.818 1.614 385 HG23 ILE 648 HG23 ILE 648 -14.824 -1.785 1.338 386 HD11 ILE 648 HD11 ILE 648 -13.426 -5.206 2.927 387 HD12 ILE 648 HD12 ILE 648 -12.180 -3.963 3.221 388 HD13 ILE 648 HD13 ILE 648 -12.586 -5.150 4.470 389 H LEU 649 H LEU 649 -17.844 -3.810 2.806 390 HA LEU 649 HA LEU 649 -18.677 -2.616 0.385 391 HB2 LEU 649 HB2 LEU 649 -19.936 -4.602 2.288 392 HB3 LEU 649 HB3 LEU 649 -20.851 -4.013 0.911 393 HG LEU 649 HG LEU 649 -18.118 -5.325 0.607 394 HD11 LEU 649 HD11 LEU 649 -20.896 -6.563 0.310 395 HD12 LEU 649 HD12 LEU 649 -19.747 -6.902 1.620 396 HD13 LEU 649 HD13 LEU 649 -19.346 -7.362 -0.042 397 HD21 LEU 649 HD21 LEU 649 -20.367 -4.781 -1.392 398 HD22 LEU 649 HD22 LEU 649 -18.859 -5.655 -1.743 399 HD23 LEU 649 HD23 LEU 649 -18.808 -3.943 -1.327 400 H LYS 650 H LYS 650 -19.990 -2.305 3.689 401 HA LYS 650 HA LYS 650 -22.257 -0.691 3.048 402 HB2 LYS 650 HB2 LYS 650 -22.287 -1.662 5.157 403 HB3 LYS 650 HB3 LYS 650 -20.619 -1.252 5.497 404 HG2 LYS 650 HG2 LYS 650 -22.054 -0.037 6.944 405 HG3 LYS 650 HG3 LYS 650 -21.141 1.042 5.909 406 HD2 LYS 650 HD2 LYS 650 -23.199 1.400 4.510 407 HD3 LYS 650 HD3 LYS 650 -24.090 0.326 5.620 408 HE2 LYS 650 HE2 LYS 650 -23.354 1.822 7.525 409 HE3 LYS 650 HE3 LYS 650 -22.631 2.918 6.347 410 HZ1 LYS 650 HZ1 LYS 650 -25.508 2.234 6.431 411 HZ2 LYS 650 HZ2 LYS 650 -24.811 3.361 5.451 412 HZ3 LYS 650 HZ3 LYS 650 -24.835 3.602 7.060 413 H GLU 651 H GLU 651 -19.006 0.417 4.273 414 HA GLU 651 HA GLU 651 -19.826 3.136 3.863 415 HB2 GLU 651 HB2 GLU 651 -17.078 1.910 4.330 416 HB3 GLU 651 HB3 GLU 651 -17.391 3.650 4.293 417 HG2 GLU 651 HG2 GLU 651 -18.639 1.660 6.248 418 HG3 GLU 651 HG3 GLU 651 -17.350 2.804 6.605 419 H ALA 652 H ALA 652 -17.919 0.909 1.787 420 HA ALA 652 HA ALA 652 -17.258 2.958 -0.117 421 HB1 ALA 652 HB1 ALA 652 -15.972 0.925 0.024 422 HB2 ALA 652 HB2 ALA 652 -17.395 -0.054 -0.363 423 HB3 ALA 652 HB3 ALA 652 -16.707 1.037 -1.587 424 H GLN 653 H GLN 653 -20.118 0.712 0.099 425 HA GLN 653 HA GLN 653 -21.304 1.614 -2.361 426 HB2 GLN 653 HB2 GLN 653 -22.449 0.372 0.161 427 HB3 GLN 653 HB3 GLN 653 -23.467 0.854 -1.176 428 HG2 GLN 653 HG2 GLN 653 -21.147 -0.894 -1.930 429 HG3 GLN 653 HG3 GLN 653 -22.394 -1.628 -0.928 430 HE21 GLN 653 HE21 GLN 653 -21.992 0.239 -4.037 431 HE22 GLN 653 HE22 GLN 653 -23.527 -0.364 -4.682 432 H GLN 654 H GLN 654 -21.403 2.911 0.996 433 HA GLN 654 HA GLN 654 -23.326 4.955 0.298 434 HB2 GLN 654 HB2 GLN 654 -21.303 4.813 2.565 435 HB3 GLN 654 HB3 GLN 654 -22.588 6.010 2.460 436 HG2 GLN 654 HG2 GLN 654 -23.290 3.050 2.411 437 HG3 GLN 654 HG3 GLN 654 -22.859 3.843 3.916 438 HE21 GLN 654 HE21 GLN 654 -24.952 5.007 1.109 439 HE22 GLN 654 HE22 GLN 654 -26.329 5.232 2.167 440 H VAL 655 H VAL 655 -19.741 4.896 0.313 441 HA VAL 655 HA VAL 655 -19.386 7.577 -0.636 442 HB VAL 655 HB VAL 655 -17.754 5.023 -0.799 443 HG11 VAL 655 HG11 VAL 655 -17.057 6.309 -2.758 444 HG12 VAL 655 HG12 VAL 655 -16.846 7.760 -1.752 445 HG13 VAL 655 HG13 VAL 655 -15.809 6.328 -1.513 446 HG21 VAL 655 HG21 VAL 655 -17.301 7.627 0.731 447 HG22 VAL 655 HG22 VAL 655 -18.010 6.166 1.429 448 HG23 VAL 655 HG23 VAL 655 -16.343 6.132 0.860 449 H GLY 656 H GLY 656 -20.346 4.593 -2.278 450 HA2 GLY 656 HA2 GLY 656 -22.052 5.036 -3.989 451 HA3 GLY 656 HA3 GLY 656 -20.984 6.245 -4.701 452 H ILE 657 H ILE 657 -19.232 3.489 -3.635 453 HA ILE 657 HA ILE 657 -18.613 2.759 -6.406 454 HB ILE 657 HB ILE 657 -17.635 1.666 -3.735 455 HG12 ILE 657 HG12 ILE 657 -16.011 3.535 -5.509 456 HG13 ILE 657 HG13 ILE 657 -17.111 4.208 -4.315 457 HG21 ILE 657 HG21 ILE 657 -17.239 0.111 -5.571 458 HG22 ILE 657 HG22 ILE 657 -16.487 1.386 -6.552 459 HG23 ILE 657 HG23 ILE 657 -15.706 0.790 -5.067 460 HD11 ILE 657 HD11 ILE 657 -14.893 2.259 -3.621 461 HD12 ILE 657 HD12 ILE 657 -14.855 4.025 -3.415 462 HD13 ILE 657 HD13 ILE 657 -16.020 3.053 -2.499 463 H GLU 658 H GLU 658 -18.961 0.484 -7.215 464 HA GLU 658 HA GLU 658 -21.528 -0.558 -6.267 465 HB2 GLU 658 HB2 GLU 658 -20.890 -0.360 -8.712 466 HB3 GLU 658 HB3 GLU 658 -19.660 -1.613 -8.432 467 HG2 GLU 658 HG2 GLU 658 -21.505 -3.138 -7.616 468 HG3 GLU 658 HG3 GLU 658 -22.674 -1.868 -7.990 469 H LYS 659 H LYS 659 -21.771 -2.579 -5.225 470 HA LYS 659 HA LYS 659 -20.138 -4.101 -3.730 471 HB2 LYS 659 HB2 LYS 659 -21.637 -5.731 -5.788 472 HB3 LYS 659 HB3 LYS 659 -21.418 -5.958 -4.087 473 HG2 LYS 659 HG2 LYS 659 -23.625 -5.558 -4.268 474 HG3 LYS 659 HG3 LYS 659 -23.000 -3.972 -3.784 475 HD2 LYS 659 HD2 LYS 659 -24.759 -3.695 -5.418 476 HD3 LYS 659 HD3 LYS 659 -23.251 -3.229 -6.178 477 HE2 LYS 659 HE2 LYS 659 -23.152 -5.593 -7.184 478 HE3 LYS 659 HE3 LYS 659 -24.760 -5.858 -6.500 479 HZ1 LYS 659 HZ1 LYS 659 -25.415 -3.841 -7.879 480 HZ2 LYS 659 HZ2 LYS 659 -25.061 -5.217 -8.712 481 HZ3 LYS 659 HZ3 LYS 659 -23.974 -4.021 -8.691 482 H SER 660 H SER 660 -20.446 -4.813 -7.187 483 HA SER 660 HA SER 660 -18.471 -6.709 -7.289 484 HB2 SER 660 HB2 SER 660 -20.319 -6.425 -8.834 485 HB3 SER 660 HB3 SER 660 -19.655 -4.895 -9.419 486 HG SER 660 HG SER 660 -19.197 -6.676 -10.806 487 H ASN 661 H ASN 661 -18.134 -3.203 -7.515 488 HA ASN 661 HA ASN 661 -15.418 -3.187 -8.569 489 HB2 ASN 661 HB2 ASN 661 -17.234 -1.104 -7.415 490 HB3 ASN 661 HB3 ASN 661 -15.506 -0.903 -7.252 491 HD21 ASN 661 HD21 ASN 661 -17.920 -1.778 -9.859 492 HD22 ASN 661 HD22 ASN 661 -17.078 -0.859 -11.075 493 H ILE 662 H ILE 662 -16.951 -3.502 -5.309 494 HA ILE 662 HA ILE 662 -14.476 -2.745 -3.932 495 HB ILE 662 HB ILE 662 -17.172 -3.805 -2.987 496 HG12 ILE 662 HG12 ILE 662 -16.177 -0.996 -2.481 497 HG13 ILE 662 HG13 ILE 662 -16.824 -1.360 -4.053 498 HG21 ILE 662 HG21 ILE 662 -14.825 -2.718 -1.370 499 HG22 ILE 662 HG22 ILE 662 -16.452 -3.013 -0.717 500 HG23 ILE 662 HG23 ILE 662 -15.492 -4.364 -1.321 501 HD11 ILE 662 HD11 ILE 662 -18.600 -0.447 -2.732 502 HD12 ILE 662 HD12 ILE 662 -18.952 -2.148 -3.079 503 HD13 ILE 662 HD13 ILE 662 -18.366 -1.677 -1.480 504 H GLU 663 H GLU 663 -16.377 -5.551 -4.925 505 HA GLU 663 HA GLU 663 -14.893 -7.574 -3.542 506 HB2 GLU 663 HB2 GLU 663 -16.675 -7.654 -6.018 507 HB3 GLU 663 HB3 GLU 663 -16.118 -9.077 -5.123 508 HG2 GLU 663 HG2 GLU 663 -17.273 -8.298 -3.101 509 HG3 GLU 663 HG3 GLU 663 -17.757 -6.839 -3.829 510 H LYS 664 H LYS 664 -14.702 -6.280 -6.931 511 HA LYS 664 HA LYS 664 -12.477 -8.005 -7.490 512 HB2 LYS 664 HB2 LYS 664 -12.425 -7.160 -9.628 513 HB3 LYS 664 HB3 LYS 664 -14.119 -7.062 -9.166 514 HG2 LYS 664 HG2 LYS 664 -13.596 -4.575 -8.568 515 HG3 LYS 664 HG3 LYS 664 -12.079 -4.832 -9.440 516 HD2 LYS 664 HD2 LYS 664 -13.708 -5.746 -11.353 517 HD3 LYS 664 HD3 LYS 664 -14.939 -4.864 -10.446 518 HE2 LYS 664 HE2 LYS 664 -14.151 -3.384 -12.143 519 HE3 LYS 664 HE3 LYS 664 -13.471 -2.799 -10.615 520 HZ1 LYS 664 HZ1 LYS 664 -12.058 -4.462 -12.614 521 HZ2 LYS 664 HZ2 LYS 664 -11.408 -3.931 -11.202 522 HZ3 LYS 664 HZ3 LYS 664 -11.819 -2.854 -12.379 523 H LEU 665 H LEU 665 -12.650 -4.636 -6.293 524 HA LEU 665 HA LEU 665 -9.814 -4.158 -6.354 525 HB2 LEU 665 HB2 LEU 665 -12.166 -2.984 -4.869 526 HB3 LEU 665 HB3 LEU 665 -10.566 -2.671 -4.273 527 HG LEU 665 HG LEU 665 -11.669 -0.964 -5.882 528 HD11 LEU 665 HD11 LEU 665 -8.793 -1.871 -6.263 529 HD12 LEU 665 HD12 LEU 665 -9.411 -0.764 -5.019 530 HD13 LEU 665 HD13 LEU 665 -9.459 -0.288 -6.724 531 HD21 LEU 665 HD21 LEU 665 -10.448 -2.764 -8.019 532 HD22 LEU 665 HD22 LEU 665 -11.107 -1.134 -8.242 533 HD23 LEU 665 HD23 LEU 665 -12.180 -2.463 -7.804 534 H LEU 666 H LEU 666 -11.966 -5.399 -3.679 535 HA LEU 666 HA LEU 666 -9.915 -5.967 -1.836 536 HB2 LEU 666 HB2 LEU 666 -12.606 -7.271 -2.403 537 HB3 LEU 666 HB3 LEU 666 -11.562 -7.883 -1.138 538 HG LEU 666 HG LEU 666 -12.474 -4.981 -1.180 539 HD11 LEU 666 HD11 LEU 666 -13.687 -7.378 0.271 540 HD12 LEU 666 HD12 LEU 666 -14.439 -6.484 -1.060 541 HD13 LEU 666 HD13 LEU 666 -14.162 -5.674 0.492 542 HD21 LEU 666 HD21 LEU 666 -11.862 -5.053 1.182 543 HD22 LEU 666 HD22 LEU 666 -10.467 -5.466 0.195 544 HD23 LEU 666 HD23 LEU 666 -11.356 -6.751 1.041 545 H THR 667 H THR 667 -11.144 -7.915 -4.553 546 HA THR 667 HA THR 667 -9.542 -10.240 -4.126 547 HB THR 667 HB THR 667 -10.516 -8.971 -6.724 548 HG1 THR 667 HG1 THR 667 -12.142 -9.726 -5.453 549 HG21 THR 667 HG21 THR 667 -8.545 -10.197 -7.342 550 HG22 THR 667 HG22 THR 667 -9.901 -11.240 -7.729 551 HG23 THR 667 HG23 THR 667 -8.929 -11.523 -6.261 552 H ASP 668 H ASP 668 -8.936 -7.354 -6.307 553 HA ASP 668 HA ASP 668 -6.439 -8.447 -6.881 554 HB2 ASP 668 HB2 ASP 668 -7.852 -6.854 -8.169 555 HB3 ASP 668 HB3 ASP 668 -7.061 -5.562 -7.225 556 H MET 669 H MET 669 -7.321 -6.111 -4.399 557 HA MET 669 HA MET 669 -4.695 -5.472 -3.507 558 HB2 MET 669 HB2 MET 669 -7.307 -5.743 -1.980 559 HB3 MET 669 HB3 MET 669 -5.822 -5.029 -1.332 560 HG2 MET 669 HG2 MET 669 -6.293 -3.722 -3.806 561 HG3 MET 669 HG3 MET 669 -7.854 -3.818 -2.989 562 HE1 MET 669 HE1 MET 669 -6.600 -0.127 -2.526 563 HE2 MET 669 HE2 MET 669 -6.276 -1.213 -3.896 564 HE3 MET 669 HE3 MET 669 -7.901 -1.157 -3.165 565 H ARG 670 H ARG 670 -6.827 -8.279 -2.527 566 HA ARG 670 HA ARG 670 -4.661 -9.398 -0.965 567 HB2 ARG 670 HB2 ARG 670 -6.071 -11.058 -0.272 568 HB3 ARG 670 HB3 ARG 670 -7.149 -9.702 -0.556 569 HG2 ARG 670 HG2 ARG 670 -8.351 -11.515 -1.300 570 HG3 ARG 670 HG3 ARG 670 -7.731 -10.836 -2.777 571 HD2 ARG 670 HD2 ARG 670 -5.787 -12.697 -2.208 572 HD3 ARG 670 HD3 ARG 670 -7.151 -13.439 -1.410 573 HE ARG 670 HE ARG 670 -6.643 -13.145 -4.236 574 HH11 ARG 670 HH11 ARG 670 -9.286 -13.812 -1.888 575 HH12 ARG 670 HH12 ARG 670 -10.464 -14.089 -3.105 576 HH21 ARG 670 HH21 ARG 670 -8.152 -13.867 -5.816 577 HH22 ARG 670 HH22 ARG 670 -9.768 -14.269 -5.352 578 H LYS 671 H LYS 671 -5.563 -9.690 -4.300 579 HA LYS 671 HA LYS 671 -3.979 -12.101 -4.718 580 HB2 LYS 671 HB2 LYS 671 -5.215 -12.342 -6.593 581 HB3 LYS 671 HB3 LYS 671 -6.231 -11.130 -5.894 582 HG2 LYS 671 HG2 LYS 671 -6.116 -10.253 -7.899 583 HG3 LYS 671 HG3 LYS 671 -4.636 -9.489 -7.292 584 HD2 LYS 671 HD2 LYS 671 -3.352 -11.415 -8.309 585 HD3 LYS 671 HD3 LYS 671 -4.874 -12.026 -8.985 586 HE2 LYS 671 HE2 LYS 671 -3.706 -9.258 -9.444 587 HE3 LYS 671 HE3 LYS 671 -3.556 -10.655 -10.563 588 HZ1 LYS 671 HZ1 LYS 671 -5.790 -8.909 -10.025 589 HZ2 LYS 671 HZ2 LYS 671 -6.135 -10.495 -10.455 590 HZ3 LYS 671 HZ3 LYS 671 -5.263 -9.477 -11.436 591 H SER 672 H SER 672 -3.432 -8.661 -5.049 592 HA SER 672 HA SER 672 -0.813 -9.106 -6.332 593 HB2 SER 672 HB2 SER 672 -2.464 -6.571 -6.011 594 HB3 SER 672 HB3 SER 672 -0.976 -6.755 -6.950 595 HG SER 672 HG SER 672 -3.436 -7.091 -7.862 596 H GLY 673 H GLY 673 -2.157 -8.251 -3.156 597 HA2 GLY 673 HA2 GLY 673 -0.675 -9.039 -1.461 598 HA3 GLY 673 HA3 GLY 673 0.699 -8.319 -2.291 599 H ILE 674 H ILE 674 -2.230 -6.441 -1.970 600 HA ILE 674 HA ILE 674 -0.840 -4.450 -0.282 601 HB ILE 674 HB ILE 674 -3.618 -4.470 -1.536 602 HG12 ILE 674 HG12 ILE 674 -1.068 -3.141 -2.553 603 HG13 ILE 674 HG13 ILE 674 -1.842 -4.552 -3.264 604 HG21 ILE 674 HG21 ILE 674 -3.474 -2.922 0.389 605 HG22 ILE 674 HG22 ILE 674 -2.014 -2.182 -0.296 606 HG23 ILE 674 HG23 ILE 674 -3.588 -2.011 -1.100 607 HD11 ILE 674 HD11 ILE 674 -3.891 -3.197 -3.725 608 HD12 ILE 674 HD12 ILE 674 -2.982 -1.748 -3.227 609 HD13 ILE 674 HD13 ILE 674 -2.438 -2.700 -4.611 610 H ILE 675 H ILE 675 -3.458 -6.895 -0.103 611 HA ILE 675 HA ILE 675 -3.574 -6.529 2.838 612 HB ILE 675 HB ILE 675 -5.944 -6.560 2.908 613 HG12 ILE 675 HG12 ILE 675 -5.848 -6.883 -0.085 614 HG13 ILE 675 HG13 ILE 675 -6.504 -7.999 1.094 615 HG21 ILE 675 HG21 ILE 675 -4.617 -4.367 2.446 616 HG22 ILE 675 HG22 ILE 675 -5.343 -4.421 0.844 617 HG23 ILE 675 HG23 ILE 675 -6.345 -4.336 2.307 618 HD11 ILE 675 HD11 ILE 675 -8.312 -6.864 -0.051 619 HD12 ILE 675 HD12 ILE 675 -8.286 -6.348 1.648 620 HD13 ILE 675 HD13 ILE 675 -7.662 -5.280 0.365 621 H TYR 676 H TYR 676 -4.875 -8.554 3.713 622 HA TYR 676 HA TYR 676 -4.755 -10.858 1.892 623 HB2 TYR 676 HB2 TYR 676 -3.990 -12.195 4.075 624 HB3 TYR 676 HB3 TYR 676 -2.907 -11.598 2.840 625 HD1 TYR 676 HD2 TYR 676 -4.468 -9.936 5.868 626 HD2 TYR 676 HD1 TYR 676 -0.868 -11.063 3.777 627 HE1 TYR 676 HE2 TYR 676 -3.076 -8.793 7.598 628 HE2 TYR 676 HE1 TYR 676 0.501 -9.973 5.515 629 HH TYR 676 HH TYR 676 0.393 -8.391 7.366 630 H GLU 677 H GLU 677 -5.992 -12.767 2.895 631 HA GLU 677 HA GLU 677 -8.578 -11.748 3.806 632 HB2 GLU 677 HB2 GLU 677 -8.145 -12.157 1.396 633 HB3 GLU 677 HB3 GLU 677 -7.638 -13.811 1.759 634 HG2 GLU 677 HG2 GLU 677 -9.944 -14.322 2.568 635 HG3 GLU 677 HG3 GLU 677 -10.339 -12.618 2.323 636 H ALA 678 H ALA 678 -8.697 -12.481 5.959 637 HA ALA 678 HA ALA 678 -7.410 -14.994 6.783 638 HB1 ALA 678 HB1 ALA 678 -8.365 -14.418 8.988 639 HB2 ALA 678 HB2 ALA 678 -7.493 -13.033 8.295 640 HB3 ALA 678 HB3 ALA 678 -9.270 -13.079 8.256 641 H LYS 679 H LYS 679 -10.589 -13.820 5.874 642 HA LYS 679 HA LYS 679 -11.531 -16.490 5.345 643 HB2 LYS 679 HB2 LYS 679 -13.137 -14.578 7.149 644 HB3 LYS 679 HB3 LYS 679 -13.866 -15.868 6.240 645 HG2 LYS 679 HG2 LYS 679 -13.652 -16.962 8.204 646 HG3 LYS 679 HG3 LYS 679 -12.119 -17.402 7.462 647 HD2 LYS 679 HD2 LYS 679 -11.219 -15.243 8.766 648 HD3 LYS 679 HD3 LYS 679 -12.721 -15.369 9.654 649 HE2 LYS 679 HE2 LYS 679 -10.838 -16.442 10.820 650 HE3 LYS 679 HE3 LYS 679 -12.123 -17.605 10.457 651 HZ1 LYS 679 HZ1 LYS 679 -10.842 -18.535 8.765 652 HZ2 LYS 679 HZ2 LYS 679 -9.731 -18.282 9.958 653 HZ3 LYS 679 HZ3 LYS 679 -9.828 -17.272 8.637 654 HA PRO 680 HA PRO 680 -12.900 -13.927 1.900 655 HB2 PRO 680 HB2 PRO 680 -15.115 -15.216 0.897 656 HB3 PRO 680 HB3 PRO 680 -13.466 -15.897 0.797 657 HG2 PRO 680 HG2 PRO 680 -15.570 -16.444 2.924 658 HG3 PRO 680 HG3 PRO 680 -14.655 -17.642 1.947 659 HD2 PRO 680 HD2 PRO 680 -13.842 -16.988 4.427 660 HD3 PRO 680 HD3 PRO 680 -12.637 -17.186 3.127 661 H GLU 681 H GLU 681 -13.794 -13.194 4.530 662 HA GLU 681 HA GLU 681 -15.701 -11.163 3.725 663 HB2 GLU 681 HB2 GLU 681 -17.389 -11.871 5.189 664 HB3 GLU 681 HB3 GLU 681 -16.831 -13.355 4.405 665 HG2 GLU 681 HG2 GLU 681 -15.269 -13.649 6.464 666 HG3 GLU 681 HG3 GLU 681 -16.265 -12.430 7.256 667 H CYS 682 H CYS 682 -12.843 -11.927 5.214 668 HA CYS 682 HA CYS 682 -12.862 -9.727 7.176 669 HB2 CYS 682 HB2 CYS 682 -13.535 -11.640 8.478 670 HB3 CYS 682 HB3 CYS 682 -12.372 -12.672 7.660 671 H TYR 683 H TYR 683 -11.489 -8.565 5.922 672 HA TYR 683 HA TYR 683 -9.009 -9.888 4.912 673 HB2 TYR 683 HB2 TYR 683 -10.581 -7.492 3.896 674 HB3 TYR 683 HB3 TYR 683 -8.926 -7.830 3.431 675 HD1 TYR 683 HD1 TYR 683 -12.092 -9.952 3.613 676 HD2 TYR 683 HD2 TYR 683 -8.710 -8.655 1.291 677 HE1 TYR 683 HE1 TYR 683 -12.923 -11.237 1.673 678 HE2 TYR 683 HE2 TYR 683 -9.616 -9.821 -0.683 679 HH TYR 683 HH TYR 683 -11.649 -12.315 -0.414 680 H LYS 684 H LYS 684 -7.024 -8.699 5.284 681 HA LYS 684 HA LYS 684 -7.256 -6.443 7.207 682 HB2 LYS 684 HB2 LYS 684 -6.965 -8.762 8.385 683 HB3 LYS 684 HB3 LYS 684 -5.330 -8.731 7.716 684 HG2 LYS 684 HG2 LYS 684 -5.235 -6.331 8.755 685 HG3 LYS 684 HG3 LYS 684 -6.653 -6.831 9.680 686 HD2 LYS 684 HD2 LYS 684 -5.296 -8.688 10.683 687 HD3 LYS 684 HD3 LYS 684 -3.923 -8.189 9.676 688 HE2 LYS 684 HE2 LYS 684 -3.366 -6.973 11.516 689 HE3 LYS 684 HE3 LYS 684 -4.365 -5.807 10.719 690 HZ1 LYS 684 HZ1 LYS 684 -4.912 -7.237 13.163 691 HZ2 LYS 684 HZ2 LYS 684 -6.203 -7.096 12.170 692 HZ3 LYS 684 HZ3 LYS 684 -5.423 -5.736 12.689 693 H LYS 685 H LYS 685 -5.464 -4.999 7.088 694 HA LYS 685 HA LYS 685 -4.285 -4.879 4.460 695 HB2 LYS 685 HB2 LYS 685 -4.760 -3.123 6.721 696 HB3 LYS 685 HB3 LYS 685 -3.045 -3.075 6.383 697 HG2 LYS 685 HG2 LYS 685 -5.197 -2.741 4.250 698 HG3 LYS 685 HG3 LYS 685 -4.565 -1.377 5.157 699 HD2 LYS 685 HD2 LYS 685 -2.574 -3.163 3.756 700 HD3 LYS 685 HD3 LYS 685 -3.580 -2.103 2.780 701 HE2 LYS 685 HE2 LYS 685 -1.471 -1.057 3.251 702 HE3 LYS 685 HE3 LYS 685 -2.819 -0.159 3.976 703 HZ1 LYS 685 HZ1 LYS 685 -2.197 -0.964 6.131 704 HZ2 LYS 685 HZ2 LYS 685 -0.816 -0.447 5.436 705 HZ3 LYS 685 HZ3 LYS 685 -1.106 -2.062 5.507 706 H VAL 686 H VAL 686 -1.976 -5.111 3.874 707 HA VAL 686 HA VAL 686 -0.392 -6.660 5.787 708 HB VAL 686 HB VAL 686 1.434 -6.494 4.320 709 HG11 VAL 686 HG11 VAL 686 0.613 -7.551 2.309 710 HG12 VAL 686 HG12 VAL 686 -0.357 -8.085 3.689 711 HG13 VAL 686 HG13 VAL 686 -1.010 -6.898 2.559 712 HG21 VAL 686 HG21 VAL 686 1.338 -5.220 2.129 713 HG22 VAL 686 HG22 VAL 686 -0.031 -4.313 2.810 714 HG23 VAL 686 HG23 VAL 686 1.546 -4.252 3.596 Start of MODEL 13 1 H1 GLY 600 H1 GLY 600 3.296 19.283 5.416 2 H2 GLY 600 H2 GLY 600 3.036 18.163 6.612 3 H3 GLY 600 H3 GLY 600 4.368 19.111 6.668 4 HA2 GLY 600 HA2 GLY 600 3.812 17.100 4.601 5 HA3 GLY 600 HA3 GLY 600 5.287 18.087 4.732 6 H SER 601 H SER 601 6.315 15.809 4.797 7 HA SER 601 HA SER 601 7.046 15.307 7.488 8 HB2 SER 601 HB2 SER 601 5.036 13.768 7.206 9 HB3 SER 601 HB3 SER 601 5.929 12.949 5.905 10 HG SER 601 HG SER 601 6.238 11.938 7.941 11 H HIS 602 H HIS 602 8.706 13.228 7.109 12 HA HIS 602 HA HIS 602 10.298 13.725 4.666 13 HB2 HIS 602 HB2 HIS 602 11.505 13.798 7.458 14 HB3 HIS 602 HB3 HIS 602 12.344 14.061 5.933 15 HD1 HIS 602 HD1 HIS 602 11.351 16.064 8.675 16 HD2 HIS 602 HD2 HIS 602 10.788 16.323 4.510 17 HE1 HIS 602 HE1 HIS 602 10.833 18.515 8.151 18 H MET 603 H MET 603 12.221 12.063 4.692 19 HA MET 603 HA MET 603 11.767 9.620 6.178 20 HB2 MET 603 HB2 MET 603 11.838 9.666 3.117 21 HB3 MET 603 HB3 MET 603 11.970 8.223 4.125 22 HG2 MET 603 HG2 MET 603 9.685 8.677 5.034 23 HG3 MET 603 HG3 MET 603 9.560 10.059 3.946 24 HE1 MET 603 HE1 MET 603 10.873 6.290 3.449 25 HE2 MET 603 HE2 MET 603 9.352 6.216 4.366 26 HE3 MET 603 HE3 MET 603 9.420 5.605 2.697 27 H GLY 604 H GLY 604 13.760 8.168 5.633 28 HA2 GLY 604 HA2 GLY 604 16.165 9.764 4.861 29 HA3 GLY 604 HA3 GLY 604 16.179 8.499 6.118 30 H GLU 605 H GLU 605 15.476 6.349 5.523 31 HA GLU 605 HA GLU 605 16.498 5.325 3.085 32 HB2 GLU 605 HB2 GLU 605 14.414 4.034 4.911 33 HB3 GLU 605 HB3 GLU 605 15.535 3.256 3.801 34 HG2 GLU 605 HG2 GLU 605 16.664 2.849 5.719 35 HG3 GLU 605 HG3 GLU 605 17.389 4.407 5.349 36 H SER 606 H SER 606 15.484 4.841 1.111 37 HA SER 606 HA SER 606 13.108 6.196 0.396 38 HB2 SER 606 HB2 SER 606 14.477 3.854 -0.997 39 HB3 SER 606 HB3 SER 606 13.413 5.063 -1.741 40 HG SER 606 HG SER 606 15.630 5.539 -2.071 41 H GLY 607 H GLY 607 10.991 5.488 0.163 42 HA2 GLY 607 HA2 GLY 607 10.206 2.748 0.986 43 HA3 GLY 607 HA3 GLY 607 9.140 4.061 0.455 44 H LYS 608 H LYS 608 8.825 1.528 -0.591 45 HA LYS 608 HA LYS 608 8.824 2.389 -3.302 46 HB2 LYS 608 HB2 LYS 608 10.774 0.490 -2.775 47 HB3 LYS 608 HB3 LYS 608 9.375 -0.539 -3.042 48 HG2 LYS 608 HG2 LYS 608 10.558 -0.312 -5.088 49 HG3 LYS 608 HG3 LYS 608 9.045 0.557 -5.287 50 HD2 LYS 608 HD2 LYS 608 11.566 2.073 -4.466 51 HD3 LYS 608 HD3 LYS 608 11.374 1.519 -6.123 52 HE2 LYS 608 HE2 LYS 608 10.211 3.349 -6.608 53 HE3 LYS 608 HE3 LYS 608 8.913 2.683 -5.635 54 HZ1 LYS 608 HZ1 LYS 608 10.765 4.813 -4.966 55 HZ2 LYS 608 HZ2 LYS 608 10.267 3.856 -3.718 56 HZ3 LYS 608 HZ3 LYS 608 9.156 4.654 -4.622 57 H ILE 609 H ILE 609 6.965 1.679 -4.254 58 HA ILE 609 HA ILE 609 4.940 1.102 -4.681 59 HB ILE 609 HB ILE 609 4.910 0.446 -1.826 60 HG12 ILE 609 HG12 ILE 609 3.608 -1.653 -2.972 61 HG13 ILE 609 HG13 ILE 609 4.483 -1.091 -4.395 62 HG21 ILE 609 HG21 ILE 609 2.877 1.771 -2.140 63 HG22 ILE 609 HG22 ILE 609 2.529 0.980 -3.681 64 HG23 ILE 609 HG23 ILE 609 2.323 0.106 -2.140 65 HD11 ILE 609 HD11 ILE 609 6.619 -1.509 -3.277 66 HD12 ILE 609 HD12 ILE 609 5.782 -1.879 -1.746 67 HD13 ILE 609 HD13 ILE 609 5.601 -2.951 -3.148 68 H ASP 610 H ASP 610 3.941 3.014 -5.094 69 HA ASP 610 HA ASP 610 4.288 5.223 -3.211 70 HB2 ASP 610 HB2 ASP 610 5.224 5.369 -6.076 71 HB3 ASP 610 HB3 ASP 610 5.498 6.512 -4.758 72 H ILE 611 H ILE 611 3.243 7.026 -4.222 73 HA ILE 611 HA ILE 611 0.574 6.262 -5.309 74 HB ILE 611 HB ILE 611 1.627 8.889 -4.209 75 HG12 ILE 611 HG12 ILE 611 -0.570 7.455 -2.772 76 HG13 ILE 611 HG13 ILE 611 0.953 6.588 -2.766 77 HG21 ILE 611 HG21 ILE 611 -0.774 9.599 -4.106 78 HG22 ILE 611 HG22 ILE 611 -0.162 9.427 -5.753 79 HG23 ILE 611 HG23 ILE 611 -1.201 8.159 -5.069 80 HD11 ILE 611 HD11 ILE 611 0.782 8.057 -0.817 81 HD12 ILE 611 HD12 ILE 611 2.134 8.538 -1.861 82 HD13 ILE 611 HD13 ILE 611 0.621 9.477 -1.879 83 H ASP 612 H ASP 612 3.420 8.119 -6.276 84 HA ASP 612 HA ASP 612 2.216 9.569 -8.429 85 HB2 ASP 612 HB2 ASP 612 4.431 10.225 -8.971 86 HB3 ASP 612 HB3 ASP 612 4.262 10.267 -7.212 87 H THR 613 H THR 613 4.159 6.649 -8.130 88 HA THR 613 HA THR 613 4.358 5.858 -10.765 89 HB THR 613 HB THR 613 5.338 4.903 -8.509 90 HG1 THR 613 HG1 THR 613 4.785 3.362 -10.824 91 HG21 THR 613 HG21 THR 613 4.613 2.796 -7.781 92 HG22 THR 613 HG22 THR 613 3.311 2.724 -8.983 93 HG23 THR 613 HG23 THR 613 3.250 3.918 -7.664 94 H ILE 614 H ILE 614 1.442 5.974 -9.044 95 HA ILE 614 HA ILE 614 0.073 4.001 -10.821 96 HB ILE 614 HB ILE 614 -0.675 5.168 -8.107 97 HG12 ILE 614 HG12 ILE 614 -0.190 2.236 -8.803 98 HG13 ILE 614 HG13 ILE 614 1.130 3.290 -8.343 99 HG21 ILE 614 HG21 ILE 614 -2.232 3.182 -9.825 100 HG22 ILE 614 HG22 ILE 614 -2.621 3.624 -8.152 101 HG23 ILE 614 HG23 ILE 614 -2.733 4.841 -9.422 102 HD11 ILE 614 HD11 ILE 614 0.541 2.207 -6.381 103 HD12 ILE 614 HD12 ILE 614 -0.074 3.863 -6.225 104 HD13 ILE 614 HD13 ILE 614 -1.197 2.534 -6.598 105 H MET 615 H MET 615 -0.338 7.273 -9.285 106 HA MET 615 HA MET 615 -2.586 7.882 -10.950 107 HB2 MET 615 HB2 MET 615 -2.492 10.079 -9.954 108 HB3 MET 615 HB3 MET 615 -2.117 8.881 -8.715 109 HG2 MET 615 HG2 MET 615 -0.464 10.413 -8.273 110 HG3 MET 615 HG3 MET 615 0.382 9.372 -9.410 111 HE1 MET 615 HE1 MET 615 2.009 12.645 -10.594 112 HE2 MET 615 HE2 MET 615 1.836 11.911 -8.984 113 HE3 MET 615 HE3 MET 615 2.222 10.893 -10.398 114 H THR 616 H THR 616 0.925 8.170 -11.528 115 HA THR 616 HA THR 616 0.698 9.970 -13.693 116 HB THR 616 HB THR 616 2.818 9.351 -12.523 117 HG1 THR 616 HG1 THR 616 2.530 9.226 -15.316 118 HG21 THR 616 HG21 THR 616 2.880 6.898 -14.346 119 HG22 THR 616 HG22 THR 616 2.489 6.811 -12.621 120 HG23 THR 616 HG23 THR 616 4.078 7.400 -13.137 121 H GLY 617 H GLY 617 -0.489 6.752 -13.498 122 HA2 GLY 617 HA2 GLY 617 -0.917 6.685 -16.445 123 HA3 GLY 617 HA3 GLY 617 -0.136 5.318 -15.646 124 H LYS 618 H LYS 618 -2.407 6.565 -13.439 125 HA LYS 618 HA LYS 618 -4.722 5.118 -14.592 126 HB2 LYS 618 HB2 LYS 618 -3.495 4.833 -11.802 127 HB3 LYS 618 HB3 LYS 618 -5.183 4.554 -12.091 128 HG2 LYS 618 HG2 LYS 618 -4.363 2.403 -12.278 129 HG3 LYS 618 HG3 LYS 618 -4.460 2.912 -13.955 130 HD2 LYS 618 HD2 LYS 618 -1.870 3.624 -13.442 131 HD3 LYS 618 HD3 LYS 618 -2.062 2.442 -12.176 132 HE2 LYS 618 HE2 LYS 618 -1.057 1.472 -14.181 133 HE3 LYS 618 HE3 LYS 618 -2.610 0.700 -13.832 134 HZ1 LYS 618 HZ1 LYS 618 -2.157 1.365 -16.218 135 HZ2 LYS 618 HZ2 LYS 618 -2.394 2.940 -15.752 136 HZ3 LYS 618 HZ3 LYS 618 -3.600 1.860 -15.597 137 HA PRO 619 HA PRO 619 -6.770 8.867 -13.468 138 HB2 PRO 619 HB2 PRO 619 -9.365 8.068 -13.084 139 HB3 PRO 619 HB3 PRO 619 -8.580 8.037 -14.696 140 HG2 PRO 619 HG2 PRO 619 -8.858 5.743 -12.712 141 HG3 PRO 619 HG3 PRO 619 -9.288 5.743 -14.456 142 HD2 PRO 619 HD2 PRO 619 -6.920 4.778 -13.569 143 HD3 PRO 619 HD3 PRO 619 -7.004 5.697 -15.097 144 H LYS 620 H LYS 620 -7.789 9.996 -11.669 145 HA LYS 620 HA LYS 620 -6.947 9.352 -9.121 146 HB2 LYS 620 HB2 LYS 620 -8.372 10.991 -8.218 147 HB3 LYS 620 HB3 LYS 620 -7.648 11.553 -9.730 148 HG2 LYS 620 HG2 LYS 620 -9.787 10.966 -10.915 149 HG3 LYS 620 HG3 LYS 620 -10.503 10.533 -9.344 150 HD2 LYS 620 HD2 LYS 620 -10.208 12.824 -8.518 151 HD3 LYS 620 HD3 LYS 620 -9.317 13.260 -9.994 152 HE2 LYS 620 HE2 LYS 620 -11.471 14.023 -10.398 153 HE3 LYS 620 HE3 LYS 620 -11.307 12.512 -11.327 154 HZ1 LYS 620 HZ1 LYS 620 -13.432 12.643 -10.158 155 HZ2 LYS 620 HZ2 LYS 620 -12.668 12.767 -8.709 156 HZ3 LYS 620 HZ3 LYS 620 -12.538 11.385 -9.593 157 H SER 621 H SER 621 -10.088 8.413 -10.604 158 HA SER 621 HA SER 621 -11.347 7.352 -8.415 159 HB2 SER 621 HB2 SER 621 -11.474 6.227 -11.231 160 HB3 SER 621 HB3 SER 621 -12.768 6.303 -10.018 161 HG SER 621 HG SER 621 -12.994 7.966 -11.538 162 H ALA 622 H ALA 622 -8.596 5.917 -10.171 163 HA ALA 622 HA ALA 622 -9.018 3.186 -9.335 164 HB1 ALA 622 HB1 ALA 622 -7.468 3.815 -11.177 165 HB2 ALA 622 HB2 ALA 622 -6.430 4.668 -10.010 166 HB3 ALA 622 HB3 ALA 622 -6.637 2.914 -9.890 167 H ARG 623 H ARG 623 -6.937 5.853 -8.087 168 HA ARG 623 HA ARG 623 -6.350 4.444 -5.619 169 HB2 ARG 623 HB2 ARG 623 -4.934 6.143 -5.209 170 HB3 ARG 623 HB3 ARG 623 -5.221 6.614 -6.873 171 HG2 ARG 623 HG2 ARG 623 -7.059 8.172 -6.005 172 HG3 ARG 623 HG3 ARG 623 -6.555 7.733 -4.371 173 HD2 ARG 623 HD2 ARG 623 -4.204 8.537 -5.066 174 HD3 ARG 623 HD3 ARG 623 -4.968 9.157 -6.535 175 HE ARG 623 HE ARG 623 -6.010 10.827 -5.354 176 HH11 ARG 623 HH11 ARG 623 -4.486 8.654 -3.015 177 HH12 ARG 623 HH12 ARG 623 -4.890 9.606 -1.629 178 HH21 ARG 623 HH21 ARG 623 -6.599 12.084 -3.510 179 HH22 ARG 623 HH22 ARG 623 -6.089 11.611 -1.935 180 H GLU 624 H GLU 624 -8.875 6.795 -6.549 181 HA GLU 624 HA GLU 624 -9.835 7.080 -3.903 182 HB2 GLU 624 HB2 GLU 624 -10.342 8.496 -6.021 183 HB3 GLU 624 HB3 GLU 624 -11.613 7.312 -6.344 184 HG2 GLU 624 HG2 GLU 624 -12.447 9.333 -5.196 185 HG3 GLU 624 HG3 GLU 624 -12.742 7.851 -4.301 186 H LYS 625 H LYS 625 -10.319 4.444 -6.152 187 HA LYS 625 HA LYS 625 -12.174 3.069 -4.294 188 HB2 LYS 625 HB2 LYS 625 -10.578 2.172 -6.722 189 HB3 LYS 625 HB3 LYS 625 -11.379 1.026 -5.642 190 HG2 LYS 625 HG2 LYS 625 -13.538 1.810 -6.139 191 HG3 LYS 625 HG3 LYS 625 -12.918 3.312 -6.832 192 HD2 LYS 625 HD2 LYS 625 -13.636 1.928 -8.636 193 HD3 LYS 625 HD3 LYS 625 -11.860 2.010 -8.680 194 HE2 LYS 625 HE2 LYS 625 -11.661 -0.190 -7.704 195 HE3 LYS 625 HE3 LYS 625 -13.393 -0.263 -7.338 196 HZ1 LYS 625 HZ1 LYS 625 -12.713 -1.520 -9.330 197 HZ2 LYS 625 HZ2 LYS 625 -12.355 -0.101 -10.094 198 HZ3 LYS 625 HZ3 LYS 625 -13.903 -0.442 -9.612 199 H MET 626 H MET 626 -8.738 2.488 -5.291 200 HA MET 626 HA MET 626 -8.512 0.289 -3.543 201 HB2 MET 626 HB2 MET 626 -6.344 2.068 -4.732 202 HB3 MET 626 HB3 MET 626 -6.049 0.496 -3.975 203 HG2 MET 626 HG2 MET 626 -7.617 -0.514 -5.691 204 HG3 MET 626 HG3 MET 626 -7.675 1.049 -6.482 205 HE1 MET 626 HE1 MET 626 -4.471 -2.169 -6.833 206 HE2 MET 626 HE2 MET 626 -4.973 -1.674 -5.205 207 HE3 MET 626 HE3 MET 626 -6.173 -2.326 -6.349 208 H MET 627 H MET 627 -7.592 3.683 -3.142 209 HA MET 627 HA MET 627 -6.311 3.355 -0.666 210 HB2 MET 627 HB2 MET 627 -7.440 5.880 -1.924 211 HB3 MET 627 HB3 MET 627 -6.345 5.839 -0.559 212 HG2 MET 627 HG2 MET 627 -5.631 4.712 -3.290 213 HG3 MET 627 HG3 MET 627 -5.295 6.353 -2.754 214 HE1 MET 627 HE1 MET 627 -2.727 5.976 -3.423 215 HE2 MET 627 HE2 MET 627 -1.750 4.623 -2.811 216 HE3 MET 627 HE3 MET 627 -3.107 4.306 -3.915 217 H LYS 628 H LYS 628 -9.656 3.630 -1.582 218 HA LYS 628 HA LYS 628 -10.484 4.572 1.123 219 HB2 LYS 628 HB2 LYS 628 -12.079 3.785 -1.354 220 HB3 LYS 628 HB3 LYS 628 -12.827 3.973 0.226 221 HG2 LYS 628 HG2 LYS 628 -11.179 6.182 -1.069 222 HG3 LYS 628 HG3 LYS 628 -12.919 5.995 -1.313 223 HD2 LYS 628 HD2 LYS 628 -13.324 6.233 1.106 224 HD3 LYS 628 HD3 LYS 628 -11.576 6.441 1.383 225 HE2 LYS 628 HE2 LYS 628 -11.584 8.385 -0.190 226 HE3 LYS 628 HE3 LYS 628 -13.316 8.209 -0.399 227 HZ1 LYS 628 HZ1 LYS 628 -13.593 8.664 1.953 228 HZ2 LYS 628 HZ2 LYS 628 -12.763 9.884 1.215 229 HZ3 LYS 628 HZ3 LYS 628 -11.963 8.795 2.161 230 H ILE 629 H ILE 629 -10.760 1.660 -0.972 231 HA ILE 629 HA ILE 629 -11.920 0.007 0.970 232 HB ILE 629 HB ILE 629 -10.101 -0.744 -1.336 233 HG12 ILE 629 HG12 ILE 629 -12.684 -1.759 -1.745 234 HG13 ILE 629 HG13 ILE 629 -13.022 -0.210 -0.989 235 HG21 ILE 629 HG21 ILE 629 -9.917 -2.551 0.279 236 HG22 ILE 629 HG22 ILE 629 -11.669 -2.535 0.573 237 HG23 ILE 629 HG23 ILE 629 -11.016 -3.090 -0.977 238 HD11 ILE 629 HD11 ILE 629 -12.802 -0.600 -3.630 239 HD12 ILE 629 HD12 ILE 629 -12.426 0.932 -2.844 240 HD13 ILE 629 HD13 ILE 629 -11.114 -0.186 -3.288 241 H ILE 630 H ILE 630 -8.354 0.369 0.386 242 HA ILE 630 HA ILE 630 -7.564 -1.416 2.460 243 HB ILE 630 HB ILE 630 -5.541 0.111 2.742 244 HG12 ILE 630 HG12 ILE 630 -5.618 1.342 0.138 245 HG13 ILE 630 HG13 ILE 630 -6.950 1.940 1.121 246 HG21 ILE 630 HG21 ILE 630 -6.108 -1.073 -0.032 247 HG22 ILE 630 HG22 ILE 630 -4.498 -0.817 0.679 248 HG23 ILE 630 HG23 ILE 630 -5.605 -2.005 1.387 249 HD11 ILE 630 HD11 ILE 630 -4.026 1.932 1.939 250 HD12 ILE 630 HD12 ILE 630 -4.969 3.336 1.394 251 HD13 ILE 630 HD13 ILE 630 -5.380 2.541 2.926 252 H GLU 631 H GLU 631 -8.468 2.030 2.623 253 HA GLU 631 HA GLU 631 -7.524 2.317 5.305 254 HB2 GLU 631 HB2 GLU 631 -7.731 4.117 3.613 255 HB3 GLU 631 HB3 GLU 631 -9.495 4.043 3.733 256 HG2 GLU 631 HG2 GLU 631 -7.829 4.301 6.235 257 HG3 GLU 631 HG3 GLU 631 -7.948 5.690 5.159 258 H ILE 632 H ILE 632 -10.767 1.660 3.828 259 HA ILE 632 HA ILE 632 -12.136 1.511 6.312 260 HB ILE 632 HB ILE 632 -12.813 -0.481 4.171 261 HG12 ILE 632 HG12 ILE 632 -12.704 1.253 2.660 262 HG13 ILE 632 HG13 ILE 632 -14.378 1.167 3.093 263 HG21 ILE 632 HG21 ILE 632 -14.072 -0.393 6.319 264 HG22 ILE 632 HG22 ILE 632 -14.558 1.265 5.969 265 HG23 ILE 632 HG23 ILE 632 -15.108 -0.070 4.930 266 HD11 ILE 632 HD11 ILE 632 -14.100 3.151 4.594 267 HD12 ILE 632 HD12 ILE 632 -12.410 3.287 4.060 268 HD13 ILE 632 HD13 ILE 632 -13.715 3.481 2.890 269 H ILE 633 H ILE 633 -10.094 -0.920 4.618 270 HA ILE 633 HA ILE 633 -10.760 -3.113 6.303 271 HB ILE 633 HB ILE 633 -8.164 -2.645 4.776 272 HG12 ILE 633 HG12 ILE 633 -10.852 -3.369 3.851 273 HG13 ILE 633 HG13 ILE 633 -9.425 -2.837 2.971 274 HG21 ILE 633 HG21 ILE 633 -7.823 -5.051 4.979 275 HG22 ILE 633 HG22 ILE 633 -7.865 -4.274 6.557 276 HG23 ILE 633 HG23 ILE 633 -9.277 -5.184 5.989 277 HD11 ILE 633 HD11 ILE 633 -10.022 -5.698 3.709 278 HD12 ILE 633 HD12 ILE 633 -10.158 -4.932 2.114 279 HD13 ILE 633 HD13 ILE 633 -8.568 -5.116 2.859 280 H ASP 634 H ASP 634 -8.049 -0.724 6.408 281 HA ASP 634 HA ASP 634 -7.056 -1.981 8.804 282 HB2 ASP 634 HB2 ASP 634 -6.223 0.460 7.259 283 HB3 ASP 634 HB3 ASP 634 -5.624 0.235 8.900 284 H SER 635 H SER 635 -9.178 0.820 8.223 285 HA SER 635 HA SER 635 -9.191 1.723 10.928 286 HB2 SER 635 HB2 SER 635 -11.101 2.093 8.587 287 HB3 SER 635 HB3 SER 635 -11.337 2.867 10.167 288 HG SER 635 HG SER 635 -9.934 3.930 8.260 289 H LEU 636 H LEU 636 -11.147 -0.765 9.193 290 HA LEU 636 HA LEU 636 -12.781 -1.334 11.540 291 HB2 LEU 636 HB2 LEU 636 -12.117 -2.861 9.014 292 HB3 LEU 636 HB3 LEU 636 -13.165 -3.533 10.262 293 HG LEU 636 HG LEU 636 -13.750 -0.852 8.923 294 HD11 LEU 636 HD11 LEU 636 -13.650 -2.566 7.186 295 HD12 LEU 636 HD12 LEU 636 -15.330 -2.106 7.481 296 HD13 LEU 636 HD13 LEU 636 -14.703 -3.637 8.139 297 HD21 LEU 636 HD21 LEU 636 -16.050 -1.292 9.687 298 HD22 LEU 636 HD22 LEU 636 -14.938 -1.243 11.057 299 HD23 LEU 636 HD23 LEU 636 -15.531 -2.806 10.448 300 H ALA 637 H ALA 637 -9.686 -2.579 10.233 301 HA ALA 637 HA ALA 637 -9.359 -4.605 12.241 302 HB1 ALA 637 HB1 ALA 637 -7.202 -4.946 11.268 303 HB2 ALA 637 HB2 ALA 637 -8.358 -4.658 9.950 304 HB3 ALA 637 HB3 ALA 637 -7.241 -3.364 10.468 305 H VAL 638 H VAL 638 -9.331 -1.339 12.796 306 HA VAL 638 HA VAL 638 -7.001 -0.914 14.297 307 HB VAL 638 HB VAL 638 -8.743 0.719 13.409 308 HG11 VAL 638 HG11 VAL 638 -10.563 1.416 14.822 309 HG12 VAL 638 HG12 VAL 638 -10.733 -0.324 14.563 310 HG13 VAL 638 HG13 VAL 638 -10.100 0.286 16.108 311 HG21 VAL 638 HG21 VAL 638 -6.808 1.432 14.736 312 HG22 VAL 638 HG22 VAL 638 -8.236 2.438 15.025 313 HG23 VAL 638 HG23 VAL 638 -7.750 1.230 16.230 314 H SER 639 H SER 639 -9.367 -3.123 15.007 315 HA SER 639 HA SER 639 -8.025 -3.901 17.382 316 HB2 SER 639 HB2 SER 639 -10.914 -3.000 17.761 317 HB3 SER 639 HB3 SER 639 -9.999 -3.978 18.926 318 HG SER 639 HG SER 639 -8.683 -1.704 18.042 319 H SER 640 H SER 640 -10.753 -4.364 15.074 320 HA SER 640 HA SER 640 -11.229 -7.085 15.563 321 HB2 SER 640 HB2 SER 640 -11.176 -5.878 12.790 322 HB3 SER 640 HB3 SER 640 -12.329 -7.026 13.485 323 HG SER 640 HG SER 640 -12.239 -4.258 13.505 324 H GLU 641 H GLU 641 -10.123 -9.000 14.810 325 HA GLU 641 HA GLU 641 -7.372 -8.753 14.061 326 HB2 GLU 641 HB2 GLU 641 -7.455 -11.165 13.679 327 HB3 GLU 641 HB3 GLU 641 -8.145 -10.720 15.241 328 HG2 GLU 641 HG2 GLU 641 -10.402 -11.072 14.463 329 HG3 GLU 641 HG3 GLU 641 -9.874 -11.224 12.788 330 H CYS 642 H CYS 642 -10.264 -8.572 12.156 331 HA CYS 642 HA CYS 642 -8.797 -7.918 9.791 332 HB2 CYS 642 HB2 CYS 642 -9.926 -9.637 8.363 333 HB3 CYS 642 HB3 CYS 642 -8.797 -10.332 9.515 334 H ALA 643 H ALA 643 -10.380 -7.158 8.149 335 HA ALA 643 HA ALA 643 -12.756 -5.837 9.315 336 HB1 ALA 643 HB1 ALA 643 -11.413 -5.709 6.579 337 HB2 ALA 643 HB2 ALA 643 -12.766 -4.701 7.110 338 HB3 ALA 643 HB3 ALA 643 -11.179 -4.568 7.913 339 H LYS 644 H LYS 644 -14.652 -6.991 9.252 340 HA LYS 644 HA LYS 644 -15.034 -9.343 7.644 341 HB2 LYS 644 HB2 LYS 644 -17.373 -7.700 8.629 342 HB3 LYS 644 HB3 LYS 644 -17.248 -9.426 8.369 343 HG2 LYS 644 HG2 LYS 644 -17.055 -9.530 10.633 344 HG3 LYS 644 HG3 LYS 644 -15.364 -9.147 10.333 345 HD2 LYS 644 HD2 LYS 644 -15.920 -7.517 11.902 346 HD3 LYS 644 HD3 LYS 644 -16.236 -6.624 10.397 347 HE2 LYS 644 HE2 LYS 644 -18.644 -7.377 10.552 348 HE3 LYS 644 HE3 LYS 644 -18.279 -8.070 12.148 349 HZ1 LYS 644 HZ1 LYS 644 -17.600 -5.755 12.780 350 HZ2 LYS 644 HZ2 LYS 644 -19.203 -5.887 12.372 351 HZ3 LYS 644 HZ3 LYS 644 -18.159 -5.237 11.311 352 H VAL 645 H VAL 645 -15.759 -9.545 5.543 353 HA VAL 645 HA VAL 645 -15.411 -7.293 3.925 354 HB VAL 645 HB VAL 645 -15.163 -9.784 3.408 355 HG11 VAL 645 HG11 VAL 645 -18.039 -9.547 2.439 356 HG12 VAL 645 HG12 VAL 645 -16.947 -10.933 2.282 357 HG13 VAL 645 HG13 VAL 645 -17.539 -10.457 3.885 358 HG21 VAL 645 HG21 VAL 645 -14.688 -8.053 1.830 359 HG22 VAL 645 HG22 VAL 645 -15.465 -9.421 1.007 360 HG23 VAL 645 HG23 VAL 645 -16.396 -7.944 1.337 361 H LYS 646 H LYS 646 -18.276 -8.334 5.542 362 HA LYS 646 HA LYS 646 -20.263 -7.125 3.848 363 HB2 LYS 646 HB2 LYS 646 -20.562 -8.903 5.653 364 HB3 LYS 646 HB3 LYS 646 -20.374 -7.622 6.861 365 HG2 LYS 646 HG2 LYS 646 -22.376 -6.474 5.971 366 HG3 LYS 646 HG3 LYS 646 -22.496 -7.671 4.662 367 HD2 LYS 646 HD2 LYS 646 -22.789 -9.474 6.367 368 HD3 LYS 646 HD3 LYS 646 -22.762 -8.242 7.648 369 HE2 LYS 646 HE2 LYS 646 -24.754 -7.160 6.667 370 HE3 LYS 646 HE3 LYS 646 -24.750 -8.326 5.334 371 HZ1 LYS 646 HZ1 LYS 646 -25.144 -10.077 6.937 372 HZ2 LYS 646 HZ2 LYS 646 -26.329 -8.941 7.032 373 HZ3 LYS 646 HZ3 LYS 646 -25.152 -8.998 8.180 374 H ASP 647 H ASP 647 -18.228 -5.944 6.562 375 HA ASP 647 HA ASP 647 -19.594 -3.432 6.876 376 HB2 ASP 647 HB2 ASP 647 -16.803 -4.384 7.648 377 HB3 ASP 647 HB3 ASP 647 -17.510 -2.843 8.125 378 H ILE 648 H ILE 648 -16.739 -4.642 5.107 379 HA ILE 648 HA ILE 648 -15.889 -2.108 4.102 380 HB ILE 648 HB ILE 648 -15.505 -4.778 2.663 381 HG12 ILE 648 HG12 ILE 648 -13.745 -3.722 4.917 382 HG13 ILE 648 HG13 ILE 648 -14.840 -5.084 5.037 383 HG21 ILE 648 HG21 ILE 648 -13.488 -3.746 1.750 384 HG22 ILE 648 HG22 ILE 648 -14.843 -2.667 1.460 385 HG23 ILE 648 HG23 ILE 648 -13.708 -2.312 2.777 386 HD11 ILE 648 HD11 ILE 648 -13.595 -6.259 3.203 387 HD12 ILE 648 HD12 ILE 648 -12.386 -4.971 3.281 388 HD13 ILE 648 HD13 ILE 648 -12.671 -6.001 4.689 389 H LEU 649 H LEU 649 -17.878 -4.688 2.614 390 HA LEU 649 HA LEU 649 -18.600 -3.373 0.241 391 HB2 LEU 649 HB2 LEU 649 -19.931 -5.409 2.046 392 HB3 LEU 649 HB3 LEU 649 -20.821 -4.782 0.671 393 HG LEU 649 HG LEU 649 -18.026 -5.905 0.284 394 HD11 LEU 649 HD11 LEU 649 -19.326 -7.654 1.434 395 HD12 LEU 649 HD12 LEU 649 -19.041 -8.084 -0.259 396 HD13 LEU 649 HD13 LEU 649 -20.637 -7.482 0.247 397 HD21 LEU 649 HD21 LEU 649 -19.111 -4.604 -1.569 398 HD22 LEU 649 HD22 LEU 649 -20.467 -5.741 -1.550 399 HD23 LEU 649 HD23 LEU 649 -18.845 -6.301 -2.001 400 H LYS 650 H LYS 650 -20.105 -3.118 3.503 401 HA LYS 650 HA LYS 650 -22.257 -1.406 2.663 402 HB2 LYS 650 HB2 LYS 650 -22.293 -2.586 4.835 403 HB3 LYS 650 HB3 LYS 650 -20.882 -1.678 5.366 404 HG2 LYS 650 HG2 LYS 650 -22.426 0.444 4.859 405 HG3 LYS 650 HG3 LYS 650 -23.736 -0.727 5.008 406 HD2 LYS 650 HD2 LYS 650 -23.035 -1.247 7.305 407 HD3 LYS 650 HD3 LYS 650 -21.536 -0.323 7.080 408 HE2 LYS 650 HE2 LYS 650 -23.102 1.684 6.525 409 HE3 LYS 650 HE3 LYS 650 -24.369 0.736 7.328 410 HZ1 LYS 650 HZ1 LYS 650 -22.872 0.687 9.285 411 HZ2 LYS 650 HZ2 LYS 650 -23.213 2.248 8.838 412 HZ3 LYS 650 HZ3 LYS 650 -21.762 1.581 8.461 413 H GLU 651 H GLU 651 -19.184 -0.513 4.399 414 HA GLU 651 HA GLU 651 -19.901 2.245 4.104 415 HB2 GLU 651 HB2 GLU 651 -17.204 1.069 4.850 416 HB3 GLU 651 HB3 GLU 651 -17.720 2.718 5.147 417 HG2 GLU 651 HG2 GLU 651 -18.821 0.193 6.446 418 HG3 GLU 651 HG3 GLU 651 -17.790 1.396 7.189 419 H ALA 652 H ALA 652 -17.803 0.157 2.121 420 HA ALA 652 HA ALA 652 -16.734 2.322 0.546 421 HB1 ALA 652 HB1 ALA 652 -17.171 -0.576 -0.195 422 HB2 ALA 652 HB2 ALA 652 -16.048 0.592 -0.952 423 HB3 ALA 652 HB3 ALA 652 -15.763 0.039 0.704 424 H GLN 653 H GLN 653 -19.777 0.269 0.230 425 HA GLN 653 HA GLN 653 -20.461 1.668 -2.222 426 HB2 GLN 653 HB2 GLN 653 -22.096 -0.040 -0.333 427 HB3 GLN 653 HB3 GLN 653 -22.719 0.668 -1.832 428 HG2 GLN 653 HG2 GLN 653 -21.045 -0.468 -3.178 429 HG3 GLN 653 HG3 GLN 653 -20.233 -1.116 -1.766 430 HE21 GLN 653 HE21 GLN 653 -21.625 -2.450 -0.318 431 HE22 GLN 653 HE22 GLN 653 -22.789 -3.568 -1.077 432 H GLN 654 H GLN 654 -21.061 2.330 1.252 433 HA GLN 654 HA GLN 654 -22.784 4.592 0.745 434 HB2 GLN 654 HB2 GLN 654 -20.879 4.167 3.093 435 HB3 GLN 654 HB3 GLN 654 -22.082 5.441 2.939 436 HG2 GLN 654 HG2 GLN 654 -23.746 3.381 2.558 437 HG3 GLN 654 HG3 GLN 654 -22.511 2.515 3.475 438 HE21 GLN 654 HE21 GLN 654 -21.877 3.541 5.756 439 HE22 GLN 654 HE22 GLN 654 -23.168 4.514 6.470 440 H VAL 655 H VAL 655 -19.192 4.340 0.941 441 HA VAL 655 HA VAL 655 -18.627 7.054 0.282 442 HB VAL 655 HB VAL 655 -17.162 4.425 -0.003 443 HG11 VAL 655 HG11 VAL 655 -15.105 5.583 -0.634 444 HG12 VAL 655 HG12 VAL 655 -16.310 5.669 -1.914 445 HG13 VAL 655 HG13 VAL 655 -16.018 7.092 -0.887 446 HG21 VAL 655 HG21 VAL 655 -16.546 6.926 1.612 447 HG22 VAL 655 HG22 VAL 655 -17.401 5.507 2.237 448 HG23 VAL 655 HG23 VAL 655 -15.722 5.351 1.714 449 H GLY 656 H GLY 656 -19.578 4.327 -1.782 450 HA2 GLY 656 HA2 GLY 656 -21.208 5.217 -3.462 451 HA3 GLY 656 HA3 GLY 656 -19.940 6.301 -4.028 452 H ILE 657 H ILE 657 -18.744 3.173 -3.191 453 HA ILE 657 HA ILE 657 -18.244 2.541 -6.014 454 HB ILE 657 HB ILE 657 -17.437 1.294 -3.366 455 HG12 ILE 657 HG12 ILE 657 -15.579 2.676 -5.329 456 HG13 ILE 657 HG13 ILE 657 -16.497 3.637 -4.190 457 HG21 ILE 657 HG21 ILE 657 -17.265 -0.552 -4.884 458 HG22 ILE 657 HG22 ILE 657 -16.641 0.480 -6.197 459 HG23 ILE 657 HG23 ILE 657 -15.643 0.094 -4.793 460 HD11 ILE 657 HD11 ILE 657 -14.606 1.425 -3.346 461 HD12 ILE 657 HD12 ILE 657 -14.277 3.168 -3.309 462 HD13 ILE 657 HD13 ILE 657 -15.545 2.489 -2.279 463 H GLU 658 H GLU 658 -18.577 -0.220 -6.295 464 HA GLU 658 HA GLU 658 -21.476 -0.687 -5.791 465 HB2 GLU 658 HB2 GLU 658 -21.098 -0.006 -8.081 466 HB3 GLU 658 HB3 GLU 658 -19.695 -1.059 -8.233 467 HG2 GLU 658 HG2 GLU 658 -22.454 -2.169 -7.739 468 HG3 GLU 658 HG3 GLU 658 -21.977 -1.662 -9.353 469 H LYS 659 H LYS 659 -21.723 -2.707 -4.784 470 HA LYS 659 HA LYS 659 -20.298 -4.378 -3.632 471 HB2 LYS 659 HB2 LYS 659 -21.803 -5.810 -5.874 472 HB3 LYS 659 HB3 LYS 659 -21.355 -6.402 -4.324 473 HG2 LYS 659 HG2 LYS 659 -23.558 -6.303 -4.251 474 HG3 LYS 659 HG3 LYS 659 -23.072 -4.918 -3.288 475 HD2 LYS 659 HD2 LYS 659 -25.144 -4.983 -5.052 476 HD3 LYS 659 HD3 LYS 659 -24.324 -3.517 -4.594 477 HE2 LYS 659 HE2 LYS 659 -24.562 -3.454 -6.957 478 HE3 LYS 659 HE3 LYS 659 -22.859 -3.693 -6.562 479 HZ1 LYS 659 HZ1 LYS 659 -23.013 -5.155 -8.102 480 HZ2 LYS 659 HZ2 LYS 659 -24.643 -5.511 -7.918 481 HZ3 LYS 659 HZ3 LYS 659 -23.493 -6.170 -6.910 482 H SER 660 H SER 660 -20.172 -4.714 -7.267 483 HA SER 660 HA SER 660 -18.440 -7.023 -6.684 484 HB2 SER 660 HB2 SER 660 -20.530 -6.938 -8.214 485 HB3 SER 660 HB3 SER 660 -19.400 -6.328 -9.437 486 HG SER 660 HG SER 660 -19.125 -8.725 -7.787 487 H ASN 661 H ASN 661 -18.177 -3.793 -7.827 488 HA ASN 661 HA ASN 661 -15.417 -3.792 -8.583 489 HB2 ASN 661 HB2 ASN 661 -17.087 -1.708 -7.183 490 HB3 ASN 661 HB3 ASN 661 -15.377 -1.598 -7.367 491 HD21 ASN 661 HD21 ASN 661 -18.334 -2.415 -9.453 492 HD22 ASN 661 HD22 ASN 661 -17.701 -1.503 -10.814 493 H ILE 662 H ILE 662 -16.996 -4.094 -5.317 494 HA ILE 662 HA ILE 662 -14.490 -3.637 -3.886 495 HB ILE 662 HB ILE 662 -17.071 -4.914 -2.889 496 HG12 ILE 662 HG12 ILE 662 -17.545 -2.629 -3.843 497 HG13 ILE 662 HG13 ILE 662 -17.876 -2.771 -2.132 498 HG21 ILE 662 HG21 ILE 662 -14.725 -3.737 -1.407 499 HG22 ILE 662 HG22 ILE 662 -16.311 -4.059 -0.665 500 HG23 ILE 662 HG23 ILE 662 -15.381 -5.378 -1.364 501 HD11 ILE 662 HD11 ILE 662 -15.741 -1.694 -1.618 502 HD12 ILE 662 HD12 ILE 662 -15.423 -1.540 -3.364 503 HD13 ILE 662 HD13 ILE 662 -16.831 -0.719 -2.623 504 H GLU 663 H GLU 663 -16.496 -6.236 -5.079 505 HA GLU 663 HA GLU 663 -15.200 -8.449 -3.724 506 HB2 GLU 663 HB2 GLU 663 -16.653 -8.498 -6.409 507 HB3 GLU 663 HB3 GLU 663 -16.233 -9.900 -5.429 508 HG2 GLU 663 HG2 GLU 663 -17.720 -9.043 -3.612 509 HG3 GLU 663 HG3 GLU 663 -18.169 -7.712 -4.607 510 H LYS 664 H LYS 664 -14.920 -7.180 -7.066 511 HA LYS 664 HA LYS 664 -12.739 -8.897 -7.660 512 HB2 LYS 664 HB2 LYS 664 -12.729 -7.955 -9.802 513 HB3 LYS 664 HB3 LYS 664 -14.378 -7.893 -9.275 514 HG2 LYS 664 HG2 LYS 664 -14.097 -5.852 -10.312 515 HG3 LYS 664 HG3 LYS 664 -14.008 -5.465 -8.609 516 HD2 LYS 664 HD2 LYS 664 -12.457 -4.178 -9.998 517 HD3 LYS 664 HD3 LYS 664 -11.583 -5.057 -8.775 518 HE2 LYS 664 HE2 LYS 664 -11.992 -6.186 -11.551 519 HE3 LYS 664 HE3 LYS 664 -10.708 -5.012 -11.223 520 HZ1 LYS 664 HZ1 LYS 664 -10.595 -7.115 -9.314 521 HZ2 LYS 664 HZ2 LYS 664 -9.437 -6.602 -10.332 522 HZ3 LYS 664 HZ3 LYS 664 -10.514 -7.709 -10.856 523 H LEU 665 H LEU 665 -12.846 -5.648 -6.199 524 HA LEU 665 HA LEU 665 -10.047 -5.126 -6.663 525 HB2 LEU 665 HB2 LEU 665 -11.742 -3.379 -6.341 526 HB3 LEU 665 HB3 LEU 665 -11.964 -3.842 -4.660 527 HG LEU 665 HG LEU 665 -9.135 -3.239 -5.512 528 HD11 LEU 665 HD11 LEU 665 -10.206 -1.561 -6.826 529 HD12 LEU 665 HD12 LEU 665 -9.703 -0.746 -5.337 530 HD13 LEU 665 HD13 LEU 665 -11.397 -1.214 -5.544 531 HD21 LEU 665 HD21 LEU 665 -9.334 -1.903 -3.338 532 HD22 LEU 665 HD22 LEU 665 -9.601 -3.649 -3.166 533 HD23 LEU 665 HD23 LEU 665 -10.974 -2.536 -3.198 534 H LEU 666 H LEU 666 -11.912 -6.175 -3.737 535 HA LEU 666 HA LEU 666 -9.808 -6.739 -1.955 536 HB2 LEU 666 HB2 LEU 666 -12.369 -8.253 -2.596 537 HB3 LEU 666 HB3 LEU 666 -11.327 -8.703 -1.262 538 HG LEU 666 HG LEU 666 -12.495 -5.899 -1.412 539 HD11 LEU 666 HD11 LEU 666 -14.331 -6.800 0.006 540 HD12 LEU 666 HD12 LEU 666 -13.707 -8.451 -0.272 541 HD13 LEU 666 HD13 LEU 666 -14.356 -7.504 -1.618 542 HD21 LEU 666 HD21 LEU 666 -12.269 -6.037 1.038 543 HD22 LEU 666 HD22 LEU 666 -10.702 -6.308 0.257 544 HD23 LEU 666 HD23 LEU 666 -11.621 -7.683 0.912 545 H THR 667 H THR 667 -11.137 -8.688 -4.635 546 HA THR 667 HA THR 667 -9.544 -11.000 -4.213 547 HB THR 667 HB THR 667 -10.795 -9.900 -6.765 548 HG1 THR 667 HG1 THR 667 -12.373 -10.298 -5.295 549 HG21 THR 667 HG21 THR 667 -10.659 -12.294 -7.492 550 HG22 THR 667 HG22 THR 667 -9.608 -12.609 -6.080 551 HG23 THR 667 HG23 THR 667 -9.087 -11.491 -7.355 552 H ASP 668 H ASP 668 -9.011 -8.052 -6.318 553 HA ASP 668 HA ASP 668 -6.669 -9.139 -7.536 554 HB2 ASP 668 HB2 ASP 668 -8.319 -6.769 -7.627 555 HB3 ASP 668 HB3 ASP 668 -6.663 -6.255 -7.422 556 H MET 669 H MET 669 -7.309 -7.034 -4.757 557 HA MET 669 HA MET 669 -4.643 -6.499 -3.980 558 HB2 MET 669 HB2 MET 669 -7.206 -6.711 -2.331 559 HB3 MET 669 HB3 MET 669 -5.663 -6.096 -1.747 560 HG2 MET 669 HG2 MET 669 -5.880 -4.539 -3.905 561 HG3 MET 669 HG3 MET 669 -7.567 -4.843 -3.685 562 HE1 MET 669 HE1 MET 669 -7.186 -2.187 -3.784 563 HE2 MET 669 HE2 MET 669 -7.031 -1.229 -2.291 564 HE3 MET 669 HE3 MET 669 -5.581 -1.890 -3.082 565 H ARG 670 H ARG 670 -6.840 -9.154 -2.852 566 HA ARG 670 HA ARG 670 -4.769 -10.223 -1.155 567 HB2 ARG 670 HB2 ARG 670 -6.331 -11.765 -0.406 568 HB3 ARG 670 HB3 ARG 670 -7.232 -10.293 -0.691 569 HG2 ARG 670 HG2 ARG 670 -8.730 -11.466 -1.764 570 HG3 ARG 670 HG3 ARG 670 -7.589 -11.683 -3.088 571 HD2 ARG 670 HD2 ARG 670 -6.954 -13.840 -2.344 572 HD3 ARG 670 HD3 ARG 670 -7.507 -13.523 -0.696 573 HE ARG 670 HE ARG 670 -9.607 -13.511 -2.741 574 HH11 ARG 670 HH11 ARG 670 -7.926 -15.647 -0.462 575 HH12 ARG 670 HH12 ARG 670 -9.398 -16.122 0.376 576 HH21 ARG 670 HH21 ARG 670 -11.578 -14.303 -1.700 577 HH22 ARG 670 HH22 ARG 670 -11.381 -15.235 -0.255 578 H LYS 671 H LYS 671 -5.675 -10.818 -4.465 579 HA LYS 671 HA LYS 671 -4.039 -13.183 -4.778 580 HB2 LYS 671 HB2 LYS 671 -5.870 -12.585 -6.317 581 HB3 LYS 671 HB3 LYS 671 -5.083 -11.053 -6.670 582 HG2 LYS 671 HG2 LYS 671 -3.135 -12.465 -7.657 583 HG3 LYS 671 HG3 LYS 671 -4.220 -13.851 -7.486 584 HD2 LYS 671 HD2 LYS 671 -4.414 -13.011 -9.753 585 HD3 LYS 671 HD3 LYS 671 -5.914 -12.612 -8.894 586 HE2 LYS 671 HE2 LYS 671 -4.941 -10.305 -8.440 587 HE3 LYS 671 HE3 LYS 671 -3.558 -10.726 -9.446 588 HZ1 LYS 671 HZ1 LYS 671 -5.549 -9.445 -10.354 589 HZ2 LYS 671 HZ2 LYS 671 -6.307 -10.879 -10.475 590 HZ3 LYS 671 HZ3 LYS 671 -4.900 -10.643 -11.324 591 H SER 672 H SER 672 -3.541 -9.639 -5.246 592 HA SER 672 HA SER 672 -0.895 -9.884 -6.285 593 HB2 SER 672 HB2 SER 672 -2.466 -8.018 -6.713 594 HB3 SER 672 HB3 SER 672 -2.339 -7.514 -5.016 595 HG SER 672 HG SER 672 -0.967 -6.356 -6.484 596 H GLY 673 H GLY 673 -2.142 -9.281 -2.984 597 HA2 GLY 673 HA2 GLY 673 -0.793 -10.069 -1.073 598 HA3 GLY 673 HA3 GLY 673 0.656 -9.506 -1.912 599 H ILE 674 H ILE 674 -2.205 -7.517 -2.139 600 HA ILE 674 HA ILE 674 -0.941 -5.347 -0.584 601 HB ILE 674 HB ILE 674 -3.548 -5.589 -2.141 602 HG12 ILE 674 HG12 ILE 674 -0.967 -4.151 -2.859 603 HG13 ILE 674 HG13 ILE 674 -1.513 -5.672 -3.546 604 HG21 ILE 674 HG21 ILE 674 -2.367 -3.077 -0.895 605 HG22 ILE 674 HG22 ILE 674 -3.820 -3.156 -1.920 606 HG23 ILE 674 HG23 ILE 674 -3.833 -3.914 -0.350 607 HD11 ILE 674 HD11 ILE 674 -3.540 -4.527 -4.464 608 HD12 ILE 674 HD12 ILE 674 -2.843 -2.974 -3.938 609 HD13 ILE 674 HD13 ILE 674 -1.997 -3.966 -5.131 610 H ILE 675 H ILE 675 -3.556 -7.765 -0.325 611 HA ILE 675 HA ILE 675 -3.749 -7.184 2.541 612 HB ILE 675 HB ILE 675 -6.113 -7.167 2.633 613 HG12 ILE 675 HG12 ILE 675 -6.112 -7.913 -0.302 614 HG13 ILE 675 HG13 ILE 675 -6.717 -8.849 1.064 615 HG21 ILE 675 HG21 ILE 675 -5.579 -5.342 0.264 616 HG22 ILE 675 HG22 ILE 675 -6.716 -5.102 1.594 617 HG23 ILE 675 HG23 ILE 675 -4.991 -4.994 1.868 618 HD11 ILE 675 HD11 ILE 675 -7.946 -6.306 -0.054 619 HD12 ILE 675 HD12 ILE 675 -8.591 -7.952 -0.126 620 HD13 ILE 675 HD13 ILE 675 -8.475 -7.118 1.438 621 H TYR 676 H TYR 676 -5.000 -9.142 3.576 622 HA TYR 676 HA TYR 676 -4.834 -11.577 1.895 623 HB2 TYR 676 HB2 TYR 676 -4.069 -12.861 3.854 624 HB3 TYR 676 HB3 TYR 676 -2.882 -11.701 3.292 625 HD1 TYR 676 HD2 TYR 676 -5.355 -12.412 6.003 626 HD2 TYR 676 HD1 TYR 676 -2.072 -9.936 4.724 627 HE1 TYR 676 HE2 TYR 676 -5.097 -11.600 8.307 628 HE2 TYR 676 HE1 TYR 676 -1.817 -9.079 7.043 629 HH TYR 676 HH TYR 676 -3.906 -10.179 9.735 630 H GLU 677 H GLU 677 -6.371 -13.261 2.640 631 HA GLU 677 HA GLU 677 -8.763 -12.227 3.954 632 HB2 GLU 677 HB2 GLU 677 -8.722 -13.657 1.825 633 HB3 GLU 677 HB3 GLU 677 -8.153 -15.003 2.822 634 HG2 GLU 677 HG2 GLU 677 -10.127 -14.942 4.113 635 HG3 GLU 677 HG3 GLU 677 -10.695 -13.465 3.279 636 H ALA 678 H ALA 678 -7.039 -15.298 4.212 637 HA ALA 678 HA ALA 678 -6.498 -16.668 5.871 638 HB1 ALA 678 HB1 ALA 678 -5.379 -15.774 7.823 639 HB2 ALA 678 HB2 ALA 678 -4.891 -14.843 6.386 640 HB3 ALA 678 HB3 ALA 678 -6.065 -14.167 7.536 641 H LYS 679 H LYS 679 -9.392 -14.979 5.989 642 HA LYS 679 HA LYS 679 -10.249 -16.255 8.454 643 HB2 LYS 679 HB2 LYS 679 -10.429 -13.321 7.675 644 HB3 LYS 679 HB3 LYS 679 -11.219 -13.957 9.099 645 HG2 LYS 679 HG2 LYS 679 -8.192 -14.201 8.893 646 HG3 LYS 679 HG3 LYS 679 -8.906 -12.645 9.145 647 HD2 LYS 679 HD2 LYS 679 -8.349 -13.488 11.260 648 HD3 LYS 679 HD3 LYS 679 -10.112 -13.508 11.149 649 HE2 LYS 679 HE2 LYS 679 -10.050 -15.949 10.692 650 HE3 LYS 679 HE3 LYS 679 -8.278 -15.918 10.775 651 HZ1 LYS 679 HZ1 LYS 679 -10.083 -15.110 13.003 652 HZ2 LYS 679 HZ2 LYS 679 -8.544 -15.039 13.086 653 HZ3 LYS 679 HZ3 LYS 679 -9.238 -16.563 12.936 654 HA PRO 680 HA PRO 680 -13.992 -16.964 6.217 655 HB2 PRO 680 HB2 PRO 680 -15.997 -16.730 8.092 656 HB3 PRO 680 HB3 PRO 680 -14.853 -18.102 8.016 657 HG2 PRO 680 HG2 PRO 680 -14.698 -15.638 9.774 658 HG3 PRO 680 HG3 PRO 680 -14.476 -17.353 10.246 659 HD2 PRO 680 HD2 PRO 680 -12.363 -15.730 9.748 660 HD3 PRO 680 HD3 PRO 680 -12.333 -17.447 9.245 661 H GLU 681 H GLU 681 -14.513 -15.527 4.730 662 HA GLU 681 HA GLU 681 -14.914 -13.584 3.657 663 HB2 GLU 681 HB2 GLU 681 -17.183 -12.825 3.889 664 HB3 GLU 681 HB3 GLU 681 -17.071 -14.555 3.810 665 HG2 GLU 681 HG2 GLU 681 -17.421 -13.053 6.447 666 HG3 GLU 681 HG3 GLU 681 -18.769 -13.488 5.413 667 H CYS 682 H CYS 682 -12.953 -12.990 5.396 668 HA CYS 682 HA CYS 682 -13.485 -10.211 6.200 669 HB2 CYS 682 HB2 CYS 682 -14.105 -11.847 8.019 670 HB3 CYS 682 HB3 CYS 682 -12.455 -12.410 8.040 671 H TYR 683 H TYR 683 -11.542 -8.976 6.148 672 HA TYR 683 HA TYR 683 -9.134 -10.375 5.065 673 HB2 TYR 683 HB2 TYR 683 -10.587 -7.988 3.842 674 HB3 TYR 683 HB3 TYR 683 -9.020 -8.589 3.315 675 HD1 TYR 683 HD1 TYR 683 -12.654 -9.364 3.480 676 HD2 TYR 683 HD2 TYR 683 -8.822 -10.507 1.856 677 HE1 TYR 683 HE1 TYR 683 -13.768 -11.061 2.041 678 HE2 TYR 683 HE2 TYR 683 -9.944 -12.175 0.402 679 HH TYR 683 HH TYR 683 -12.245 -13.622 0.855 680 H LYS 684 H LYS 684 -7.145 -9.101 5.197 681 HA LYS 684 HA LYS 684 -7.344 -6.596 6.755 682 HB2 LYS 684 HB2 LYS 684 -7.074 -8.747 8.237 683 HB3 LYS 684 HB3 LYS 684 -5.408 -8.679 7.706 684 HG2 LYS 684 HG2 LYS 684 -6.920 -6.457 9.159 685 HG3 LYS 684 HG3 LYS 684 -5.817 -7.613 9.920 686 HD2 LYS 684 HD2 LYS 684 -4.041 -6.780 8.254 687 HD3 LYS 684 HD3 LYS 684 -5.185 -5.448 7.927 688 HE2 LYS 684 HE2 LYS 684 -5.048 -4.783 10.307 689 HE3 LYS 684 HE3 LYS 684 -3.726 -5.962 10.490 690 HZ1 LYS 684 HZ1 LYS 684 -2.743 -4.776 8.469 691 HZ2 LYS 684 HZ2 LYS 684 -2.750 -3.882 9.885 692 HZ3 LYS 684 HZ3 LYS 684 -3.861 -3.595 8.710 693 H LYS 685 H LYS 685 -5.842 -5.144 6.123 694 HA LYS 685 HA LYS 685 -4.320 -5.468 3.741 695 HB2 LYS 685 HB2 LYS 685 -5.547 -3.413 4.825 696 HB3 LYS 685 HB3 LYS 685 -4.082 -3.235 5.780 697 HG2 LYS 685 HG2 LYS 685 -4.064 -3.292 2.749 698 HG3 LYS 685 HG3 LYS 685 -4.417 -1.822 3.639 699 HD2 LYS 685 HD2 LYS 685 -2.262 -1.541 4.402 700 HD3 LYS 685 HD3 LYS 685 -1.896 -3.257 4.353 701 HE2 LYS 685 HE2 LYS 685 -2.175 -3.073 1.774 702 HE3 LYS 685 HE3 LYS 685 -2.043 -1.327 2.023 703 HZ1 LYS 685 HZ1 LYS 685 -0.070 -3.443 2.213 704 HZ2 LYS 685 HZ2 LYS 685 0.047 -2.505 3.433 705 HZ3 LYS 685 HZ3 LYS 685 0.206 -1.823 1.893 706 H VAL 686 H VAL 686 -2.123 -5.739 3.410 707 HA VAL 686 HA VAL 686 -0.333 -5.840 5.755 708 HB VAL 686 HB VAL 686 -0.520 -8.106 5.212 709 HG11 VAL 686 HG11 VAL 686 -0.262 -7.452 2.258 710 HG12 VAL 686 HG12 VAL 686 -0.216 -9.086 2.940 711 HG13 VAL 686 HG13 VAL 686 -1.684 -8.116 3.084 712 HG21 VAL 686 HG21 VAL 686 1.809 -7.267 5.441 713 HG22 VAL 686 HG22 VAL 686 1.688 -8.739 4.459 714 HG23 VAL 686 HG23 VAL 686 1.922 -7.169 3.669 Start of MODEL 14 1 H1 GLY 600 H1 GLY 600 0.040 -6.110 -21.447 2 H2 GLY 600 H2 GLY 600 1.467 -6.697 -20.845 3 H3 GLY 600 H3 GLY 600 0.714 -5.455 -20.084 4 HA2 GLY 600 HA2 GLY 600 1.882 -5.351 -22.775 5 HA3 GLY 600 HA3 GLY 600 1.074 -4.004 -21.943 6 H SER 601 H SER 601 3.412 -3.136 -22.574 7 HA SER 601 HA SER 601 5.681 -3.777 -21.058 8 HB2 SER 601 HB2 SER 601 5.927 -1.150 -21.683 9 HB3 SER 601 HB3 SER 601 6.210 -2.461 -22.837 10 HG SER 601 HG SER 601 4.762 -0.710 -23.528 11 H HIS 602 H HIS 602 5.979 -3.560 -18.887 12 HA HIS 602 HA HIS 602 5.136 -1.211 -17.525 13 HB2 HIS 602 HB2 HIS 602 3.934 -2.277 -15.720 14 HB3 HIS 602 HB3 HIS 602 3.093 -2.577 -17.227 15 HD1 HIS 602 HD1 HIS 602 3.845 -5.237 -18.295 16 HD2 HIS 602 HD2 HIS 602 3.998 -4.320 -14.175 17 HE1 HIS 602 HE1 HIS 602 3.818 -7.468 -17.023 18 H MET 603 H MET 603 6.163 -1.346 -15.252 19 HA MET 603 HA MET 603 8.814 -2.699 -15.534 20 HB2 MET 603 HB2 MET 603 8.158 0.084 -14.488 21 HB3 MET 603 HB3 MET 603 9.772 -0.629 -14.621 22 HG2 MET 603 HG2 MET 603 7.951 -0.020 -16.971 23 HG3 MET 603 HG3 MET 603 9.266 0.983 -16.370 24 HE1 MET 603 HE1 MET 603 11.223 0.084 -19.361 25 HE2 MET 603 HE2 MET 603 9.587 0.761 -19.116 26 HE3 MET 603 HE3 MET 603 10.922 1.243 -18.043 27 H GLY 604 H GLY 604 6.155 -2.990 -13.672 28 HA2 GLY 604 HA2 GLY 604 7.640 -3.323 -11.094 29 HA3 GLY 604 HA3 GLY 604 5.992 -2.682 -11.203 30 H GLU 605 H GLU 605 8.013 -5.531 -11.426 31 HA GLU 605 HA GLU 605 5.648 -7.296 -11.758 32 HB2 GLU 605 HB2 GLU 605 8.629 -7.809 -11.989 33 HB3 GLU 605 HB3 GLU 605 7.374 -9.052 -12.086 34 HG2 GLU 605 HG2 GLU 605 6.299 -7.777 -13.971 35 HG3 GLU 605 HG3 GLU 605 7.680 -6.674 -13.966 36 H SER 606 H SER 606 7.649 -6.063 -9.243 37 HA SER 606 HA SER 606 7.786 -8.142 -7.413 38 HB2 SER 606 HB2 SER 606 7.561 -5.175 -6.798 39 HB3 SER 606 HB3 SER 606 8.488 -6.408 -5.922 40 HG SER 606 HG SER 606 9.851 -5.197 -7.254 41 H GLY 607 H GLY 607 4.937 -7.679 -8.478 42 HA2 GLY 607 HA2 GLY 607 3.086 -8.134 -6.533 43 HA3 GLY 607 HA3 GLY 607 3.373 -6.378 -6.432 44 H LYS 608 H LYS 608 0.936 -6.710 -7.237 45 HA LYS 608 HA LYS 608 1.172 -5.837 -10.013 46 HB2 LYS 608 HB2 LYS 608 0.502 -8.390 -9.886 47 HB3 LYS 608 HB3 LYS 608 -1.059 -7.775 -9.369 48 HG2 LYS 608 HG2 LYS 608 -1.300 -8.170 -11.641 49 HG3 LYS 608 HG3 LYS 608 -1.104 -6.432 -11.589 50 HD2 LYS 608 HD2 LYS 608 1.105 -8.438 -12.264 51 HD3 LYS 608 HD3 LYS 608 0.091 -7.623 -13.442 52 HE2 LYS 608 HE2 LYS 608 1.524 -5.944 -13.562 53 HE3 LYS 608 HE3 LYS 608 1.130 -5.508 -11.902 54 HZ1 LYS 608 HZ1 LYS 608 2.923 -7.030 -11.185 55 HZ2 LYS 608 HZ2 LYS 608 3.500 -5.852 -12.145 56 HZ3 LYS 608 HZ3 LYS 608 3.285 -7.337 -12.789 57 H ILE 609 H ILE 609 -0.092 -5.288 -6.944 58 HA ILE 609 HA ILE 609 -1.873 -3.228 -8.119 59 HB ILE 609 HB ILE 609 -1.986 -4.242 -5.265 60 HG12 ILE 609 HG12 ILE 609 -2.818 -6.130 -6.396 61 HG13 ILE 609 HG13 ILE 609 -4.186 -5.244 -5.781 62 HG21 ILE 609 HG21 ILE 609 -2.812 -1.941 -5.568 63 HG22 ILE 609 HG22 ILE 609 -3.893 -2.471 -6.868 64 HG23 ILE 609 HG23 ILE 609 -4.155 -3.020 -5.199 65 HD11 ILE 609 HD11 ILE 609 -4.648 -6.175 -7.946 66 HD12 ILE 609 HD12 ILE 609 -4.626 -4.395 -8.074 67 HD13 ILE 609 HD13 ILE 609 -3.249 -5.372 -8.658 68 H ASP 610 H ASP 610 -1.369 -1.153 -7.486 69 HA ASP 610 HA ASP 610 0.647 -0.550 -5.487 70 HB2 ASP 610 HB2 ASP 610 0.882 0.397 -8.386 71 HB3 ASP 610 HB3 ASP 610 1.842 0.975 -7.032 72 H ILE 611 H ILE 611 0.656 1.998 -5.520 73 HA ILE 611 HA ILE 611 -2.063 3.121 -5.873 74 HB ILE 611 HB ILE 611 0.629 4.278 -5.060 75 HG12 ILE 611 HG12 ILE 611 -1.680 4.304 -3.138 76 HG13 ILE 611 HG13 ILE 611 -1.037 2.708 -3.487 77 HG21 ILE 611 HG21 ILE 611 -2.090 5.630 -5.210 78 HG22 ILE 611 HG22 ILE 611 -0.664 6.308 -4.374 79 HG23 ILE 611 HG23 ILE 611 -0.621 6.046 -6.120 80 HD11 ILE 611 HD11 ILE 611 1.225 3.394 -2.883 81 HD12 ILE 611 HD12 ILE 611 0.667 5.055 -2.580 82 HD13 ILE 611 HD13 ILE 611 0.093 3.716 -1.554 83 H ASP 612 H ASP 612 1.202 3.113 -7.321 84 HA ASP 612 HA ASP 612 1.024 5.158 -9.177 85 HB2 ASP 612 HB2 ASP 612 3.111 4.022 -8.694 86 HB3 ASP 612 HB3 ASP 612 2.500 2.510 -9.384 87 H THR 613 H THR 613 0.272 1.729 -9.643 88 HA THR 613 HA THR 613 -0.444 1.903 -12.357 89 HB THR 613 HB THR 613 0.177 -0.146 -11.073 90 HG1 THR 613 HG1 THR 613 -2.101 -0.026 -12.726 91 HG21 THR 613 HG21 THR 613 -2.729 -0.372 -10.273 92 HG22 THR 613 HG22 THR 613 -1.438 0.146 -9.169 93 HG23 THR 613 HG23 THR 613 -1.390 -1.470 -9.901 94 H ILE 614 H ILE 614 -2.181 3.178 -9.794 95 HA ILE 614 HA ILE 614 -4.798 2.994 -11.192 96 HB ILE 614 HB ILE 614 -4.307 3.922 -8.338 97 HG12 ILE 614 HG12 ILE 614 -3.399 1.655 -8.469 98 HG13 ILE 614 HG13 ILE 614 -4.822 1.750 -7.459 99 HG21 ILE 614 HG21 ILE 614 -6.690 3.383 -8.050 100 HG22 ILE 614 HG22 ILE 614 -6.460 4.553 -9.357 101 HG23 ILE 614 HG23 ILE 614 -6.797 2.867 -9.745 102 HD11 ILE 614 HD11 ILE 614 -6.196 0.758 -9.213 103 HD12 ILE 614 HD12 ILE 614 -4.823 0.803 -10.349 104 HD13 ILE 614 HD13 ILE 614 -4.759 -0.246 -8.914 105 H MET 615 H MET 615 -2.695 5.193 -9.362 106 HA MET 615 HA MET 615 -4.111 7.576 -10.151 107 HB2 MET 615 HB2 MET 615 -2.487 8.801 -8.937 108 HB3 MET 615 HB3 MET 615 -2.735 7.293 -8.063 109 HG2 MET 615 HG2 MET 615 -0.436 7.450 -8.003 110 HG3 MET 615 HG3 MET 615 -0.657 6.461 -9.440 111 HE1 MET 615 HE1 MET 615 2.316 8.295 -10.936 112 HE2 MET 615 HE2 MET 615 2.108 7.373 -9.432 113 HE3 MET 615 HE3 MET 615 1.341 6.815 -10.936 114 H THR 616 H THR 616 -1.467 5.768 -11.691 115 HA THR 616 HA THR 616 -0.674 7.830 -13.455 116 HB THR 616 HB THR 616 0.508 5.669 -12.892 117 HG1 THR 616 HG1 THR 616 1.600 5.706 -14.702 118 HG21 THR 616 HG21 THR 616 0.121 3.685 -14.198 119 HG22 THR 616 HG22 THR 616 -1.141 4.480 -15.165 120 HG23 THR 616 HG23 THR 616 -1.426 4.115 -13.451 121 H GLY 617 H GLY 617 -3.608 6.056 -13.314 122 HA2 GLY 617 HA2 GLY 617 -4.492 7.182 -15.930 123 HA3 GLY 617 HA3 GLY 617 -4.717 5.466 -15.593 124 H LYS 618 H LYS 618 -5.136 7.260 -12.655 125 HA LYS 618 HA LYS 618 -7.901 8.124 -13.341 126 HB2 LYS 618 HB2 LYS 618 -7.005 6.197 -11.205 127 HB3 LYS 618 HB3 LYS 618 -8.217 7.351 -10.737 128 HG2 LYS 618 HG2 LYS 618 -9.872 6.419 -11.911 129 HG3 LYS 618 HG3 LYS 618 -8.890 6.017 -13.308 130 HD2 LYS 618 HD2 LYS 618 -8.503 4.486 -10.719 131 HD3 LYS 618 HD3 LYS 618 -9.893 4.142 -11.728 132 HE2 LYS 618 HE2 LYS 618 -7.792 2.683 -12.049 133 HE3 LYS 618 HE3 LYS 618 -8.681 3.251 -13.464 134 HZ1 LYS 618 HZ1 LYS 618 -7.077 4.916 -13.841 135 HZ2 LYS 618 HZ2 LYS 618 -6.290 3.477 -13.708 136 HZ3 LYS 618 HZ3 LYS 618 -6.217 4.573 -12.479 137 HA PRO 619 HA PRO 619 -6.775 11.845 -11.105 138 HB2 PRO 619 HB2 PRO 619 -9.155 12.676 -10.069 139 HB3 PRO 619 HB3 PRO 619 -8.937 12.552 -11.843 140 HG2 PRO 619 HG2 PRO 619 -9.981 10.365 -9.981 141 HG3 PRO 619 HG3 PRO 619 -10.885 11.117 -11.340 142 HD2 PRO 619 HD2 PRO 619 -9.551 8.878 -11.753 143 HD3 PRO 619 HD3 PRO 619 -9.333 10.197 -12.938 144 H LYS 620 H LYS 620 -7.327 12.851 -8.723 145 HA LYS 620 HA LYS 620 -6.034 11.277 -6.893 146 HB2 LYS 620 HB2 LYS 620 -6.597 12.744 -5.162 147 HB3 LYS 620 HB3 LYS 620 -6.314 13.702 -6.605 148 HG2 LYS 620 HG2 LYS 620 -8.628 14.275 -6.822 149 HG3 LYS 620 HG3 LYS 620 -9.142 12.956 -5.766 150 HD2 LYS 620 HD2 LYS 620 -7.879 14.080 -3.868 151 HD3 LYS 620 HD3 LYS 620 -7.712 15.502 -4.911 152 HE2 LYS 620 HE2 LYS 620 -10.061 15.891 -4.926 153 HE3 LYS 620 HE3 LYS 620 -10.422 14.221 -4.454 154 HZ1 LYS 620 HZ1 LYS 620 -9.556 14.623 -2.287 155 HZ2 LYS 620 HZ2 LYS 620 -10.753 15.700 -2.607 156 HZ3 LYS 620 HZ3 LYS 620 -9.173 16.188 -2.650 157 H SER 621 H SER 621 -9.540 11.172 -7.421 158 HA SER 621 HA SER 621 -10.690 9.588 -5.635 159 HB2 SER 621 HB2 SER 621 -11.540 10.174 -7.918 160 HB3 SER 621 HB3 SER 621 -10.578 8.821 -8.557 161 HG SER 621 HG SER 621 -12.703 8.686 -6.677 162 H ALA 622 H ALA 622 -8.074 8.437 -7.768 163 HA ALA 622 HA ALA 622 -7.881 5.709 -7.070 164 HB1 ALA 622 HB1 ALA 622 -5.841 7.884 -7.807 165 HB2 ALA 622 HB2 ALA 622 -5.519 6.136 -7.850 166 HB3 ALA 622 HB3 ALA 622 -6.736 6.871 -8.925 167 H ARG 623 H ARG 623 -5.618 8.187 -5.781 168 HA ARG 623 HA ARG 623 -4.959 6.645 -3.448 169 HB2 ARG 623 HB2 ARG 623 -3.849 8.604 -2.601 170 HB3 ARG 623 HB3 ARG 623 -3.449 8.366 -4.299 171 HG2 ARG 623 HG2 ARG 623 -5.009 10.123 -4.956 172 HG3 ARG 623 HG3 ARG 623 -5.547 10.338 -3.277 173 HD2 ARG 623 HD2 ARG 623 -2.718 10.799 -4.270 174 HD3 ARG 623 HD3 ARG 623 -3.954 12.065 -4.117 175 HE ARG 623 HE ARG 623 -4.051 11.089 -1.653 176 HH11 ARG 623 HH11 ARG 623 -1.235 12.062 -3.556 177 HH12 ARG 623 HH12 ARG 623 -0.235 12.427 -2.193 178 HH21 ARG 623 HH21 ARG 623 -2.735 11.551 0.183 179 HH22 ARG 623 HH22 ARG 623 -1.124 12.130 -0.017 180 H GLU 624 H GLU 624 -7.574 8.759 -4.086 181 HA GLU 624 HA GLU 624 -8.269 9.244 -1.271 182 HB2 GLU 624 HB2 GLU 624 -9.775 9.719 -3.839 183 HB3 GLU 624 HB3 GLU 624 -10.412 10.213 -2.304 184 HG2 GLU 624 HG2 GLU 624 -7.766 11.231 -3.426 185 HG3 GLU 624 HG3 GLU 624 -9.326 12.004 -3.658 186 H LYS 625 H LYS 625 -8.957 6.628 -3.505 187 HA LYS 625 HA LYS 625 -10.926 5.412 -1.620 188 HB2 LYS 625 HB2 LYS 625 -9.576 4.393 -4.175 189 HB3 LYS 625 HB3 LYS 625 -10.613 3.389 -3.154 190 HG2 LYS 625 HG2 LYS 625 -12.546 4.774 -3.607 191 HG3 LYS 625 HG3 LYS 625 -11.551 5.986 -4.374 192 HD2 LYS 625 HD2 LYS 625 -12.467 4.998 -6.195 193 HD3 LYS 625 HD3 LYS 625 -10.929 4.140 -6.106 194 HE2 LYS 625 HE2 LYS 625 -12.032 2.183 -5.114 195 HE3 LYS 625 HE3 LYS 625 -13.537 3.093 -4.911 196 HZ1 LYS 625 HZ1 LYS 625 -13.739 1.713 -6.878 197 HZ2 LYS 625 HZ2 LYS 625 -12.340 2.301 -7.494 198 HZ3 LYS 625 HZ3 LYS 625 -13.658 3.269 -7.342 199 H MET 626 H MET 626 -7.598 4.906 -2.893 200 HA MET 626 HA MET 626 -6.994 2.506 -1.573 201 HB2 MET 626 HB2 MET 626 -5.400 4.824 -2.686 202 HB3 MET 626 HB3 MET 626 -4.584 3.495 -1.909 203 HG2 MET 626 HG2 MET 626 -4.456 3.357 -4.254 204 HG3 MET 626 HG3 MET 626 -5.300 1.955 -3.561 205 HE1 MET 626 HE1 MET 626 -8.176 2.313 -3.483 206 HE2 MET 626 HE2 MET 626 -8.686 1.973 -5.146 207 HE3 MET 626 HE3 MET 626 -7.358 1.037 -4.411 208 H MET 627 H MET 627 -6.155 5.884 -0.769 209 HA MET 627 HA MET 627 -4.622 5.191 1.475 210 HB2 MET 627 HB2 MET 627 -5.754 7.876 0.585 211 HB3 MET 627 HB3 MET 627 -4.591 7.682 1.870 212 HG2 MET 627 HG2 MET 627 -4.083 6.868 -1.015 213 HG3 MET 627 HG3 MET 627 -3.564 8.378 -0.273 214 HE1 MET 627 HE1 MET 627 -0.214 6.509 -0.827 215 HE2 MET 627 HE2 MET 627 -1.658 6.484 -1.868 216 HE3 MET 627 HE3 MET 627 -1.145 8.001 -1.092 217 H LYS 628 H LYS 628 -7.900 6.034 0.895 218 HA LYS 628 HA LYS 628 -8.739 6.624 3.632 219 HB2 LYS 628 HB2 LYS 628 -10.077 6.257 1.023 220 HB3 LYS 628 HB3 LYS 628 -10.918 5.391 2.294 221 HG2 LYS 628 HG2 LYS 628 -10.907 7.479 3.673 222 HG3 LYS 628 HG3 LYS 628 -10.280 8.359 2.261 223 HD2 LYS 628 HD2 LYS 628 -12.246 7.904 0.974 224 HD3 LYS 628 HD3 LYS 628 -12.811 6.654 2.083 225 HE2 LYS 628 HE2 LYS 628 -12.650 9.621 2.746 226 HE3 LYS 628 HE3 LYS 628 -14.109 8.763 2.234 227 HZ1 LYS 628 HZ1 LYS 628 -13.919 7.369 4.194 228 HZ2 LYS 628 HZ2 LYS 628 -14.006 8.952 4.628 229 HZ3 LYS 628 HZ3 LYS 628 -12.565 8.159 4.678 230 H ILE 629 H ILE 629 -9.141 3.751 1.536 231 HA ILE 629 HA ILE 629 -10.154 2.028 3.458 232 HB ILE 629 HB ILE 629 -8.406 1.431 1.053 233 HG12 ILE 629 HG12 ILE 629 -11.382 0.872 1.174 234 HG13 ILE 629 HG13 ILE 629 -10.865 2.542 0.929 235 HG21 ILE 629 HG21 ILE 629 -10.049 -0.516 2.729 236 HG22 ILE 629 HG22 ILE 629 -9.362 -0.897 1.137 237 HG23 ILE 629 HG23 ILE 629 -8.289 -0.538 2.482 238 HD11 ILE 629 HD11 ILE 629 -11.157 1.508 -1.228 239 HD12 ILE 629 HD12 ILE 629 -9.425 1.795 -0.986 240 HD13 ILE 629 HD13 ILE 629 -10.074 0.171 -0.748 241 H ILE 630 H ILE 630 -6.674 2.145 2.424 242 HA ILE 630 HA ILE 630 -5.857 0.251 4.246 243 HB ILE 630 HB ILE 630 -3.548 1.172 3.997 244 HG12 ILE 630 HG12 ILE 630 -3.737 2.918 1.835 245 HG13 ILE 630 HG13 ILE 630 -5.015 3.495 2.898 246 HG21 ILE 630 HG21 ILE 630 -5.131 0.756 1.437 247 HG22 ILE 630 HG22 ILE 630 -3.381 0.547 1.650 248 HG23 ILE 630 HG23 ILE 630 -4.504 -0.521 2.500 249 HD11 ILE 630 HD11 ILE 630 -3.070 4.714 3.423 250 HD12 ILE 630 HD12 ILE 630 -3.339 3.581 4.766 251 HD13 ILE 630 HD13 ILE 630 -2.083 3.237 3.550 252 H GLU 631 H GLU 631 -6.646 3.625 5.045 253 HA GLU 631 HA GLU 631 -5.158 3.522 7.582 254 HB2 GLU 631 HB2 GLU 631 -6.402 5.640 5.850 255 HB3 GLU 631 HB3 GLU 631 -6.496 5.891 7.555 256 HG2 GLU 631 HG2 GLU 631 -3.881 5.280 6.142 257 HG3 GLU 631 HG3 GLU 631 -4.480 6.912 6.447 258 H ILE 632 H ILE 632 -8.504 3.276 6.266 259 HA ILE 632 HA ILE 632 -9.713 3.490 8.929 260 HB ILE 632 HB ILE 632 -10.720 2.110 6.420 261 HG12 ILE 632 HG12 ILE 632 -12.091 4.631 7.315 262 HG13 ILE 632 HG13 ILE 632 -10.459 4.877 6.764 263 HG21 ILE 632 HG21 ILE 632 -12.521 2.931 8.736 264 HG22 ILE 632 HG22 ILE 632 -12.686 1.619 7.578 265 HG23 ILE 632 HG23 ILE 632 -11.619 1.415 8.864 266 HD11 ILE 632 HD11 ILE 632 -11.311 5.172 4.777 267 HD12 ILE 632 HD12 ILE 632 -11.539 3.410 4.682 268 HD13 ILE 632 HD13 ILE 632 -12.848 4.498 5.206 269 H ILE 633 H ILE 633 -8.416 0.967 6.728 270 HA ILE 633 HA ILE 633 -9.042 -1.232 8.316 271 HB ILE 633 HB ILE 633 -6.802 -0.832 6.288 272 HG12 ILE 633 HG12 ILE 633 -9.633 -1.877 6.173 273 HG13 ILE 633 HG13 ILE 633 -8.856 -0.747 5.133 274 HG21 ILE 633 HG21 ILE 633 -6.396 -3.199 6.278 275 HG22 ILE 633 HG22 ILE 633 -6.233 -2.644 7.938 276 HG23 ILE 633 HG23 ILE 633 -7.698 -3.503 7.441 277 HD11 ILE 633 HD11 ILE 633 -8.387 -3.736 5.061 278 HD12 ILE 633 HD12 ILE 633 -9.175 -2.725 3.843 279 HD13 ILE 633 HD13 ILE 633 -7.442 -2.540 4.136 280 H ASP 634 H ASP 634 -5.970 0.782 8.233 281 HA ASP 634 HA ASP 634 -5.037 -0.878 10.344 282 HB2 ASP 634 HB2 ASP 634 -3.644 0.438 8.562 283 HB3 ASP 634 HB3 ASP 634 -3.631 1.705 9.790 284 H SER 635 H SER 635 -6.769 2.234 10.336 285 HA SER 635 HA SER 635 -6.280 2.885 13.058 286 HB2 SER 635 HB2 SER 635 -8.840 3.328 11.455 287 HB3 SER 635 HB3 SER 635 -8.391 4.140 12.968 288 HG SER 635 HG SER 635 -7.168 4.307 10.409 289 H LEU 636 H LEU 636 -8.790 0.823 11.477 290 HA LEU 636 HA LEU 636 -10.012 0.014 13.928 291 HB2 LEU 636 HB2 LEU 636 -9.931 -1.255 11.202 292 HB3 LEU 636 HB3 LEU 636 -10.813 -1.951 12.564 293 HG LEU 636 HG LEU 636 -11.360 0.840 11.430 294 HD11 LEU 636 HD11 LEU 636 -12.859 -1.706 11.124 295 HD12 LEU 636 HD12 LEU 636 -11.823 -0.896 9.909 296 HD13 LEU 636 HD13 LEU 636 -13.263 -0.065 10.512 297 HD21 LEU 636 HD21 LEU 636 -12.072 0.769 13.783 298 HD22 LEU 636 HD22 LEU 636 -12.863 -0.798 13.511 299 HD23 LEU 636 HD23 LEU 636 -13.469 0.679 12.718 300 H ALA 637 H ALA 637 -7.249 -1.306 12.050 301 HA ALA 637 HA ALA 637 -6.863 -3.606 13.701 302 HB1 ALA 637 HB1 ALA 637 -4.752 -2.111 12.115 303 HB2 ALA 637 HB2 ALA 637 -4.776 -3.808 12.607 304 HB3 ALA 637 HB3 ALA 637 -5.939 -3.229 11.388 305 H VAL 638 H VAL 638 -6.023 -0.250 14.279 306 HA VAL 638 HA VAL 638 -4.334 -0.944 16.604 307 HB VAL 638 HB VAL 638 -5.329 1.655 15.369 308 HG11 VAL 638 HG11 VAL 638 -5.289 2.065 17.793 309 HG12 VAL 638 HG12 VAL 638 -3.678 1.327 17.918 310 HG13 VAL 638 HG13 VAL 638 -3.904 2.851 17.031 311 HG21 VAL 638 HG21 VAL 638 -3.415 0.488 14.260 312 HG22 VAL 638 HG22 VAL 638 -2.941 2.037 14.957 313 HG23 VAL 638 HG23 VAL 638 -2.523 0.522 15.788 314 H SER 639 H SER 639 -7.664 0.126 15.887 315 HA SER 639 HA SER 639 -8.459 0.363 18.644 316 HB2 SER 639 HB2 SER 639 -9.376 1.508 16.530 317 HB3 SER 639 HB3 SER 639 -10.260 0.002 16.223 318 HG SER 639 HG SER 639 -11.463 1.584 17.395 319 H SER 640 H SER 640 -8.249 -2.447 16.514 320 HA SER 640 HA SER 640 -9.233 -4.316 18.498 321 HB2 SER 640 HB2 SER 640 -10.805 -3.609 15.970 322 HB3 SER 640 HB3 SER 640 -11.049 -5.113 16.878 323 HG SER 640 HG SER 640 -11.054 -2.750 18.362 324 H GLU 641 H GLU 641 -9.401 -6.575 17.145 325 HA GLU 641 HA GLU 641 -6.778 -7.210 16.536 326 HB2 GLU 641 HB2 GLU 641 -9.338 -8.640 15.700 327 HB3 GLU 641 HB3 GLU 641 -7.732 -9.373 15.743 328 HG2 GLU 641 HG2 GLU 641 -7.618 -9.090 18.177 329 HG3 GLU 641 HG3 GLU 641 -9.179 -8.256 18.188 330 H CYS 642 H CYS 642 -9.320 -6.212 14.238 331 HA CYS 642 HA CYS 642 -7.576 -5.910 12.031 332 HB2 CYS 642 HB2 CYS 642 -8.749 -7.681 10.612 333 HB3 CYS 642 HB3 CYS 642 -7.598 -8.263 11.799 334 H ALA 643 H ALA 643 -8.875 -5.347 10.120 335 HA ALA 643 HA ALA 643 -11.131 -3.579 10.747 336 HB1 ALA 643 HB1 ALA 643 -10.784 -2.768 8.532 337 HB2 ALA 643 HB2 ALA 643 -9.179 -3.052 9.249 338 HB3 ALA 643 HB3 ALA 643 -9.844 -4.196 8.065 339 H LYS 644 H LYS 644 -13.050 -4.631 11.024 340 HA LYS 644 HA LYS 644 -13.781 -7.150 9.917 341 HB2 LYS 644 HB2 LYS 644 -16.013 -6.456 10.800 342 HB3 LYS 644 HB3 LYS 644 -14.660 -6.448 11.967 343 HG2 LYS 644 HG2 LYS 644 -14.569 -3.904 11.517 344 HG3 LYS 644 HG3 LYS 644 -16.188 -4.166 10.784 345 HD2 LYS 644 HD2 LYS 644 -17.041 -5.013 12.800 346 HD3 LYS 644 HD3 LYS 644 -15.443 -5.084 13.560 347 HE2 LYS 644 HE2 LYS 644 -16.531 -3.094 14.378 348 HE3 LYS 644 HE3 LYS 644 -15.165 -2.668 13.321 349 HZ1 LYS 644 HZ1 LYS 644 -17.077 -1.293 12.895 350 HZ2 LYS 644 HZ2 LYS 644 -17.997 -2.602 12.508 351 HZ3 LYS 644 HZ3 LYS 644 -16.696 -2.191 11.575 352 H VAL 645 H VAL 645 -14.471 -7.478 7.807 353 HA VAL 645 HA VAL 645 -14.465 -5.397 5.894 354 HB VAL 645 HB VAL 645 -15.618 -8.193 5.819 355 HG11 VAL 645 HG11 VAL 645 -16.814 -7.089 4.077 356 HG12 VAL 645 HG12 VAL 645 -15.368 -6.226 3.511 357 HG13 VAL 645 HG13 VAL 645 -15.514 -7.989 3.306 358 HG21 VAL 645 HG21 VAL 645 -13.116 -6.956 4.571 359 HG22 VAL 645 HG22 VAL 645 -13.124 -7.890 6.067 360 HG23 VAL 645 HG23 VAL 645 -13.582 -8.668 4.542 361 H LYS 646 H LYS 646 -16.996 -6.224 8.043 362 HA LYS 646 HA LYS 646 -19.293 -5.062 6.775 363 HB2 LYS 646 HB2 LYS 646 -18.633 -5.158 9.756 364 HB3 LYS 646 HB3 LYS 646 -20.207 -4.964 9.014 365 HG2 LYS 646 HG2 LYS 646 -20.414 -7.166 9.471 366 HG3 LYS 646 HG3 LYS 646 -19.584 -7.377 7.929 367 HD2 LYS 646 HD2 LYS 646 -17.421 -7.665 9.146 368 HD3 LYS 646 HD3 LYS 646 -18.232 -7.272 10.663 369 HE2 LYS 646 HE2 LYS 646 -17.894 -9.600 10.648 370 HE3 LYS 646 HE3 LYS 646 -19.627 -9.334 10.447 371 HZ1 LYS 646 HZ1 LYS 646 -18.430 -11.052 9.038 372 HZ2 LYS 646 HZ2 LYS 646 -17.820 -9.830 8.169 373 HZ3 LYS 646 HZ3 LYS 646 -19.467 -10.034 8.223 374 H ASP 647 H ASP 647 -16.596 -3.741 8.725 375 HA ASP 647 HA ASP 647 -17.447 -1.074 9.069 376 HB2 ASP 647 HB2 ASP 647 -15.384 -0.768 9.966 377 HB3 ASP 647 HB3 ASP 647 -15.239 -2.474 10.011 378 H ILE 648 H ILE 648 -15.364 -2.653 6.723 379 HA ILE 648 HA ILE 648 -14.732 -0.233 5.495 380 HB ILE 648 HB ILE 648 -14.324 -2.884 4.058 381 HG12 ILE 648 HG12 ILE 648 -12.630 -2.029 6.432 382 HG13 ILE 648 HG13 ILE 648 -13.819 -3.325 6.483 383 HG21 ILE 648 HG21 ILE 648 -12.150 -1.770 3.455 384 HG22 ILE 648 HG22 ILE 648 -13.532 -0.751 3.024 385 HG23 ILE 648 HG23 ILE 648 -12.584 -0.401 4.480 386 HD11 ILE 648 HD11 ILE 648 -11.292 -3.316 4.794 387 HD12 ILE 648 HD12 ILE 648 -11.663 -4.321 6.199 388 HD13 ILE 648 HD13 ILE 648 -12.568 -4.548 4.690 389 H LEU 649 H LEU 649 -16.921 -2.749 4.827 390 HA LEU 649 HA LEU 649 -17.872 -1.858 2.203 391 HB2 LEU 649 HB2 LEU 649 -19.024 -3.702 4.300 392 HB3 LEU 649 HB3 LEU 649 -19.970 -3.251 2.885 393 HG LEU 649 HG LEU 649 -17.182 -4.462 2.654 394 HD11 LEU 649 HD11 LEU 649 -18.301 -6.614 2.211 395 HD12 LEU 649 HD12 LEU 649 -19.893 -5.867 2.463 396 HD13 LEU 649 HD13 LEU 649 -18.766 -6.016 3.820 397 HD21 LEU 649 HD21 LEU 649 -17.869 -5.020 0.355 398 HD22 LEU 649 HD22 LEU 649 -17.995 -3.281 0.619 399 HD23 LEU 649 HD23 LEU 649 -19.458 -4.271 0.624 400 H LYS 650 H LYS 650 -18.983 -1.284 5.583 401 HA LYS 650 HA LYS 650 -21.307 0.203 4.763 402 HB2 LYS 650 HB2 LYS 650 -21.202 -0.717 7.006 403 HB3 LYS 650 HB3 LYS 650 -19.762 0.236 7.394 404 HG2 LYS 650 HG2 LYS 650 -21.018 2.323 7.246 405 HG3 LYS 650 HG3 LYS 650 -22.454 1.474 6.642 406 HD2 LYS 650 HD2 LYS 650 -22.766 0.360 8.780 407 HD3 LYS 650 HD3 LYS 650 -21.201 0.936 9.360 408 HE2 LYS 650 HE2 LYS 650 -22.965 2.224 10.388 409 HE3 LYS 650 HE3 LYS 650 -21.984 3.264 9.351 410 HZ1 LYS 650 HZ1 LYS 650 -24.446 3.553 9.216 411 HZ2 LYS 650 HZ2 LYS 650 -24.539 2.110 8.429 412 HZ3 LYS 650 HZ3 LYS 650 -23.714 3.397 7.784 413 H GLU 651 H GLU 651 -18.037 1.357 5.939 414 HA GLU 651 HA GLU 651 -18.722 4.096 5.609 415 HB2 GLU 651 HB2 GLU 651 -16.333 4.507 5.865 416 HB3 GLU 651 HB3 GLU 651 -16.768 3.175 6.917 417 HG2 GLU 651 HG2 GLU 651 -16.014 1.590 5.119 418 HG3 GLU 651 HG3 GLU 651 -15.404 3.002 4.211 419 H ALA 652 H ALA 652 -17.176 1.727 3.336 420 HA ALA 652 HA ALA 652 -16.348 3.792 1.636 421 HB1 ALA 652 HB1 ALA 652 -16.721 0.828 1.140 422 HB2 ALA 652 HB2 ALA 652 -15.878 1.902 0.019 423 HB3 ALA 652 HB3 ALA 652 -15.244 1.651 1.658 424 H GLN 653 H GLN 653 -19.253 1.658 1.680 425 HA GLN 653 HA GLN 653 -20.555 2.667 -0.679 426 HB2 GLN 653 HB2 GLN 653 -21.553 1.322 1.851 427 HB3 GLN 653 HB3 GLN 653 -22.625 1.781 0.539 428 HG2 GLN 653 HG2 GLN 653 -20.247 0.155 -0.300 429 HG3 GLN 653 HG3 GLN 653 -21.406 -0.657 0.745 430 HE21 GLN 653 HE21 GLN 653 -21.382 1.416 -2.297 431 HE22 GLN 653 HE22 GLN 653 -22.851 0.630 -2.896 432 H GLN 654 H GLN 654 -20.590 3.750 2.777 433 HA GLN 654 HA GLN 654 -22.538 5.808 2.311 434 HB2 GLN 654 HB2 GLN 654 -20.356 5.627 4.423 435 HB3 GLN 654 HB3 GLN 654 -21.681 6.770 4.463 436 HG2 GLN 654 HG2 GLN 654 -22.572 3.932 4.178 437 HG3 GLN 654 HG3 GLN 654 -21.621 4.249 5.623 438 HE21 GLN 654 HE21 GLN 654 -23.989 6.557 4.119 439 HE22 GLN 654 HE22 GLN 654 -25.073 6.472 5.493 440 H VAL 655 H VAL 655 -18.979 5.783 1.994 441 HA VAL 655 HA VAL 655 -18.702 8.557 1.257 442 HB VAL 655 HB VAL 655 -17.012 6.057 0.877 443 HG11 VAL 655 HG11 VAL 655 -16.247 8.885 0.057 444 HG12 VAL 655 HG12 VAL 655 -15.116 7.516 0.215 445 HG13 VAL 655 HG13 VAL 655 -16.389 7.468 -1.005 446 HG21 VAL 655 HG21 VAL 655 -17.255 7.069 3.183 447 HG22 VAL 655 HG22 VAL 655 -15.603 7.024 2.570 448 HG23 VAL 655 HG23 VAL 655 -16.527 8.554 2.555 449 H GLY 656 H GLY 656 -19.374 5.578 -0.605 450 HA2 GLY 656 HA2 GLY 656 -21.167 6.070 -2.287 451 HA3 GLY 656 HA3 GLY 656 -20.103 7.306 -2.951 452 H ILE 657 H ILE 657 -18.350 4.516 -1.936 453 HA ILE 657 HA ILE 657 -17.767 3.733 -4.702 454 HB ILE 657 HB ILE 657 -16.889 2.615 -2.007 455 HG12 ILE 657 HG12 ILE 657 -15.154 4.303 -3.860 456 HG13 ILE 657 HG13 ILE 657 -16.158 5.069 -2.639 457 HG21 ILE 657 HG21 ILE 657 -16.585 0.922 -3.691 458 HG22 ILE 657 HG22 ILE 657 -15.842 2.081 -4.821 459 HG23 ILE 657 HG23 ILE 657 -15.004 1.570 -3.336 460 HD11 ILE 657 HD11 ILE 657 -14.016 3.015 -2.020 461 HD12 ILE 657 HD12 ILE 657 -13.941 4.772 -1.755 462 HD13 ILE 657 HD13 ILE 657 -15.105 3.803 -0.851 463 H GLU 658 H GLU 658 -18.106 1.270 -5.296 464 HA GLU 658 HA GLU 658 -20.863 0.586 -4.452 465 HB2 GLU 658 HB2 GLU 658 -20.595 0.811 -6.772 466 HB3 GLU 658 HB3 GLU 658 -19.098 -0.093 -6.788 467 HG2 GLU 658 HG2 GLU 658 -21.510 -1.590 -5.820 468 HG3 GLU 658 HG3 GLU 658 -21.634 -1.035 -7.463 469 H LYS 659 H LYS 659 -21.289 -1.528 -3.742 470 HA LYS 659 HA LYS 659 -19.839 -2.960 -1.951 471 HB2 LYS 659 HB2 LYS 659 -22.173 -3.414 -2.620 472 HB3 LYS 659 HB3 LYS 659 -21.625 -3.976 -4.204 473 HG2 LYS 659 HG2 LYS 659 -20.238 -5.735 -2.913 474 HG3 LYS 659 HG3 LYS 659 -21.152 -5.230 -1.490 475 HD2 LYS 659 HD2 LYS 659 -22.197 -7.204 -2.377 476 HD3 LYS 659 HD3 LYS 659 -23.264 -5.843 -2.736 477 HE2 LYS 659 HE2 LYS 659 -23.171 -7.241 -4.691 478 HE3 LYS 659 HE3 LYS 659 -22.286 -5.763 -5.072 479 HZ1 LYS 659 HZ1 LYS 659 -20.471 -6.955 -5.464 480 HZ2 LYS 659 HZ2 LYS 659 -21.338 -8.331 -5.309 481 HZ3 LYS 659 HZ3 LYS 659 -20.515 -7.747 -4.019 482 H SER 660 H SER 660 -19.752 -3.724 -5.523 483 HA SER 660 HA SER 660 -17.922 -5.873 -4.904 484 HB2 SER 660 HB2 SER 660 -18.373 -4.993 -7.731 485 HB3 SER 660 HB3 SER 660 -18.129 -6.619 -7.063 486 HG SER 660 HG SER 660 -20.366 -4.852 -7.008 487 H ASN 661 H ASN 661 -17.554 -2.590 -6.168 488 HA ASN 661 HA ASN 661 -14.788 -2.579 -6.757 489 HB2 ASN 661 HB2 ASN 661 -16.620 -0.519 -5.454 490 HB3 ASN 661 HB3 ASN 661 -14.912 -0.283 -5.448 491 HD21 ASN 661 HD21 ASN 661 -17.475 -1.322 -7.902 492 HD22 ASN 661 HD22 ASN 661 -16.788 -0.269 -9.131 493 H ILE 662 H ILE 662 -16.376 -2.876 -3.489 494 HA ILE 662 HA ILE 662 -13.816 -2.274 -2.142 495 HB ILE 662 HB ILE 662 -16.492 -3.132 -1.021 496 HG12 ILE 662 HG12 ILE 662 -15.465 -0.337 -0.615 497 HG13 ILE 662 HG13 ILE 662 -16.052 -0.693 -2.213 498 HG21 ILE 662 HG21 ILE 662 -14.620 -3.665 0.473 499 HG22 ILE 662 HG22 ILE 662 -14.006 -2.021 0.393 500 HG23 ILE 662 HG23 ILE 662 -15.554 -2.371 1.185 501 HD11 ILE 662 HD11 ILE 662 -17.679 -0.977 0.314 502 HD12 ILE 662 HD12 ILE 662 -17.884 0.211 -0.987 503 HD13 ILE 662 HD13 ILE 662 -18.215 -1.505 -1.282 504 H GLU 663 H GLU 663 -15.967 -4.899 -3.104 505 HA GLU 663 HA GLU 663 -14.537 -7.063 -1.815 506 HB2 GLU 663 HB2 GLU 663 -16.024 -7.190 -4.463 507 HB3 GLU 663 HB3 GLU 663 -15.579 -8.547 -3.441 508 HG2 GLU 663 HG2 GLU 663 -17.089 -7.780 -1.668 509 HG3 GLU 663 HG3 GLU 663 -17.466 -6.335 -2.539 510 H LYS 664 H LYS 664 -14.218 -5.466 -4.988 511 HA LYS 664 HA LYS 664 -11.916 -6.695 -5.971 512 HB2 LYS 664 HB2 LYS 664 -12.500 -3.686 -6.219 513 HB3 LYS 664 HB3 LYS 664 -11.335 -4.588 -7.098 514 HG2 LYS 664 HG2 LYS 664 -13.596 -6.000 -7.643 515 HG3 LYS 664 HG3 LYS 664 -14.265 -4.403 -7.426 516 HD2 LYS 664 HD2 LYS 664 -13.805 -4.324 -9.652 517 HD3 LYS 664 HD3 LYS 664 -12.362 -3.527 -8.998 518 HE2 LYS 664 HE2 LYS 664 -12.502 -6.504 -9.267 519 HE3 LYS 664 HE3 LYS 664 -12.325 -5.512 -10.736 520 HZ1 LYS 664 HZ1 LYS 664 -10.244 -4.638 -9.796 521 HZ2 LYS 664 HZ2 LYS 664 -10.152 -6.273 -9.915 522 HZ3 LYS 664 HZ3 LYS 664 -10.336 -5.582 -8.470 523 H LEU 665 H LEU 665 -11.967 -3.580 -4.365 524 HA LEU 665 HA LEU 665 -9.261 -3.192 -4.020 525 HB2 LEU 665 HB2 LEU 665 -11.668 -2.168 -2.593 526 HB3 LEU 665 HB3 LEU 665 -10.261 -2.178 -1.582 527 HG LEU 665 HG LEU 665 -10.634 -0.070 -2.836 528 HD11 LEU 665 HD11 LEU 665 -8.304 -1.339 -2.097 529 HD12 LEU 665 HD12 LEU 665 -8.416 0.313 -2.618 530 HD13 LEU 665 HD13 LEU 665 -7.964 -0.968 -3.789 531 HD21 LEU 665 HD21 LEU 665 -11.392 -0.879 -4.994 532 HD22 LEU 665 HD22 LEU 665 -9.765 -1.490 -5.356 533 HD23 LEU 665 HD23 LEU 665 -10.037 0.246 -5.126 534 H LEU 666 H LEU 666 -11.313 -4.717 -1.521 535 HA LEU 666 HA LEU 666 -9.194 -5.298 0.256 536 HB2 LEU 666 HB2 LEU 666 -11.917 -6.541 -0.212 537 HB3 LEU 666 HB3 LEU 666 -10.905 -6.956 1.153 538 HG LEU 666 HG LEU 666 -11.262 -4.937 2.243 539 HD11 LEU 666 HD11 LEU 666 -12.093 -2.882 1.574 540 HD12 LEU 666 HD12 LEU 666 -12.105 -3.357 -0.111 541 HD13 LEU 666 HD13 LEU 666 -10.580 -3.279 0.777 542 HD21 LEU 666 HD21 LEU 666 -13.149 -6.342 2.282 543 HD22 LEU 666 HD22 LEU 666 -13.799 -5.602 0.821 544 HD23 LEU 666 HD23 LEU 666 -13.657 -4.647 2.329 545 H THR 667 H THR 667 -10.608 -7.236 -2.449 546 HA THR 667 HA THR 667 -9.135 -9.655 -1.906 547 HB THR 667 HB THR 667 -10.395 -8.579 -4.474 548 HG1 THR 667 HG1 THR 667 -11.960 -8.878 -3.123 549 HG21 THR 667 HG21 THR 667 -10.402 -10.974 -5.173 550 HG22 THR 667 HG22 THR 667 -9.320 -11.320 -3.795 551 HG23 THR 667 HG23 THR 667 -8.791 -10.248 -5.109 552 H ASP 668 H ASP 668 -8.621 -6.811 -4.004 553 HA ASP 668 HA ASP 668 -6.486 -7.950 -5.536 554 HB2 ASP 668 HB2 ASP 668 -7.796 -5.238 -5.167 555 HB3 ASP 668 HB3 ASP 668 -6.405 -5.453 -6.230 556 H MET 669 H MET 669 -6.779 -5.601 -2.856 557 HA MET 669 HA MET 669 -4.016 -5.116 -2.410 558 HB2 MET 669 HB2 MET 669 -6.416 -5.057 -0.532 559 HB3 MET 669 HB3 MET 669 -4.789 -4.535 -0.093 560 HG2 MET 669 HG2 MET 669 -5.149 -3.158 -2.430 561 HG3 MET 669 HG3 MET 669 -6.777 -3.162 -1.812 562 HE1 MET 669 HE1 MET 669 -6.142 -0.446 -2.160 563 HE2 MET 669 HE2 MET 669 -5.063 0.402 -1.039 564 HE3 MET 669 HE3 MET 669 -4.396 -0.731 -2.245 565 H ARG 670 H ARG 670 -6.176 -7.697 -0.912 566 HA ARG 670 HA ARG 670 -3.863 -8.792 0.418 567 HB2 ARG 670 HB2 ARG 670 -5.202 -10.364 1.405 568 HB3 ARG 670 HB3 ARG 670 -6.270 -8.990 1.188 569 HG2 ARG 670 HG2 ARG 670 -7.655 -10.727 0.618 570 HG3 ARG 670 HG3 ARG 670 -7.064 -10.240 -0.955 571 HD2 ARG 670 HD2 ARG 670 -5.238 -12.169 -0.322 572 HD3 ARG 670 HD3 ARG 670 -6.563 -12.717 0.676 573 HE ARG 670 HE ARG 670 -6.403 -12.623 -2.245 574 HH11 ARG 670 HH11 ARG 670 -8.600 -13.342 0.534 575 HH12 ARG 670 HH12 ARG 670 -9.922 -13.731 -0.474 576 HH21 ARG 670 HH21 ARG 670 -8.119 -13.466 -3.532 577 HH22 ARG 670 HH22 ARG 670 -9.586 -13.984 -2.781 578 H LYS 671 H LYS 671 -5.114 -9.238 -2.813 579 HA LYS 671 HA LYS 671 -3.663 -11.657 -3.321 580 HB2 LYS 671 HB2 LYS 671 -5.053 -9.566 -4.989 581 HB3 LYS 671 HB3 LYS 671 -3.894 -10.573 -5.809 582 HG2 LYS 671 HG2 LYS 671 -6.107 -11.772 -4.102 583 HG3 LYS 671 HG3 LYS 671 -6.378 -11.317 -5.782 584 HD2 LYS 671 HD2 LYS 671 -4.194 -13.258 -4.902 585 HD3 LYS 671 HD3 LYS 671 -5.813 -13.745 -5.431 586 HE2 LYS 671 HE2 LYS 671 -5.456 -12.641 -7.619 587 HE3 LYS 671 HE3 LYS 671 -3.836 -12.142 -7.113 588 HZ1 LYS 671 HZ1 LYS 671 -3.766 -14.121 -8.449 589 HZ2 LYS 671 HZ2 LYS 671 -4.732 -14.936 -7.399 590 HZ3 LYS 671 HZ3 LYS 671 -3.226 -14.453 -6.933 591 H SER 672 H SER 672 -2.773 -8.211 -3.601 592 HA SER 672 HA SER 672 -0.084 -9.082 -4.573 593 HB2 SER 672 HB2 SER 672 -1.299 -7.502 -5.959 594 HB3 SER 672 HB3 SER 672 -1.349 -6.339 -4.602 595 HG SER 672 HG SER 672 1.041 -6.679 -4.638 596 H GLY 673 H GLY 673 -1.531 -8.155 -1.595 597 HA2 GLY 673 HA2 GLY 673 -0.261 -8.841 0.255 598 HA3 GLY 673 HA3 GLY 673 1.231 -8.317 -0.547 599 H ILE 674 H ILE 674 -1.386 -6.105 -0.767 600 HA ILE 674 HA ILE 674 0.065 -4.079 0.753 601 HB ILE 674 HB ILE 674 -2.677 -4.071 -0.569 602 HG12 ILE 674 HG12 ILE 674 0.029 -3.126 -1.592 603 HG13 ILE 674 HG13 ILE 674 -0.905 -4.485 -2.197 604 HG21 ILE 674 HG21 ILE 674 -2.514 -1.577 -0.421 605 HG22 ILE 674 HG22 ILE 674 -2.543 -2.317 1.159 606 HG23 ILE 674 HG23 ILE 674 -0.998 -1.748 0.493 607 HD11 ILE 674 HD11 ILE 674 -1.677 -1.565 -2.471 608 HD12 ILE 674 HD12 ILE 674 -1.163 -2.686 -3.729 609 HD13 ILE 674 HD13 ILE 674 -2.720 -2.944 -2.910 610 H ILE 675 H ILE 675 -2.674 -6.300 1.299 611 HA ILE 675 HA ILE 675 -2.611 -5.606 4.156 612 HB ILE 675 HB ILE 675 -4.964 -5.495 4.394 613 HG12 ILE 675 HG12 ILE 675 -5.116 -6.119 1.438 614 HG13 ILE 675 HG13 ILE 675 -5.762 -7.041 2.783 615 HG21 ILE 675 HG21 ILE 675 -3.643 -3.376 3.641 616 HG22 ILE 675 HG22 ILE 675 -4.418 -3.588 2.089 617 HG23 ILE 675 HG23 ILE 675 -5.385 -3.323 3.554 618 HD11 ILE 675 HD11 ILE 675 -7.357 -5.178 3.271 619 HD12 ILE 675 HD12 ILE 675 -6.767 -4.325 1.822 620 HD13 ILE 675 HD13 ILE 675 -7.565 -5.888 1.655 621 H TYR 676 H TYR 676 -3.633 -7.488 5.400 622 HA TYR 676 HA TYR 676 -3.614 -10.008 3.846 623 HB2 TYR 676 HB2 TYR 676 -3.157 -10.754 6.517 624 HB3 TYR 676 HB3 TYR 676 -2.131 -10.963 5.129 625 HD1 TYR 676 HD2 TYR 676 -2.927 -8.307 7.685 626 HD2 TYR 676 HD1 TYR 676 0.099 -10.371 5.432 627 HE1 TYR 676 HE2 TYR 676 -1.156 -7.058 8.922 628 HE2 TYR 676 HE1 TYR 676 1.861 -9.197 6.719 629 HH TYR 676 HH TYR 676 1.528 -6.366 8.310 630 H GLU 677 H GLU 677 -5.001 -11.719 4.919 631 HA GLU 677 HA GLU 677 -7.578 -10.567 5.707 632 HB2 GLU 677 HB2 GLU 677 -7.198 -11.483 3.441 633 HB3 GLU 677 HB3 GLU 677 -6.701 -13.033 4.134 634 HG2 GLU 677 HG2 GLU 677 -8.968 -13.379 5.031 635 HG3 GLU 677 HG3 GLU 677 -9.372 -11.717 4.583 636 H ALA 678 H ALA 678 -7.642 -10.804 7.983 637 HA ALA 678 HA ALA 678 -6.308 -13.021 9.344 638 HB1 ALA 678 HB1 ALA 678 -7.312 -12.026 11.362 639 HB2 ALA 678 HB2 ALA 678 -6.504 -10.774 10.396 640 HB3 ALA 678 HB3 ALA 678 -8.279 -10.921 10.372 641 H LYS 679 H LYS 679 -9.535 -12.185 8.204 642 HA LYS 679 HA LYS 679 -10.411 -14.975 8.490 643 HB2 LYS 679 HB2 LYS 679 -12.174 -12.604 9.279 644 HB3 LYS 679 HB3 LYS 679 -12.616 -14.306 9.342 645 HG2 LYS 679 HG2 LYS 679 -10.969 -14.644 11.198 646 HG3 LYS 679 HG3 LYS 679 -10.550 -12.931 11.098 647 HD2 LYS 679 HD2 LYS 679 -12.018 -12.751 12.772 648 HD3 LYS 679 HD3 LYS 679 -13.173 -12.562 11.464 649 HE2 LYS 679 HE2 LYS 679 -12.522 -15.173 12.910 650 HE3 LYS 679 HE3 LYS 679 -13.855 -14.098 13.346 651 HZ1 LYS 679 HZ1 LYS 679 -13.612 -15.478 10.749 652 HZ2 LYS 679 HZ2 LYS 679 -14.873 -14.515 11.190 653 HZ3 LYS 679 HZ3 LYS 679 -14.612 -15.916 11.980 654 HA PRO 680 HA PRO 680 -12.008 -13.547 4.421 655 HB2 PRO 680 HB2 PRO 680 -14.032 -15.298 3.876 656 HB3 PRO 680 HB3 PRO 680 -12.328 -15.825 3.948 657 HG2 PRO 680 HG2 PRO 680 -14.389 -15.939 6.184 658 HG3 PRO 680 HG3 PRO 680 -13.374 -17.281 5.558 659 HD2 PRO 680 HD2 PRO 680 -12.637 -15.854 7.743 660 HD3 PRO 680 HD3 PRO 680 -11.418 -16.381 6.551 661 H GLU 681 H GLU 681 -12.655 -12.086 6.574 662 HA GLU 681 HA GLU 681 -14.905 -10.576 5.829 663 HB2 GLU 681 HB2 GLU 681 -16.469 -11.124 7.472 664 HB3 GLU 681 HB3 GLU 681 -15.945 -12.686 6.847 665 HG2 GLU 681 HG2 GLU 681 -14.474 -13.036 8.763 666 HG3 GLU 681 HG3 GLU 681 -14.896 -11.467 9.452 667 H CYS 682 H CYS 682 -11.910 -10.851 7.397 668 HA CYS 682 HA CYS 682 -12.216 -8.275 8.671 669 HB2 CYS 682 HB2 CYS 682 -12.801 -10.158 10.360 670 HB3 CYS 682 HB3 CYS 682 -11.079 -10.536 10.331 671 H TYR 683 H TYR 683 -10.522 -7.210 7.766 672 HA TYR 683 HA TYR 683 -8.141 -8.781 6.840 673 HB2 TYR 683 HB2 TYR 683 -9.537 -6.384 5.585 674 HB3 TYR 683 HB3 TYR 683 -7.925 -6.906 5.158 675 HD1 TYR 683 HD2 TYR 683 -11.096 -9.004 5.647 676 HD2 TYR 683 HD1 TYR 683 -7.977 -7.677 2.979 677 HE1 TYR 683 HE2 TYR 683 -11.937 -10.515 3.919 678 HE2 TYR 683 HE1 TYR 683 -8.918 -9.101 1.208 679 HH TYR 683 HH TYR 683 -10.794 -11.727 1.907 680 H LYS 684 H LYS 684 -6.096 -7.443 6.834 681 HA LYS 684 HA LYS 684 -6.153 -5.173 8.733 682 HB2 LYS 684 HB2 LYS 684 -5.948 -7.459 9.917 683 HB3 LYS 684 HB3 LYS 684 -4.331 -7.558 9.246 684 HG2 LYS 684 HG2 LYS 684 -5.473 -5.510 11.184 685 HG3 LYS 684 HG3 LYS 684 -4.281 -6.765 11.543 686 HD2 LYS 684 HD2 LYS 684 -2.965 -5.578 9.576 687 HD3 LYS 684 HD3 LYS 684 -3.968 -4.181 10.054 688 HE2 LYS 684 HE2 LYS 684 -2.873 -4.318 12.313 689 HE3 LYS 684 HE3 LYS 684 -1.860 -5.631 11.677 690 HZ1 LYS 684 HZ1 LYS 684 -1.994 -2.831 10.689 691 HZ2 LYS 684 HZ2 LYS 684 -1.235 -4.016 9.862 692 HZ3 LYS 684 HZ3 LYS 684 -0.691 -3.567 11.373 693 H LYS 685 H LYS 685 -4.620 -3.680 8.154 694 HA LYS 685 HA LYS 685 -3.445 -3.815 5.609 695 HB2 LYS 685 HB2 LYS 685 -4.260 -1.737 6.409 696 HB3 LYS 685 HB3 LYS 685 -3.489 -1.935 7.976 697 HG2 LYS 685 HG2 LYS 685 -2.426 -0.173 6.659 698 HG3 LYS 685 HG3 LYS 685 -1.330 -1.498 7.077 699 HD2 LYS 685 HD2 LYS 685 -1.819 -2.428 4.723 700 HD3 LYS 685 HD3 LYS 685 -2.689 -0.963 4.392 701 HE2 LYS 685 HE2 LYS 685 -0.289 -1.224 3.598 702 HE3 LYS 685 HE3 LYS 685 -0.784 0.295 4.369 703 HZ1 LYS 685 HZ1 LYS 685 1.426 -0.591 5.129 704 HZ2 LYS 685 HZ2 LYS 685 0.687 -1.877 5.834 705 HZ3 LYS 685 HZ3 LYS 685 0.356 -0.383 6.361 706 H VAL 686 H VAL 686 -1.316 -4.262 4.911 707 HA VAL 686 HA VAL 686 0.092 -6.092 6.397 708 HB VAL 686 HB VAL 686 0.185 -5.739 3.928 709 HG11 VAL 686 HG11 VAL 686 0.824 -3.289 3.940 710 HG12 VAL 686 HG12 VAL 686 2.433 -3.764 4.512 711 HG13 VAL 686 HG13 VAL 686 1.847 -4.316 2.927 712 HG21 VAL 686 HG21 VAL 686 2.501 -6.562 3.708 713 HG22 VAL 686 HG22 VAL 686 2.801 -6.140 5.412 714 HG23 VAL 686 HG23 VAL 686 1.590 -7.369 4.981 Start of MODEL 15 1 H1 GLY 600 H1 GLY 600 12.679 -13.331 -12.295 2 H2 GLY 600 H2 GLY 600 11.168 -12.938 -11.804 3 H3 GLY 600 H3 GLY 600 11.990 -14.155 -11.028 4 HA2 GLY 600 HA2 GLY 600 11.964 -15.494 -13.027 5 HA3 GLY 600 HA3 GLY 600 10.314 -15.052 -12.514 6 H SER 601 H SER 601 9.350 -15.036 -14.670 7 HA SER 601 HA SER 601 10.356 -13.579 -16.844 8 HB2 SER 601 HB2 SER 601 7.440 -14.012 -16.102 9 HB3 SER 601 HB3 SER 601 8.136 -13.871 -17.728 10 HG SER 601 HG SER 601 9.040 -15.872 -17.497 11 H HIS 602 H HIS 602 9.056 -12.420 -13.854 12 HA HIS 602 HA HIS 602 9.641 -9.736 -14.683 13 HB2 HIS 602 HB2 HIS 602 7.669 -8.711 -13.767 14 HB3 HIS 602 HB3 HIS 602 7.140 -9.885 -14.960 15 HD1 HIS 602 HD1 HIS 602 6.926 -9.124 -11.229 16 HD2 HIS 602 HD2 HIS 602 5.943 -12.183 -13.978 17 HE1 HIS 602 HE1 HIS 602 5.351 -10.743 -10.021 18 H MET 603 H MET 603 9.311 -8.457 -12.357 19 HA MET 603 HA MET 603 10.156 -10.117 -10.085 20 HB2 MET 603 HB2 MET 603 11.524 -7.535 -10.983 21 HB3 MET 603 HB3 MET 603 11.742 -8.291 -9.399 22 HG2 MET 603 HG2 MET 603 12.643 -10.323 -10.452 23 HG3 MET 603 HG3 MET 603 12.399 -9.617 -12.050 24 HE1 MET 603 HE1 MET 603 15.635 -8.229 -9.027 25 HE2 MET 603 HE2 MET 603 13.913 -7.957 -8.699 26 HE3 MET 603 HE3 MET 603 14.556 -9.617 -8.774 27 H GLY 604 H GLY 604 10.036 -8.343 -8.058 28 HA2 GLY 604 HA2 GLY 604 8.231 -6.209 -8.255 29 HA3 GLY 604 HA3 GLY 604 7.401 -7.649 -7.607 30 H GLU 605 H GLU 605 7.609 -5.643 -5.769 31 HA GLU 605 HA GLU 605 9.261 -6.871 -3.807 32 HB2 GLU 605 HB2 GLU 605 10.549 -5.019 -3.108 33 HB3 GLU 605 HB3 GLU 605 10.826 -5.202 -4.823 34 HG2 GLU 605 HG2 GLU 605 10.607 -2.947 -4.792 35 HG3 GLU 605 HG3 GLU 605 8.901 -3.331 -5.005 36 H SER 606 H SER 606 8.713 -5.628 -1.625 37 HA SER 606 HA SER 606 5.871 -4.818 -1.571 38 HB2 SER 606 HB2 SER 606 5.569 -6.628 0.192 39 HB3 SER 606 HB3 SER 606 5.767 -7.196 -1.470 40 HG SER 606 HG SER 606 7.051 -8.255 0.255 41 H GLY 607 H GLY 607 8.149 -3.161 -1.147 42 HA2 GLY 607 HA2 GLY 607 8.183 -2.723 1.808 43 HA3 GLY 607 HA3 GLY 607 9.687 -2.852 0.880 44 H LYS 608 H LYS 608 9.932 -1.281 -1.001 45 HA LYS 608 HA LYS 608 9.110 1.382 0.044 46 HB2 LYS 608 HB2 LYS 608 11.554 0.715 -0.500 47 HB3 LYS 608 HB3 LYS 608 11.122 0.939 -2.186 48 HG2 LYS 608 HG2 LYS 608 10.904 2.985 0.084 49 HG3 LYS 608 HG3 LYS 608 12.174 2.944 -1.128 50 HD2 LYS 608 HD2 LYS 608 9.234 3.556 -1.678 51 HD3 LYS 608 HD3 LYS 608 10.532 4.735 -1.540 52 HE2 LYS 608 HE2 LYS 608 11.678 3.855 -3.480 53 HE3 LYS 608 HE3 LYS 608 10.557 2.487 -3.597 54 HZ1 LYS 608 HZ1 LYS 608 9.415 5.193 -3.750 55 HZ2 LYS 608 HZ2 LYS 608 8.834 3.866 -4.311 56 HZ3 LYS 608 HZ3 LYS 608 10.126 4.503 -5.102 57 H ILE 609 H ILE 609 6.860 0.571 -0.656 58 HA ILE 609 HA ILE 609 6.262 1.309 -3.389 59 HB ILE 609 HB ILE 609 5.200 -0.407 -1.380 60 HG12 ILE 609 HG12 ILE 609 3.463 -0.832 -3.035 61 HG13 ILE 609 HG13 ILE 609 4.048 0.570 -3.976 62 HG21 ILE 609 HG21 ILE 609 3.135 1.771 -1.798 63 HG22 ILE 609 HG22 ILE 609 2.972 0.248 -0.909 64 HG23 ILE 609 HG23 ILE 609 4.053 1.504 -0.293 65 HD11 ILE 609 HD11 ILE 609 4.913 -1.591 -4.860 66 HD12 ILE 609 HD12 ILE 609 6.249 -0.599 -4.272 67 HD13 ILE 609 HD13 ILE 609 5.651 -1.941 -3.282 68 H ASP 610 H ASP 610 4.377 2.983 -3.505 69 HA ASP 610 HA ASP 610 4.736 5.269 -1.751 70 HB2 ASP 610 HB2 ASP 610 5.011 5.687 -4.744 71 HB3 ASP 610 HB3 ASP 610 5.417 6.796 -3.448 72 H ILE 611 H ILE 611 3.138 7.034 -2.828 73 HA ILE 611 HA ILE 611 0.688 5.670 -3.796 74 HB ILE 611 HB ILE 611 1.178 8.647 -3.312 75 HG12 ILE 611 HG12 ILE 611 -0.508 8.074 -1.319 76 HG13 ILE 611 HG13 ILE 611 0.222 6.478 -1.410 77 HG21 ILE 611 HG21 ILE 611 -1.363 7.004 -3.666 78 HG22 ILE 611 HG22 ILE 611 -1.282 8.759 -3.349 79 HG23 ILE 611 HG23 ILE 611 -0.655 8.108 -4.861 80 HD11 ILE 611 HD11 ILE 611 2.444 7.500 -0.901 81 HD12 ILE 611 HD12 ILE 611 1.712 9.118 -0.975 82 HD13 ILE 611 HD13 ILE 611 1.243 7.978 0.300 83 H ASP 612 H ASP 612 3.245 7.929 -4.765 84 HA ASP 612 HA ASP 612 2.345 8.675 -7.245 85 HB2 ASP 612 HB2 ASP 612 5.184 8.386 -6.202 86 HB3 ASP 612 HB3 ASP 612 4.656 9.448 -7.525 87 H THR 613 H THR 613 4.274 5.828 -6.365 88 HA THR 613 HA THR 613 4.892 4.943 -8.995 89 HB THR 613 HB THR 613 5.926 4.178 -6.840 90 HG1 THR 613 HG1 THR 613 4.959 2.377 -8.779 91 HG21 THR 613 HG21 THR 613 3.752 3.649 -5.653 92 HG22 THR 613 HG22 THR 613 5.069 2.467 -5.520 93 HG23 THR 613 HG23 THR 613 3.711 2.152 -6.612 94 H ILE 614 H ILE 614 1.832 5.193 -7.556 95 HA ILE 614 HA ILE 614 0.684 3.132 -9.381 96 HB ILE 614 HB ILE 614 -0.369 4.277 -6.773 97 HG12 ILE 614 HG12 ILE 614 0.156 1.325 -7.199 98 HG13 ILE 614 HG13 ILE 614 1.545 2.349 -6.949 99 HG21 ILE 614 HG21 ILE 614 -2.246 3.851 -8.262 100 HG22 ILE 614 HG22 ILE 614 -1.621 2.228 -8.637 101 HG23 ILE 614 HG23 ILE 614 -2.202 2.614 -6.999 102 HD11 ILE 614 HD11 ILE 614 0.541 3.265 -4.877 103 HD12 ILE 614 HD12 ILE 614 -0.761 2.063 -5.026 104 HD13 ILE 614 HD13 ILE 614 0.932 1.538 -4.821 105 H MET 615 H MET 615 0.377 6.540 -8.130 106 HA MET 615 HA MET 615 -1.687 7.301 -9.971 107 HB2 MET 615 HB2 MET 615 0.547 8.994 -8.825 108 HB3 MET 615 HB3 MET 615 -0.911 9.586 -9.647 109 HG2 MET 615 HG2 MET 615 -2.312 8.602 -7.874 110 HG3 MET 615 HG3 MET 615 -0.863 8.092 -7.013 111 HE1 MET 615 HE1 MET 615 0.691 11.524 -5.816 112 HE2 MET 615 HE2 MET 615 0.834 9.759 -5.788 113 HE3 MET 615 HE3 MET 615 1.140 10.660 -7.292 114 H THR 616 H THR 616 1.872 6.926 -10.374 115 HA THR 616 HA THR 616 1.937 8.226 -12.878 116 HB THR 616 HB THR 616 3.896 7.719 -11.423 117 HG1 THR 616 HG1 THR 616 3.811 7.029 -14.151 118 HG21 THR 616 HG21 THR 616 3.390 5.275 -11.017 119 HG22 THR 616 HG22 THR 616 5.046 5.600 -11.563 120 HG23 THR 616 HG23 THR 616 3.848 4.941 -12.695 121 H GLY 617 H GLY 617 0.347 5.300 -12.145 122 HA2 GLY 617 HA2 GLY 617 0.213 4.580 -15.042 123 HA3 GLY 617 HA3 GLY 617 0.422 3.359 -13.786 124 H LYS 618 H LYS 618 -1.561 5.543 -12.272 125 HA LYS 618 HA LYS 618 -4.090 4.586 -13.493 126 HB2 LYS 618 HB2 LYS 618 -3.221 4.561 -10.561 127 HB3 LYS 618 HB3 LYS 618 -4.885 4.503 -11.053 128 HG2 LYS 618 HG2 LYS 618 -4.283 2.404 -12.444 129 HG3 LYS 618 HG3 LYS 618 -2.708 2.447 -11.634 130 HD2 LYS 618 HD2 LYS 618 -3.943 2.316 -9.417 131 HD3 LYS 618 HD3 LYS 618 -5.441 2.084 -10.333 132 HE2 LYS 618 HE2 LYS 618 -4.450 0.060 -11.408 133 HE3 LYS 618 HE3 LYS 618 -2.969 0.295 -10.476 134 HZ1 LYS 618 HZ1 LYS 618 -4.402 -1.355 -9.450 135 HZ2 LYS 618 HZ2 LYS 618 -5.636 -0.294 -9.324 136 HZ3 LYS 618 HZ3 LYS 618 -4.260 -0.063 -8.456 137 HA PRO 619 HA PRO 619 -5.122 8.942 -12.913 138 HB2 PRO 619 HB2 PRO 619 -7.850 8.837 -12.662 139 HB3 PRO 619 HB3 PRO 619 -7.004 8.604 -14.228 140 HG2 PRO 619 HG2 PRO 619 -7.989 6.462 -12.302 141 HG3 PRO 619 HG3 PRO 619 -8.269 6.556 -14.073 142 HD2 PRO 619 HD2 PRO 619 -6.300 5.024 -13.026 143 HD3 PRO 619 HD3 PRO 619 -6.027 5.939 -14.540 144 H LYS 620 H LYS 620 -5.639 10.324 -11.133 145 HA LYS 620 HA LYS 620 -4.972 9.327 -8.651 146 HB2 LYS 620 HB2 LYS 620 -6.694 11.793 -9.052 147 HB3 LYS 620 HB3 LYS 620 -5.702 11.374 -7.642 148 HG2 LYS 620 HG2 LYS 620 -3.675 11.442 -9.187 149 HG3 LYS 620 HG3 LYS 620 -4.735 12.200 -10.387 150 HD2 LYS 620 HD2 LYS 620 -3.987 13.257 -7.621 151 HD3 LYS 620 HD3 LYS 620 -3.532 13.907 -9.188 152 HE2 LYS 620 HE2 LYS 620 -5.186 15.379 -8.683 153 HE3 LYS 620 HE3 LYS 620 -6.147 14.175 -9.547 154 HZ1 LYS 620 HZ1 LYS 620 -6.880 13.296 -7.375 155 HZ2 LYS 620 HZ2 LYS 620 -7.156 14.897 -7.453 156 HZ3 LYS 620 HZ3 LYS 620 -5.874 14.322 -6.595 157 H SER 621 H SER 621 -8.246 9.533 -9.959 158 HA SER 621 HA SER 621 -9.974 9.070 -7.881 159 HB2 SER 621 HB2 SER 621 -10.651 9.208 -10.195 160 HB3 SER 621 HB3 SER 621 -9.866 7.667 -10.577 161 HG SER 621 HG SER 621 -12.287 7.905 -10.000 162 H ALA 622 H ALA 622 -7.579 6.720 -9.197 163 HA ALA 622 HA ALA 622 -8.412 4.355 -7.871 164 HB1 ALA 622 HB1 ALA 622 -6.073 3.652 -8.192 165 HB2 ALA 622 HB2 ALA 622 -6.761 4.368 -9.664 166 HB3 ALA 622 HB3 ALA 622 -5.627 5.305 -8.662 167 H ARG 623 H ARG 623 -5.798 6.638 -6.833 168 HA ARG 623 HA ARG 623 -5.702 5.686 -4.121 169 HB2 ARG 623 HB2 ARG 623 -4.028 7.205 -3.887 170 HB3 ARG 623 HB3 ARG 623 -4.135 7.374 -5.632 171 HG2 ARG 623 HG2 ARG 623 -5.901 9.231 -5.103 172 HG3 ARG 623 HG3 ARG 623 -5.259 9.180 -3.465 173 HD2 ARG 623 HD2 ARG 623 -3.117 9.969 -4.358 174 HD3 ARG 623 HD3 ARG 623 -3.747 9.781 -6.028 175 HE ARG 623 HE ARG 623 -5.686 11.278 -4.876 176 HH11 ARG 623 HH11 ARG 623 -2.227 12.002 -5.045 177 HH12 ARG 623 HH12 ARG 623 -2.436 13.660 -4.575 178 HH21 ARG 623 HH21 ARG 623 -6.018 13.140 -4.338 179 HH22 ARG 623 HH22 ARG 623 -4.782 14.393 -4.087 180 H GLU 624 H GLU 624 -7.644 8.195 -5.715 181 HA GLU 624 HA GLU 624 -8.616 9.460 -3.455 182 HB2 GLU 624 HB2 GLU 624 -8.993 9.501 -6.249 183 HB3 GLU 624 HB3 GLU 624 -10.614 9.411 -5.576 184 HG2 GLU 624 HG2 GLU 624 -10.230 11.659 -5.870 185 HG3 GLU 624 HG3 GLU 624 -9.835 11.437 -4.187 186 H LYS 625 H LYS 625 -9.764 6.412 -4.859 187 HA LYS 625 HA LYS 625 -11.505 6.171 -2.397 188 HB2 LYS 625 HB2 LYS 625 -12.742 4.406 -3.459 189 HB3 LYS 625 HB3 LYS 625 -12.743 5.884 -4.425 190 HG2 LYS 625 HG2 LYS 625 -10.763 4.755 -5.717 191 HG3 LYS 625 HG3 LYS 625 -11.294 3.261 -4.957 192 HD2 LYS 625 HD2 LYS 625 -13.411 3.326 -6.030 193 HD3 LYS 625 HD3 LYS 625 -13.281 5.044 -6.436 194 HE2 LYS 625 HE2 LYS 625 -11.455 2.909 -7.579 195 HE3 LYS 625 HE3 LYS 625 -12.938 3.465 -8.379 196 HZ1 LYS 625 HZ1 LYS 625 -10.737 5.297 -7.626 197 HZ2 LYS 625 HZ2 LYS 625 -11.999 5.664 -8.569 198 HZ3 LYS 625 HZ3 LYS 625 -10.880 4.606 -9.124 199 H MET 626 H MET 626 -8.667 4.602 -3.912 200 HA MET 626 HA MET 626 -8.758 2.267 -2.245 201 HB2 MET 626 HB2 MET 626 -6.490 3.632 -3.747 202 HB3 MET 626 HB3 MET 626 -6.286 2.140 -2.844 203 HG2 MET 626 HG2 MET 626 -7.858 0.953 -4.249 204 HG3 MET 626 HG3 MET 626 -8.357 2.432 -5.047 205 HE1 MET 626 HE1 MET 626 -4.286 0.310 -5.731 206 HE2 MET 626 HE2 MET 626 -4.673 1.107 -4.196 207 HE3 MET 626 HE3 MET 626 -5.597 -0.325 -4.715 208 H MET 627 H MET 627 -7.298 5.523 -1.840 209 HA MET 627 HA MET 627 -5.923 4.954 0.578 210 HB2 MET 627 HB2 MET 627 -6.984 7.582 -0.496 211 HB3 MET 627 HB3 MET 627 -5.905 7.418 0.882 212 HG2 MET 627 HG2 MET 627 -5.216 6.386 -1.891 213 HG3 MET 627 HG3 MET 627 -4.790 7.993 -1.326 214 HE1 MET 627 HE1 MET 627 -1.885 7.529 1.034 215 HE2 MET 627 HE2 MET 627 -2.732 8.588 -0.113 216 HE3 MET 627 HE3 MET 627 -3.566 8.018 1.353 217 H LYS 628 H LYS 628 -9.238 5.828 -0.206 218 HA LYS 628 HA LYS 628 -10.102 6.322 2.552 219 HB2 LYS 628 HB2 LYS 628 -11.810 5.435 0.177 220 HB3 LYS 628 HB3 LYS 628 -12.397 5.863 1.773 221 HG2 LYS 628 HG2 LYS 628 -11.466 8.171 1.481 222 HG3 LYS 628 HG3 LYS 628 -11.021 7.740 -0.185 223 HD2 LYS 628 HD2 LYS 628 -13.426 7.181 -0.650 224 HD3 LYS 628 HD3 LYS 628 -13.823 7.598 1.021 225 HE2 LYS 628 HE2 LYS 628 -14.459 9.511 -0.105 226 HE3 LYS 628 HE3 LYS 628 -12.857 9.930 0.517 227 HZ1 LYS 628 HZ1 LYS 628 -12.955 10.596 -1.732 228 HZ2 LYS 628 HZ2 LYS 628 -13.578 9.160 -2.237 229 HZ3 LYS 628 HZ3 LYS 628 -12.020 9.231 -1.757 230 H ILE 629 H ILE 629 -10.235 3.465 0.360 231 HA ILE 629 HA ILE 629 -11.397 1.708 2.223 232 HB ILE 629 HB ILE 629 -9.530 1.177 -0.105 233 HG12 ILE 629 HG12 ILE 629 -12.492 0.519 0.184 234 HG13 ILE 629 HG13 ILE 629 -11.975 2.113 -0.347 235 HG21 ILE 629 HG21 ILE 629 -11.044 -0.883 1.579 236 HG22 ILE 629 HG22 ILE 629 -10.185 -1.218 0.060 237 HG23 ILE 629 HG23 ILE 629 -9.280 -0.722 1.467 238 HD11 ILE 629 HD11 ILE 629 -10.848 1.207 -2.292 239 HD12 ILE 629 HD12 ILE 629 -11.202 -0.453 -1.771 240 HD13 ILE 629 HD13 ILE 629 -12.527 0.630 -2.221 241 H ILE 630 H ILE 630 -7.824 1.948 1.569 242 HA ILE 630 HA ILE 630 -7.119 0.348 3.753 243 HB ILE 630 HB ILE 630 -4.873 1.341 3.656 244 HG12 ILE 630 HG12 ILE 630 -4.597 2.852 1.459 245 HG13 ILE 630 HG13 ILE 630 -6.197 3.387 1.942 246 HG21 ILE 630 HG21 ILE 630 -6.056 0.698 0.932 247 HG22 ILE 630 HG22 ILE 630 -4.369 0.508 1.441 248 HG23 ILE 630 HG23 ILE 630 -5.625 -0.498 2.176 249 HD11 ILE 630 HD11 ILE 630 -5.276 4.085 4.156 250 HD12 ILE 630 HD12 ILE 630 -3.676 3.511 3.638 251 HD13 ILE 630 HD13 ILE 630 -4.456 4.872 2.803 252 H GLU 631 H GLU 631 -8.013 3.854 3.922 253 HA GLU 631 HA GLU 631 -7.181 4.113 6.655 254 HB2 GLU 631 HB2 GLU 631 -8.782 5.652 4.651 255 HB3 GLU 631 HB3 GLU 631 -9.286 5.873 6.305 256 HG2 GLU 631 HG2 GLU 631 -6.379 6.099 5.464 257 HG3 GLU 631 HG3 GLU 631 -7.504 7.470 5.441 258 H ILE 632 H ILE 632 -10.304 3.187 5.074 259 HA ILE 632 HA ILE 632 -11.689 2.889 7.564 260 HB ILE 632 HB ILE 632 -12.155 1.518 4.895 261 HG12 ILE 632 HG12 ILE 632 -13.872 3.736 6.088 262 HG13 ILE 632 HG13 ILE 632 -12.431 4.151 5.182 263 HG21 ILE 632 HG21 ILE 632 -13.832 1.588 7.450 264 HG22 ILE 632 HG22 ILE 632 -14.513 1.124 5.880 265 HG23 ILE 632 HG23 ILE 632 -13.216 0.169 6.587 266 HD11 ILE 632 HD11 ILE 632 -14.742 2.506 4.073 267 HD12 ILE 632 HD12 ILE 632 -14.386 4.207 3.724 268 HD13 ILE 632 HD13 ILE 632 -13.258 2.944 3.199 269 H ILE 633 H ILE 633 -9.714 0.609 5.609 270 HA ILE 633 HA ILE 633 -10.206 -1.737 7.110 271 HB ILE 633 HB ILE 633 -7.605 -0.962 5.728 272 HG12 ILE 633 HG12 ILE 633 -9.976 -1.166 4.388 273 HG13 ILE 633 HG13 ILE 633 -8.400 -1.514 3.701 274 HG21 ILE 633 HG21 ILE 633 -7.216 -2.773 7.256 275 HG22 ILE 633 HG22 ILE 633 -8.574 -3.695 6.599 276 HG23 ILE 633 HG23 ILE 633 -7.136 -3.362 5.597 277 HD11 ILE 633 HD11 ILE 633 -10.109 -3.154 3.130 278 HD12 ILE 633 HD12 ILE 633 -8.802 -3.908 4.056 279 HD13 ILE 633 HD13 ILE 633 -10.333 -3.525 4.863 280 H ASP 634 H ASP 634 -7.581 0.761 7.401 281 HA ASP 634 HA ASP 634 -6.569 -0.713 9.635 282 HB2 ASP 634 HB2 ASP 634 -5.275 0.736 7.894 283 HB3 ASP 634 HB3 ASP 634 -5.598 2.066 9.018 284 H SER 635 H SER 635 -8.541 2.280 9.339 285 HA SER 635 HA SER 635 -8.426 2.987 12.092 286 HB2 SER 635 HB2 SER 635 -9.130 4.447 10.197 287 HB3 SER 635 HB3 SER 635 -10.634 3.513 10.061 288 HG SER 635 HG SER 635 -10.660 5.509 11.340 289 H LEU 636 H LEU 636 -10.518 0.665 10.291 290 HA LEU 636 HA LEU 636 -12.110 -0.027 12.611 291 HB2 LEU 636 HB2 LEU 636 -11.433 -1.479 10.052 292 HB3 LEU 636 HB3 LEU 636 -12.462 -2.189 11.292 293 HG LEU 636 HG LEU 636 -13.090 0.511 10.013 294 HD11 LEU 636 HD11 LEU 636 -14.602 -0.696 8.524 295 HD12 LEU 636 HD12 LEU 636 -14.087 -2.255 9.216 296 HD13 LEU 636 HD13 LEU 636 -12.943 -1.260 8.291 297 HD21 LEU 636 HD21 LEU 636 -15.384 0.011 10.773 298 HD22 LEU 636 HD22 LEU 636 -14.265 0.092 12.138 299 HD23 LEU 636 HD23 LEU 636 -14.817 -1.488 11.533 300 H ALA 637 H ALA 637 -9.216 -1.462 11.015 301 HA ALA 637 HA ALA 637 -9.008 -3.630 12.824 302 HB1 ALA 637 HB1 ALA 637 -6.934 -2.498 10.910 303 HB2 ALA 637 HB2 ALA 637 -6.980 -4.126 11.598 304 HB3 ALA 637 HB3 ALA 637 -8.240 -3.636 10.473 305 H VAL 638 H VAL 638 -7.876 -0.363 13.316 306 HA VAL 638 HA VAL 638 -5.850 -1.015 15.229 307 HB VAL 638 HB VAL 638 -6.444 1.238 14.026 308 HG11 VAL 638 HG11 VAL 638 -8.743 1.426 15.102 309 HG12 VAL 638 HG12 VAL 638 -7.919 1.778 16.631 310 HG13 VAL 638 HG13 VAL 638 -7.708 2.856 15.236 311 HG21 VAL 638 HG21 VAL 638 -5.244 2.519 15.729 312 HG22 VAL 638 HG22 VAL 638 -5.472 1.200 16.901 313 HG23 VAL 638 HG23 VAL 638 -4.494 0.943 15.436 314 H SER 639 H SER 639 -9.378 -1.079 15.428 315 HA SER 639 HA SER 639 -9.269 -1.534 18.367 316 HB2 SER 639 HB2 SER 639 -11.456 -0.309 18.381 317 HB3 SER 639 HB3 SER 639 -10.060 0.677 17.909 318 HG SER 639 HG SER 639 -11.511 1.130 16.363 319 H SER 640 H SER 640 -9.565 -3.235 15.696 320 HA SER 640 HA SER 640 -11.555 -5.135 16.781 321 HB2 SER 640 HB2 SER 640 -12.606 -3.850 14.908 322 HB3 SER 640 HB3 SER 640 -11.223 -4.244 13.874 323 HG SER 640 HG SER 640 -12.439 -5.854 13.316 324 H GLU 641 H GLU 641 -11.079 -7.323 15.858 325 HA GLU 641 HA GLU 641 -8.285 -8.060 15.697 326 HB2 GLU 641 HB2 GLU 641 -10.765 -9.453 14.581 327 HB3 GLU 641 HB3 GLU 641 -9.143 -10.148 14.678 328 HG2 GLU 641 HG2 GLU 641 -9.249 -9.843 17.194 329 HG3 GLU 641 HG3 GLU 641 -10.951 -9.389 17.009 330 H CYS 642 H CYS 642 -10.867 -7.315 13.326 331 HA CYS 642 HA CYS 642 -8.994 -6.422 11.304 332 HB2 CYS 642 HB2 CYS 642 -9.907 -8.228 9.702 333 HB3 CYS 642 HB3 CYS 642 -8.651 -8.660 10.844 334 H ALA 643 H ALA 643 -10.214 -5.918 9.275 335 HA ALA 643 HA ALA 643 -12.652 -4.376 9.922 336 HB1 ALA 643 HB1 ALA 643 -10.723 -3.263 8.831 337 HB2 ALA 643 HB2 ALA 643 -10.771 -4.437 7.504 338 HB3 ALA 643 HB3 ALA 643 -12.121 -3.314 7.728 339 H LYS 644 H LYS 644 -14.590 -5.330 9.500 340 HA LYS 644 HA LYS 644 -14.742 -7.758 7.884 341 HB2 LYS 644 HB2 LYS 644 -16.998 -6.024 8.988 342 HB3 LYS 644 HB3 LYS 644 -17.140 -7.640 8.320 343 HG2 LYS 644 HG2 LYS 644 -17.035 -8.338 10.469 344 HG3 LYS 644 HG3 LYS 644 -15.294 -8.162 10.250 345 HD2 LYS 644 HD2 LYS 644 -15.798 -7.039 12.286 346 HD3 LYS 644 HD3 LYS 644 -15.560 -5.765 11.090 347 HE2 LYS 644 HE2 LYS 644 -18.173 -5.973 10.764 348 HE3 LYS 644 HE3 LYS 644 -18.142 -6.756 12.357 349 HZ1 LYS 644 HZ1 LYS 644 -17.120 -4.709 13.211 350 HZ2 LYS 644 HZ2 LYS 644 -18.482 -4.287 12.320 351 HZ3 LYS 644 HZ3 LYS 644 -17.037 -4.119 11.652 352 H VAL 645 H VAL 645 -15.396 -7.912 5.777 353 HA VAL 645 HA VAL 645 -15.518 -5.751 3.960 354 HB VAL 645 HB VAL 645 -16.591 -8.579 3.927 355 HG11 VAL 645 HG11 VAL 645 -16.836 -8.345 1.434 356 HG12 VAL 645 HG12 VAL 645 -18.056 -7.529 2.399 357 HG13 VAL 645 HG13 VAL 645 -16.739 -6.584 1.647 358 HG21 VAL 645 HG21 VAL 645 -14.749 -9.079 2.512 359 HG22 VAL 645 HG22 VAL 645 -14.441 -7.374 2.183 360 HG23 VAL 645 HG23 VAL 645 -14.051 -8.047 3.772 361 H LYS 646 H LYS 646 -18.043 -7.014 6.186 362 HA LYS 646 HA LYS 646 -20.254 -5.645 5.025 363 HB2 LYS 646 HB2 LYS 646 -19.726 -5.998 8.013 364 HB3 LYS 646 HB3 LYS 646 -21.261 -5.650 7.238 365 HG2 LYS 646 HG2 LYS 646 -19.765 -8.251 7.378 366 HG3 LYS 646 HG3 LYS 646 -21.423 -7.881 7.819 367 HD2 LYS 646 HD2 LYS 646 -21.923 -7.554 5.335 368 HD3 LYS 646 HD3 LYS 646 -20.275 -8.151 5.020 369 HE2 LYS 646 HE2 LYS 646 -21.141 -10.087 6.711 370 HE3 LYS 646 HE3 LYS 646 -22.703 -9.629 6.001 371 HZ1 LYS 646 HZ1 LYS 646 -21.650 -11.381 4.741 372 HZ2 LYS 646 HZ2 LYS 646 -20.246 -10.539 4.659 373 HZ3 LYS 646 HZ3 LYS 646 -21.565 -10.010 3.802 374 H ASP 647 H ASP 647 -17.579 -4.426 7.200 375 HA ASP 647 HA ASP 647 -19.085 -2.061 7.727 376 HB2 ASP 647 HB2 ASP 647 -16.098 -2.587 8.008 377 HB3 ASP 647 HB3 ASP 647 -16.944 -1.187 8.674 378 H ILE 648 H ILE 648 -16.550 -3.121 5.569 379 HA ILE 648 HA ILE 648 -15.813 -0.542 4.540 380 HB ILE 648 HB ILE 648 -15.334 -3.292 3.308 381 HG12 ILE 648 HG12 ILE 648 -13.437 -1.836 5.204 382 HG13 ILE 648 HG13 ILE 648 -14.552 -3.020 5.791 383 HG21 ILE 648 HG21 ILE 648 -13.813 -0.646 3.051 384 HG22 ILE 648 HG22 ILE 648 -13.339 -2.177 2.295 385 HG23 ILE 648 HG23 ILE 648 -14.833 -1.382 1.799 386 HD11 ILE 648 HD11 ILE 648 -12.411 -3.595 3.742 387 HD12 ILE 648 HD12 ILE 648 -12.462 -4.105 5.446 388 HD13 ILE 648 HD13 ILE 648 -13.634 -4.750 4.297 389 H LEU 649 H LEU 649 -17.896 -3.225 3.326 390 HA LEU 649 HA LEU 649 -18.781 -1.939 0.963 391 HB2 LEU 649 HB2 LEU 649 -20.027 -3.987 2.823 392 HB3 LEU 649 HB3 LEU 649 -20.889 -3.402 1.408 393 HG LEU 649 HG LEU 649 -18.131 -4.680 1.212 394 HD11 LEU 649 HD11 LEU 649 -19.850 -6.266 2.120 395 HD12 LEU 649 HD12 LEU 649 -19.317 -6.717 0.483 396 HD13 LEU 649 HD13 LEU 649 -20.887 -5.926 0.730 397 HD21 LEU 649 HD21 LEU 649 -20.299 -4.254 -0.875 398 HD22 LEU 649 HD22 LEU 649 -18.675 -4.915 -1.154 399 HD23 LEU 649 HD23 LEU 649 -18.890 -3.216 -0.707 400 H LYS 650 H LYS 650 -20.010 -1.707 4.346 401 HA LYS 650 HA LYS 650 -22.251 -0.058 3.711 402 HB2 LYS 650 HB2 LYS 650 -21.884 -1.169 5.896 403 HB3 LYS 650 HB3 LYS 650 -20.520 -0.101 6.215 404 HG2 LYS 650 HG2 LYS 650 -22.217 1.855 5.946 405 HG3 LYS 650 HG3 LYS 650 -23.466 0.609 6.100 406 HD2 LYS 650 HD2 LYS 650 -21.207 1.168 8.074 407 HD3 LYS 650 HD3 LYS 650 -22.871 1.730 8.261 408 HE2 LYS 650 HE2 LYS 650 -23.668 -0.573 8.475 409 HE3 LYS 650 HE3 LYS 650 -22.055 -1.205 8.089 410 HZ1 LYS 650 HZ1 LYS 650 -21.217 -0.181 10.079 411 HZ2 LYS 650 HZ2 LYS 650 -22.447 -1.207 10.457 412 HZ3 LYS 650 HZ3 LYS 650 -22.698 0.425 10.458 413 H GLU 651 H GLU 651 -18.975 1.001 4.921 414 HA GLU 651 HA GLU 651 -19.749 3.732 4.506 415 HB2 GLU 651 HB2 GLU 651 -16.999 2.530 5.010 416 HB3 GLU 651 HB3 GLU 651 -17.380 4.253 5.063 417 HG2 GLU 651 HG2 GLU 651 -18.398 2.071 6.916 418 HG3 GLU 651 HG3 GLU 651 -17.363 3.433 7.324 419 H ALA 652 H ALA 652 -17.960 1.468 2.391 420 HA ALA 652 HA ALA 652 -17.242 3.560 0.505 421 HB1 ALA 652 HB1 ALA 652 -17.389 0.570 0.186 422 HB2 ALA 652 HB2 ALA 652 -16.707 1.722 -0.991 423 HB3 ALA 652 HB3 ALA 652 -15.968 1.535 0.611 424 H GLN 653 H GLN 653 -20.223 1.498 0.871 425 HA GLN 653 HA GLN 653 -21.377 2.584 -1.573 426 HB2 GLN 653 HB2 GLN 653 -22.561 1.180 0.838 427 HB3 GLN 653 HB3 GLN 653 -23.563 1.851 -0.451 428 HG2 GLN 653 HG2 GLN 653 -22.554 0.487 -2.139 429 HG3 GLN 653 HG3 GLN 653 -21.296 -0.082 -1.043 430 HE21 GLN 653 HE21 GLN 653 -22.189 -1.126 1.005 431 HE22 GLN 653 HE22 GLN 653 -23.514 -2.301 0.781 432 H GLN 654 H GLN 654 -21.372 3.603 1.872 433 HA GLN 654 HA GLN 654 -23.064 5.881 1.480 434 HB2 GLN 654 HB2 GLN 654 -20.784 5.455 3.456 435 HB3 GLN 654 HB3 GLN 654 -21.846 6.847 3.477 436 HG2 GLN 654 HG2 GLN 654 -22.821 3.971 3.771 437 HG3 GLN 654 HG3 GLN 654 -22.468 5.055 5.111 438 HE21 GLN 654 HE21 GLN 654 -23.750 7.181 5.159 439 HE22 GLN 654 HE22 GLN 654 -25.395 7.096 4.532 440 H VAL 655 H VAL 655 -19.493 5.560 1.065 441 HA VAL 655 HA VAL 655 -19.059 8.224 0.125 442 HB VAL 655 HB VAL 655 -17.609 5.585 -0.233 443 HG11 VAL 655 HG11 VAL 655 -17.024 6.843 -2.244 444 HG12 VAL 655 HG12 VAL 655 -16.631 8.271 -1.261 445 HG13 VAL 655 HG13 VAL 655 -15.665 6.774 -1.129 446 HG21 VAL 655 HG21 VAL 655 -17.597 6.751 2.015 447 HG22 VAL 655 HG22 VAL 655 -15.998 6.542 1.303 448 HG23 VAL 655 HG23 VAL 655 -16.805 8.130 1.245 449 H GLY 656 H GLY 656 -20.195 5.301 -1.562 450 HA2 GLY 656 HA2 GLY 656 -22.051 5.987 -3.087 451 HA3 GLY 656 HA3 GLY 656 -20.907 7.060 -3.891 452 H ILE 657 H ILE 657 -19.579 3.976 -2.925 453 HA ILE 657 HA ILE 657 -19.195 3.362 -5.783 454 HB ILE 657 HB ILE 657 -17.910 2.223 -3.266 455 HG12 ILE 657 HG12 ILE 657 -16.738 4.325 -5.153 456 HG13 ILE 657 HG13 ILE 657 -17.483 4.725 -3.608 457 HG21 ILE 657 HG21 ILE 657 -16.177 1.357 -4.760 458 HG22 ILE 657 HG22 ILE 657 -17.737 0.768 -5.278 459 HG23 ILE 657 HG23 ILE 657 -16.980 2.102 -6.170 460 HD11 ILE 657 HD11 ILE 657 -15.146 4.684 -3.277 461 HD12 ILE 657 HD12 ILE 657 -15.858 3.312 -2.413 462 HD13 ILE 657 HD13 ILE 657 -14.991 3.049 -3.949 463 H GLU 658 H GLU 658 -19.570 1.052 -6.560 464 HA GLU 658 HA GLU 658 -22.102 0.045 -5.482 465 HB2 GLU 658 HB2 GLU 658 -22.055 0.121 -7.803 466 HB3 GLU 658 HB3 GLU 658 -20.364 -0.371 -7.901 467 HG2 GLU 658 HG2 GLU 658 -21.950 -1.997 -8.855 468 HG3 GLU 658 HG3 GLU 658 -20.834 -2.614 -7.652 469 H LYS 659 H LYS 659 -22.266 -1.788 -4.283 470 HA LYS 659 HA LYS 659 -20.248 -2.968 -2.767 471 HB2 LYS 659 HB2 LYS 659 -21.767 -4.951 -2.527 472 HB3 LYS 659 HB3 LYS 659 -22.538 -3.390 -2.219 473 HG2 LYS 659 HG2 LYS 659 -23.270 -3.437 -4.623 474 HG3 LYS 659 HG3 LYS 659 -22.790 -5.134 -4.698 475 HD2 LYS 659 HD2 LYS 659 -24.570 -5.701 -3.181 476 HD3 LYS 659 HD3 LYS 659 -24.908 -3.987 -2.827 477 HE2 LYS 659 HE2 LYS 659 -24.996 -5.172 -5.646 478 HE3 LYS 659 HE3 LYS 659 -26.430 -5.086 -4.601 479 HZ1 LYS 659 HZ1 LYS 659 -26.383 -3.217 -6.052 480 HZ2 LYS 659 HZ2 LYS 659 -24.850 -2.816 -5.675 481 HZ3 LYS 659 HZ3 LYS 659 -26.034 -2.641 -4.541 482 H SER 660 H SER 660 -21.277 -4.004 -6.084 483 HA SER 660 HA SER 660 -19.477 -6.228 -6.135 484 HB2 SER 660 HB2 SER 660 -20.486 -4.670 -8.546 485 HB3 SER 660 HB3 SER 660 -20.025 -6.376 -8.454 486 HG SER 660 HG SER 660 -22.340 -5.031 -7.370 487 H ASN 661 H ASN 661 -19.049 -2.783 -6.763 488 HA ASN 661 HA ASN 661 -16.528 -2.952 -8.188 489 HB2 ASN 661 HB2 ASN 661 -17.960 -0.639 -6.955 490 HB3 ASN 661 HB3 ASN 661 -16.330 -0.604 -7.600 491 HD21 ASN 661 HD21 ASN 661 -17.666 1.128 -9.018 492 HD22 ASN 661 HD22 ASN 661 -18.321 0.431 -10.489 493 H ILE 662 H ILE 662 -17.669 -2.515 -4.863 494 HA ILE 662 HA ILE 662 -15.097 -1.939 -3.666 495 HB ILE 662 HB ILE 662 -17.777 -2.880 -2.604 496 HG12 ILE 662 HG12 ILE 662 -16.503 -0.188 -2.114 497 HG13 ILE 662 HG13 ILE 662 -17.348 -0.494 -3.609 498 HG21 ILE 662 HG21 ILE 662 -16.289 -3.637 -0.949 499 HG22 ILE 662 HG22 ILE 662 -15.241 -2.200 -1.069 500 HG23 ILE 662 HG23 ILE 662 -16.819 -2.096 -0.309 501 HD11 ILE 662 HD11 ILE 662 -18.685 -0.838 -0.914 502 HD12 ILE 662 HD12 ILE 662 -18.840 0.572 -1.975 503 HD13 ILE 662 HD13 ILE 662 -19.428 -0.995 -2.505 504 H GLU 663 H GLU 663 -16.981 -4.827 -4.492 505 HA GLU 663 HA GLU 663 -15.273 -6.668 -3.051 506 HB2 GLU 663 HB2 GLU 663 -17.330 -6.997 -5.252 507 HB3 GLU 663 HB3 GLU 663 -16.447 -8.371 -4.587 508 HG2 GLU 663 HG2 GLU 663 -17.768 -6.435 -2.657 509 HG3 GLU 663 HG3 GLU 663 -18.786 -7.512 -3.567 510 H LYS 664 H LYS 664 -15.362 -5.570 -6.517 511 HA LYS 664 HA LYS 664 -12.984 -6.993 -7.174 512 HB2 LYS 664 HB2 LYS 664 -13.025 -4.283 -8.414 513 HB3 LYS 664 HB3 LYS 664 -12.787 -5.873 -9.138 514 HG2 LYS 664 HG2 LYS 664 -15.272 -6.253 -8.815 515 HG3 LYS 664 HG3 LYS 664 -15.333 -4.564 -8.277 516 HD2 LYS 664 HD2 LYS 664 -14.434 -3.853 -10.504 517 HD3 LYS 664 HD3 LYS 664 -14.656 -5.527 -11.054 518 HE2 LYS 664 HE2 LYS 664 -16.720 -3.472 -10.227 519 HE3 LYS 664 HE3 LYS 664 -16.609 -4.343 -11.754 520 HZ1 LYS 664 HZ1 LYS 664 -17.262 -6.348 -10.563 521 HZ2 LYS 664 HZ2 LYS 664 -18.380 -5.152 -10.347 522 HZ3 LYS 664 HZ3 LYS 664 -17.319 -5.522 -9.132 523 H LEU 665 H LEU 665 -13.295 -3.700 -5.868 524 HA LEU 665 HA LEU 665 -10.569 -2.986 -5.833 525 HB2 LEU 665 HB2 LEU 665 -12.891 -2.203 -4.028 526 HB3 LEU 665 HB3 LEU 665 -11.297 -1.568 -3.740 527 HG LEU 665 HG LEU 665 -12.478 -1.379 -6.543 528 HD11 LEU 665 HD11 LEU 665 -13.429 0.795 -6.102 529 HD12 LEU 665 HD12 LEU 665 -12.943 0.725 -4.397 530 HD13 LEU 665 HD13 LEU 665 -14.176 -0.387 -5.028 531 HD21 LEU 665 HD21 LEU 665 -10.528 0.409 -5.019 532 HD22 LEU 665 HD22 LEU 665 -11.007 0.581 -6.722 533 HD23 LEU 665 HD23 LEU 665 -10.071 -0.826 -6.206 534 H LEU 666 H LEU 666 -12.426 -4.326 -3.083 535 HA LEU 666 HA LEU 666 -10.253 -4.536 -1.281 536 HB2 LEU 666 HB2 LEU 666 -12.934 -5.931 -1.562 537 HB3 LEU 666 HB3 LEU 666 -11.874 -6.215 -0.207 538 HG LEU 666 HG LEU 666 -12.256 -4.133 0.748 539 HD11 LEU 666 HD11 LEU 666 -11.627 -2.636 -0.943 540 HD12 LEU 666 HD12 LEU 666 -13.071 -2.130 -0.070 541 HD13 LEU 666 HD13 LEU 666 -13.206 -2.773 -1.702 542 HD21 LEU 666 HD21 LEU 666 -14.137 -5.488 0.992 543 HD22 LEU 666 HD22 LEU 666 -14.765 -5.019 -0.577 544 HD23 LEU 666 HD23 LEU 666 -14.693 -3.834 0.770 545 H THR 667 H THR 667 -11.642 -6.860 -3.612 546 HA THR 667 HA THR 667 -9.908 -9.033 -3.065 547 HB THR 667 HB THR 667 -11.112 -8.257 -5.751 548 HG1 THR 667 HG1 THR 667 -12.737 -8.556 -4.430 549 HG21 THR 667 HG21 THR 667 -10.030 -10.931 -4.746 550 HG22 THR 667 HG22 THR 667 -9.329 -9.939 -6.042 551 HG23 THR 667 HG23 THR 667 -10.923 -10.671 -6.259 552 H ASP 668 H ASP 668 -9.462 -6.310 -5.460 553 HA ASP 668 HA ASP 668 -6.941 -7.197 -6.378 554 HB2 ASP 668 HB2 ASP 668 -8.428 -5.450 -7.427 555 HB3 ASP 668 HB3 ASP 668 -7.906 -4.319 -6.176 556 H MET 669 H MET 669 -7.846 -5.153 -3.614 557 HA MET 669 HA MET 669 -5.228 -4.515 -2.762 558 HB2 MET 669 HB2 MET 669 -7.723 -4.877 -1.046 559 HB3 MET 669 HB3 MET 669 -6.215 -4.128 -0.546 560 HG2 MET 669 HG2 MET 669 -6.739 -2.678 -2.779 561 HG3 MET 669 HG3 MET 669 -8.377 -3.054 -2.246 562 HE1 MET 669 HE1 MET 669 -6.611 -0.278 -2.472 563 HE2 MET 669 HE2 MET 669 -8.383 -0.295 -2.263 564 HE3 MET 669 HE3 MET 669 -7.353 0.644 -1.149 565 H ARG 670 H ARG 670 -7.305 -7.221 -1.463 566 HA ARG 670 HA ARG 670 -5.182 -8.230 0.181 567 HB2 ARG 670 HB2 ARG 670 -6.479 -10.310 0.400 568 HB3 ARG 670 HB3 ARG 670 -7.448 -8.880 0.733 569 HG2 ARG 670 HG2 ARG 670 -8.684 -9.070 -1.215 570 HG3 ARG 670 HG3 ARG 670 -7.501 -10.100 -2.035 571 HD2 ARG 670 HD2 ARG 670 -8.063 -11.974 -0.794 572 HD3 ARG 670 HD3 ARG 670 -9.075 -11.056 0.311 573 HE ARG 670 HE ARG 670 -9.717 -11.211 -2.598 574 HH11 ARG 670 HH11 ARG 670 -10.953 -11.997 0.648 575 HH12 ARG 670 HH12 ARG 670 -12.598 -11.759 0.205 576 HH21 ARG 670 HH21 ARG 670 -11.989 -10.583 -3.080 577 HH22 ARG 670 HH22 ARG 670 -13.161 -10.976 -1.901 578 H LYS 671 H LYS 671 -6.056 -8.812 -3.143 579 HA LYS 671 HA LYS 671 -4.407 -11.113 -3.519 580 HB2 LYS 671 HB2 LYS 671 -6.492 -10.544 -4.740 581 HB3 LYS 671 HB3 LYS 671 -5.711 -9.116 -5.399 582 HG2 LYS 671 HG2 LYS 671 -4.014 -11.122 -6.255 583 HG3 LYS 671 HG3 LYS 671 -5.549 -11.989 -6.132 584 HD2 LYS 671 HD2 LYS 671 -5.315 -11.092 -8.409 585 HD3 LYS 671 HD3 LYS 671 -6.630 -10.253 -7.567 586 HE2 LYS 671 HE2 LYS 671 -4.944 -8.408 -7.002 587 HE3 LYS 671 HE3 LYS 671 -3.798 -9.206 -8.077 588 HZ1 LYS 671 HZ1 LYS 671 -5.028 -8.527 -9.886 589 HZ2 LYS 671 HZ2 LYS 671 -5.415 -7.299 -8.823 590 HZ3 LYS 671 HZ3 LYS 671 -6.466 -8.510 -9.061 591 H SER 672 H SER 672 -3.971 -7.584 -4.253 592 HA SER 672 HA SER 672 -1.305 -8.055 -5.337 593 HB2 SER 672 HB2 SER 672 -2.861 -6.297 -6.220 594 HB3 SER 672 HB3 SER 672 -2.707 -5.437 -4.671 595 HG SER 672 HG SER 672 -0.331 -5.683 -5.138 596 H GLY 673 H GLY 673 -2.555 -7.538 -2.109 597 HA2 GLY 673 HA2 GLY 673 -1.226 -7.812 -0.189 598 HA3 GLY 673 HA3 GLY 673 0.240 -7.486 -1.129 599 H ILE 674 H ILE 674 -2.739 -5.577 -1.087 600 HA ILE 674 HA ILE 674 -1.388 -3.202 0.126 601 HB ILE 674 HB ILE 674 -4.130 -3.631 -1.119 602 HG12 ILE 674 HG12 ILE 674 -1.623 -2.354 -2.236 603 HG13 ILE 674 HG13 ILE 674 -2.445 -3.792 -2.823 604 HG21 ILE 674 HG21 ILE 674 -2.899 -1.053 -0.117 605 HG22 ILE 674 HG22 ILE 674 -4.434 -1.187 -1.021 606 HG23 ILE 674 HG23 ILE 674 -4.301 -1.906 0.561 607 HD11 ILE 674 HD11 ILE 674 -4.428 -2.387 -3.447 608 HD12 ILE 674 HD12 ILE 674 -3.452 -0.946 -3.059 609 HD13 ILE 674 HD13 ILE 674 -2.938 -2.044 -4.348 610 H ILE 675 H ILE 675 -3.774 -5.764 0.665 611 HA ILE 675 HA ILE 675 -3.748 -5.226 3.525 612 HB ILE 675 HB ILE 675 -6.153 -5.500 3.777 613 HG12 ILE 675 HG12 ILE 675 -6.196 -5.902 0.798 614 HG13 ILE 675 HG13 ILE 675 -6.639 -7.059 2.044 615 HG21 ILE 675 HG21 ILE 675 -6.951 -3.387 2.962 616 HG22 ILE 675 HG22 ILE 675 -5.247 -3.183 3.314 617 HG23 ILE 675 HG23 ILE 675 -5.779 -3.367 1.643 618 HD11 ILE 675 HD11 ILE 675 -8.564 -5.634 2.656 619 HD12 ILE 675 HD12 ILE 675 -8.186 -4.562 1.292 620 HD13 ILE 675 HD13 ILE 675 -8.630 -6.257 0.999 621 H TYR 676 H TYR 676 -4.884 -7.340 4.488 622 HA TYR 676 HA TYR 676 -4.830 -9.691 2.711 623 HB2 TYR 676 HB2 TYR 676 -3.700 -10.852 4.879 624 HB3 TYR 676 HB3 TYR 676 -2.777 -10.254 3.505 625 HD1 TYR 676 HD2 TYR 676 -4.187 -8.541 6.587 626 HD2 TYR 676 HD1 TYR 676 -0.701 -9.501 4.226 627 HE1 TYR 676 HE2 TYR 676 -2.799 -6.986 7.952 628 HE2 TYR 676 HE1 TYR 676 0.675 -8.023 5.662 629 HH TYR 676 HH TYR 676 -0.822 -5.613 7.565 630 H GLU 677 H GLU 677 -5.921 -11.532 3.790 631 HA GLU 677 HA GLU 677 -8.176 -10.561 5.368 632 HB2 GLU 677 HB2 GLU 677 -8.242 -11.510 3.009 633 HB3 GLU 677 HB3 GLU 677 -7.876 -13.091 3.715 634 HG2 GLU 677 HG2 GLU 677 -9.843 -12.971 5.088 635 HG3 GLU 677 HG3 GLU 677 -10.189 -11.301 4.595 636 H ALA 678 H ALA 678 -7.796 -10.766 7.500 637 HA ALA 678 HA ALA 678 -5.891 -12.714 8.553 638 HB1 ALA 678 HB1 ALA 678 -6.420 -11.602 10.700 639 HB2 ALA 678 HB2 ALA 678 -6.040 -10.404 9.442 640 HB3 ALA 678 HB3 ALA 678 -7.732 -10.695 9.921 641 H LYS 679 H LYS 679 -9.402 -12.292 8.390 642 HA LYS 679 HA LYS 679 -9.803 -15.103 9.052 643 HB2 LYS 679 HB2 LYS 679 -11.228 -12.809 10.500 644 HB3 LYS 679 HB3 LYS 679 -11.879 -14.437 10.427 645 HG2 LYS 679 HG2 LYS 679 -9.780 -15.285 11.531 646 HG3 LYS 679 HG3 LYS 679 -9.242 -13.599 11.695 647 HD2 LYS 679 HD2 LYS 679 -11.332 -13.096 12.987 648 HD3 LYS 679 HD3 LYS 679 -11.751 -14.825 12.919 649 HE2 LYS 679 HE2 LYS 679 -9.592 -15.361 14.076 650 HE3 LYS 679 HE3 LYS 679 -9.214 -13.629 14.113 651 HZ1 LYS 679 HZ1 LYS 679 -11.337 -13.352 15.388 652 HZ2 LYS 679 HZ2 LYS 679 -10.124 -13.905 16.158 653 HZ3 LYS 679 HZ3 LYS 679 -11.310 -15.003 15.665 654 HA PRO 680 HA PRO 680 -12.183 -14.725 5.435 655 HB2 PRO 680 HB2 PRO 680 -14.709 -15.852 5.991 656 HB3 PRO 680 HB3 PRO 680 -13.223 -16.718 5.498 657 HG2 PRO 680 HG2 PRO 680 -14.304 -16.265 8.282 658 HG3 PRO 680 HG3 PRO 680 -13.578 -17.755 7.597 659 HD2 PRO 680 HD2 PRO 680 -12.136 -16.139 9.193 660 HD3 PRO 680 HD3 PRO 680 -11.376 -16.839 7.738 661 H GLU 681 H GLU 681 -13.043 -13.095 4.465 662 HA GLU 681 HA GLU 681 -13.829 -11.162 3.984 663 HB2 GLU 681 HB2 GLU 681 -15.985 -10.672 4.102 664 HB3 GLU 681 HB3 GLU 681 -16.051 -12.383 4.377 665 HG2 GLU 681 HG2 GLU 681 -17.012 -12.147 6.427 666 HG3 GLU 681 HG3 GLU 681 -15.984 -10.818 6.922 667 H CYS 682 H CYS 682 -12.096 -11.474 6.559 668 HA CYS 682 HA CYS 682 -12.688 -8.799 7.717 669 HB2 CYS 682 HB2 CYS 682 -13.471 -10.872 8.912 670 HB3 CYS 682 HB3 CYS 682 -11.779 -11.269 9.164 671 H TYR 683 H TYR 683 -11.155 -7.550 6.855 672 HA TYR 683 HA TYR 683 -8.531 -8.681 6.211 673 HB2 TYR 683 HB2 TYR 683 -9.725 -5.962 5.623 674 HB3 TYR 683 HB3 TYR 683 -8.232 -6.591 4.927 675 HD1 TYR 683 HD2 TYR 683 -8.688 -9.149 3.882 676 HD2 TYR 683 HD1 TYR 683 -11.323 -5.765 3.977 677 HE1 TYR 683 HE2 TYR 683 -9.891 -10.059 1.947 678 HE2 TYR 683 HE1 TYR 683 -12.440 -6.574 1.943 679 HH TYR 683 HH TYR 683 -11.713 -9.779 0.506 680 H LYS 684 H LYS 684 -6.572 -7.305 6.380 681 HA LYS 684 HA LYS 684 -6.682 -5.099 8.302 682 HB2 LYS 684 HB2 LYS 684 -4.749 -7.412 8.728 683 HB3 LYS 684 HB3 LYS 684 -4.487 -5.779 9.355 684 HG2 LYS 684 HG2 LYS 684 -6.794 -6.132 10.549 685 HG3 LYS 684 HG3 LYS 684 -6.540 -7.836 10.165 686 HD2 LYS 684 HD2 LYS 684 -5.447 -7.827 12.205 687 HD3 LYS 684 HD3 LYS 684 -4.099 -7.329 11.205 688 HE2 LYS 684 HE2 LYS 684 -3.929 -5.594 12.685 689 HE3 LYS 684 HE3 LYS 684 -5.174 -4.882 11.681 690 HZ1 LYS 684 HZ1 LYS 684 -6.723 -6.205 13.336 691 HZ2 LYS 684 HZ2 LYS 684 -6.131 -4.719 13.780 692 HZ3 LYS 684 HZ3 LYS 684 -5.440 -6.108 14.328 693 H LYS 685 H LYS 685 -4.879 -3.606 7.901 694 HA LYS 685 HA LYS 685 -4.219 -3.607 5.104 695 HB2 LYS 685 HB2 LYS 685 -5.062 -1.721 6.680 696 HB3 LYS 685 HB3 LYS 685 -3.404 -1.581 7.237 697 HG2 LYS 685 HG2 LYS 685 -3.888 -1.522 4.263 698 HG3 LYS 685 HG3 LYS 685 -4.538 -0.181 5.199 699 HD2 LYS 685 HD2 LYS 685 -2.461 0.627 5.839 700 HD3 LYS 685 HD3 LYS 685 -1.671 -0.943 5.668 701 HE2 LYS 685 HE2 LYS 685 -2.028 -0.821 3.186 702 HE3 LYS 685 HE3 LYS 685 -2.642 0.832 3.379 703 HZ1 LYS 685 HZ1 LYS 685 0.026 -0.201 4.153 704 HZ2 LYS 685 HZ2 LYS 685 -0.424 1.386 4.312 705 HZ3 LYS 685 HZ3 LYS 685 -0.253 0.659 2.813 706 H VAL 686 H VAL 686 -2.018 -3.195 4.182 707 HA VAL 686 HA VAL 686 0.226 -3.517 6.028 708 HB VAL 686 HB VAL 686 0.169 -5.687 5.157 709 HG11 VAL 686 HG11 VAL 686 -0.214 -4.588 2.376 710 HG12 VAL 686 HG12 VAL 686 0.175 -6.281 2.743 711 HG13 VAL 686 HG13 VAL 686 -1.349 -5.591 3.305 712 HG21 VAL 686 HG21 VAL 686 2.186 -4.203 3.457 713 HG22 VAL 686 HG22 VAL 686 2.382 -4.609 5.179 714 HG23 VAL 686 HG23 VAL 686 2.259 -5.901 3.971 Start of MODEL 16 1 H1 GLY 600 H1 GLY 600 13.018 16.063 10.664 2 H2 GLY 600 H2 GLY 600 11.877 16.857 11.568 3 H3 GLY 600 H3 GLY 600 11.567 15.339 11.036 4 HA2 GLY 600 HA2 GLY 600 11.817 17.754 9.376 5 HA3 GLY 600 HA3 GLY 600 11.584 16.099 8.743 6 H SER 601 H SER 601 9.471 15.311 8.608 7 HA SER 601 HA SER 601 7.446 16.167 10.520 8 HB2 SER 601 HB2 SER 601 6.386 14.049 9.715 9 HB3 SER 601 HB3 SER 601 6.737 15.170 8.391 10 HG SER 601 HG SER 601 7.514 12.664 8.625 11 H HIS 602 H HIS 602 6.832 14.129 11.977 12 HA HIS 602 HA HIS 602 9.279 12.787 13.033 13 HB2 HIS 602 HB2 HIS 602 6.850 13.829 14.528 14 HB3 HIS 602 HB3 HIS 602 8.042 12.732 15.219 15 HD1 HIS 602 HD1 HIS 602 10.211 13.815 16.187 16 HD2 HIS 602 HD2 HIS 602 7.930 16.358 13.722 17 HE1 HIS 602 HE1 HIS 602 11.288 16.133 16.314 18 H MET 603 H MET 603 6.876 12.200 11.007 19 HA MET 603 HA MET 603 6.826 9.364 11.470 20 HB2 MET 603 HB2 MET 603 4.211 10.946 11.243 21 HB3 MET 603 HB3 MET 603 4.363 9.184 11.167 22 HG2 MET 603 HG2 MET 603 5.220 9.173 13.492 23 HG3 MET 603 HG3 MET 603 4.971 10.925 13.566 24 HE1 MET 603 HE1 MET 603 3.503 10.908 15.608 25 HE2 MET 603 HE2 MET 603 2.148 9.781 15.875 26 HE3 MET 603 HE3 MET 603 3.813 9.159 15.734 27 H GLY 604 H GLY 604 5.566 8.447 9.299 28 HA2 GLY 604 HA2 GLY 604 5.338 10.129 7.046 29 HA3 GLY 604 HA3 GLY 604 6.940 9.364 7.044 30 H GLU 605 H GLU 605 5.617 8.605 4.958 31 HA GLU 605 HA GLU 605 3.753 6.477 5.088 32 HB2 GLU 605 HB2 GLU 605 5.778 7.318 2.981 33 HB3 GLU 605 HB3 GLU 605 4.623 5.993 2.759 34 HG2 GLU 605 HG2 GLU 605 2.735 7.546 3.151 35 HG3 GLU 605 HG3 GLU 605 3.867 8.885 3.353 36 H SER 606 H SER 606 4.317 5.029 6.624 37 HA SER 606 HA SER 606 7.000 4.166 7.064 38 HB2 SER 606 HB2 SER 606 4.340 3.463 8.359 39 HB3 SER 606 HB3 SER 606 5.930 3.007 9.000 40 HG SER 606 HG SER 606 5.234 5.745 8.439 41 H GLY 607 H GLY 607 6.160 3.263 4.491 42 HA2 GLY 607 HA2 GLY 607 7.201 0.643 4.514 43 HA3 GLY 607 HA3 GLY 607 5.447 0.564 4.192 44 H LYS 608 H LYS 608 7.574 -0.016 2.186 45 HA LYS 608 HA LYS 608 7.828 2.480 0.750 46 HB2 LYS 608 HB2 LYS 608 9.745 0.928 1.120 47 HB3 LYS 608 HB3 LYS 608 9.055 -0.139 -0.106 48 HG2 LYS 608 HG2 LYS 608 10.844 1.385 -0.937 49 HG3 LYS 608 HG3 LYS 608 9.346 1.566 -1.831 50 HD2 LYS 608 HD2 LYS 608 9.906 3.438 0.494 51 HD3 LYS 608 HD3 LYS 608 10.780 3.659 -1.015 52 HE2 LYS 608 HE2 LYS 608 9.076 4.613 -2.061 53 HE3 LYS 608 HE3 LYS 608 7.971 3.317 -1.665 54 HZ1 LYS 608 HZ1 LYS 608 8.526 5.254 0.460 55 HZ2 LYS 608 HZ2 LYS 608 7.064 4.567 -0.021 56 HZ3 LYS 608 HZ3 LYS 608 7.699 5.758 -0.877 57 H ILE 609 H ILE 609 5.469 2.434 0.612 58 HA ILE 609 HA ILE 609 4.854 1.993 -2.237 59 HB ILE 609 HB ILE 609 2.902 1.919 0.122 60 HG12 ILE 609 HG12 ILE 609 2.166 -0.225 -1.221 61 HG13 ILE 609 HG13 ILE 609 3.753 -0.130 -1.967 62 HG21 ILE 609 HG21 ILE 609 1.817 3.254 -1.589 63 HG22 ILE 609 HG22 ILE 609 2.254 2.072 -2.854 64 HG23 ILE 609 HG23 ILE 609 1.088 1.669 -1.579 65 HD11 ILE 609 HD11 ILE 609 3.262 -0.318 1.045 66 HD12 ILE 609 HD12 ILE 609 3.499 -1.717 -0.019 67 HD13 ILE 609 HD13 ILE 609 4.809 -0.564 0.200 68 H ASP 610 H ASP 610 3.384 4.055 -2.857 69 HA ASP 610 HA ASP 610 3.749 6.396 -1.258 70 HB2 ASP 610 HB2 ASP 610 4.740 6.795 -4.075 71 HB3 ASP 610 HB3 ASP 610 4.976 7.701 -2.679 72 H ILE 611 H ILE 611 2.573 8.210 -2.507 73 HA ILE 611 HA ILE 611 0.251 7.275 -4.018 74 HB ILE 611 HB ILE 611 1.462 10.024 -3.523 75 HG12 ILE 611 HG12 ILE 611 -1.146 9.143 -2.275 76 HG13 ILE 611 HG13 ILE 611 0.326 8.474 -1.590 77 HG21 ILE 611 HG21 ILE 611 0.108 10.194 -5.522 78 HG22 ILE 611 HG22 ILE 611 -1.221 9.295 -4.758 79 HG23 ILE 611 HG23 ILE 611 -0.787 10.926 -4.190 80 HD11 ILE 611 HD11 ILE 611 -0.294 10.509 -0.411 81 HD12 ILE 611 HD12 ILE 611 1.266 10.702 -1.234 82 HD13 ILE 611 HD13 ILE 611 -0.197 11.446 -1.922 83 H ASP 612 H ASP 612 3.483 8.458 -4.759 84 HA ASP 612 HA ASP 612 2.818 9.271 -7.517 85 HB2 ASP 612 HB2 ASP 612 4.581 10.500 -6.316 86 HB3 ASP 612 HB3 ASP 612 5.555 9.020 -6.213 87 H THR 613 H THR 613 4.512 6.695 -5.880 88 HA THR 613 HA THR 613 5.302 4.896 -7.811 89 HB THR 613 HB THR 613 4.647 5.116 -5.039 90 HG1 THR 613 HG1 THR 613 6.437 4.402 -4.771 91 HG21 THR 613 HG21 THR 613 2.857 3.730 -5.188 92 HG22 THR 613 HG22 THR 613 4.196 3.014 -4.275 93 HG23 THR 613 HG23 THR 613 3.860 2.448 -5.940 94 H ILE 614 H ILE 614 1.990 5.844 -7.081 95 HA ILE 614 HA ILE 614 0.929 3.771 -8.924 96 HB ILE 614 HB ILE 614 -0.627 5.891 -7.376 97 HG12 ILE 614 HG12 ILE 614 0.362 4.577 -5.667 98 HG13 ILE 614 HG13 ILE 614 -1.326 4.129 -5.812 99 HG21 ILE 614 HG21 ILE 614 -1.947 5.159 -9.183 100 HG22 ILE 614 HG22 ILE 614 -1.465 3.456 -8.971 101 HG23 ILE 614 HG23 ILE 614 -2.532 4.238 -7.798 102 HD11 ILE 614 HD11 ILE 614 1.048 2.568 -6.910 103 HD12 ILE 614 HD12 ILE 614 0.047 2.154 -5.508 104 HD13 ILE 614 HD13 ILE 614 -0.661 2.124 -7.145 105 H MET 615 H MET 615 0.825 7.289 -8.430 106 HA MET 615 HA MET 615 -0.612 7.855 -10.817 107 HB2 MET 615 HB2 MET 615 1.075 9.564 -9.034 108 HB3 MET 615 HB3 MET 615 0.168 10.205 -10.421 109 HG2 MET 615 HG2 MET 615 -1.467 8.500 -8.677 110 HG3 MET 615 HG3 MET 615 -0.791 9.887 -7.829 111 HE1 MET 615 HE1 MET 615 -3.413 10.381 -11.635 112 HE2 MET 615 HE2 MET 615 -1.692 9.973 -11.705 113 HE3 MET 615 HE3 MET 615 -2.845 8.802 -11.032 114 H THR 616 H THR 616 2.824 7.443 -10.333 115 HA THR 616 HA THR 616 3.755 8.899 -12.519 116 HB THR 616 HB THR 616 4.968 8.051 -10.495 117 HG1 THR 616 HG1 THR 616 6.646 8.504 -11.419 118 HG21 THR 616 HG21 THR 616 4.284 5.625 -10.677 119 HG22 THR 616 HG22 THR 616 6.021 5.890 -10.471 120 HG23 THR 616 HG23 THR 616 5.372 5.481 -12.075 121 H GLY 617 H GLY 617 2.157 5.808 -12.399 122 HA2 GLY 617 HA2 GLY 617 2.376 5.603 -15.374 123 HA3 GLY 617 HA3 GLY 617 2.717 4.190 -14.378 124 H LYS 618 H LYS 618 0.242 5.781 -12.723 125 HA LYS 618 HA LYS 618 -1.875 4.288 -14.207 126 HB2 LYS 618 HB2 LYS 618 -1.300 4.592 -11.242 127 HB3 LYS 618 HB3 LYS 618 -2.885 4.244 -11.805 128 HG2 LYS 618 HG2 LYS 618 -1.938 2.190 -11.135 129 HG3 LYS 618 HG3 LYS 618 -2.035 2.134 -12.895 130 HD2 LYS 618 HD2 LYS 618 0.336 2.473 -13.120 131 HD3 LYS 618 HD3 LYS 618 0.530 2.897 -11.417 132 HE2 LYS 618 HE2 LYS 618 -0.399 0.169 -12.401 133 HE3 LYS 618 HE3 LYS 618 1.298 0.585 -12.128 134 HZ1 LYS 618 HZ1 LYS 618 -0.798 0.655 -10.058 135 HZ2 LYS 618 HZ2 LYS 618 0.793 1.036 -9.835 136 HZ3 LYS 618 HZ3 LYS 618 0.361 -0.502 -10.219 137 HA PRO 619 HA PRO 619 -4.110 8.176 -14.043 138 HB2 PRO 619 HB2 PRO 619 -6.712 7.357 -14.100 139 HB3 PRO 619 HB3 PRO 619 -5.616 7.201 -15.512 140 HG2 PRO 619 HG2 PRO 619 -6.297 5.082 -13.435 141 HG3 PRO 619 HG3 PRO 619 -6.349 4.920 -15.222 142 HD2 PRO 619 HD2 PRO 619 -4.212 4.094 -13.766 143 HD3 PRO 619 HD3 PRO 619 -3.990 4.863 -15.366 144 H LYS 620 H LYS 620 -5.684 9.375 -12.713 145 HA LYS 620 HA LYS 620 -5.261 9.091 -9.961 146 HB2 LYS 620 HB2 LYS 620 -7.098 10.698 -9.629 147 HB3 LYS 620 HB3 LYS 620 -5.852 11.224 -10.734 148 HG2 LYS 620 HG2 LYS 620 -7.218 11.109 -12.629 149 HG3 LYS 620 HG3 LYS 620 -8.405 10.043 -11.882 150 HD2 LYS 620 HD2 LYS 620 -7.933 12.881 -10.893 151 HD3 LYS 620 HD3 LYS 620 -9.110 12.494 -12.165 152 HE2 LYS 620 HE2 LYS 620 -10.455 11.159 -10.727 153 HE3 LYS 620 HE3 LYS 620 -9.140 10.947 -9.584 154 HZ1 LYS 620 HZ1 LYS 620 -9.389 13.410 -9.152 155 HZ2 LYS 620 HZ2 LYS 620 -10.388 12.305 -8.483 156 HZ3 LYS 620 HZ3 LYS 620 -10.916 13.223 -9.780 157 H SER 621 H SER 621 -8.301 8.179 -11.683 158 HA SER 621 HA SER 621 -9.860 6.980 -9.947 159 HB2 SER 621 HB2 SER 621 -10.345 5.304 -11.777 160 HB3 SER 621 HB3 SER 621 -10.483 7.028 -12.156 161 HG SER 621 HG SER 621 -9.345 5.907 -13.778 162 H ALA 622 H ALA 622 -6.699 5.542 -10.861 163 HA ALA 622 HA ALA 622 -7.292 2.891 -9.874 164 HB1 ALA 622 HB1 ALA 622 -5.508 3.316 -11.544 165 HB2 ALA 622 HB2 ALA 622 -4.614 4.272 -10.340 166 HB3 ALA 622 HB3 ALA 622 -4.872 2.537 -10.079 167 H ARG 623 H ARG 623 -5.172 5.532 -8.587 168 HA ARG 623 HA ARG 623 -5.159 4.380 -5.937 169 HB2 ARG 623 HB2 ARG 623 -4.263 6.474 -5.132 170 HB3 ARG 623 HB3 ARG 623 -3.393 5.957 -6.573 171 HG2 ARG 623 HG2 ARG 623 -4.602 7.576 -7.942 172 HG3 ARG 623 HG3 ARG 623 -5.632 7.996 -6.559 173 HD2 ARG 623 HD2 ARG 623 -3.486 8.696 -5.381 174 HD3 ARG 623 HD3 ARG 623 -2.727 8.568 -6.983 175 HE ARG 623 HE ARG 623 -3.657 10.563 -7.549 176 HH11 ARG 623 HH11 ARG 623 -5.580 9.404 -4.723 177 HH12 ARG 623 HH12 ARG 623 -6.911 10.492 -5.161 178 HH21 ARG 623 HH21 ARG 623 -5.421 12.200 -7.699 179 HH22 ARG 623 HH22 ARG 623 -6.807 11.909 -6.627 180 H GLU 624 H GLU 624 -7.317 6.787 -7.531 181 HA GLU 624 HA GLU 624 -8.605 7.684 -5.194 182 HB2 GLU 624 HB2 GLU 624 -9.577 7.425 -8.024 183 HB3 GLU 624 HB3 GLU 624 -10.495 8.311 -6.875 184 HG2 GLU 624 HG2 GLU 624 -7.610 9.103 -7.246 185 HG3 GLU 624 HG3 GLU 624 -8.749 9.418 -8.534 186 H LYS 625 H LYS 625 -9.108 4.639 -6.927 187 HA LYS 625 HA LYS 625 -11.217 4.001 -4.886 188 HB2 LYS 625 HB2 LYS 625 -11.862 2.106 -6.077 189 HB3 LYS 625 HB3 LYS 625 -11.748 3.450 -7.203 190 HG2 LYS 625 HG2 LYS 625 -9.413 2.487 -7.838 191 HG3 LYS 625 HG3 LYS 625 -9.876 1.067 -6.896 192 HD2 LYS 625 HD2 LYS 625 -10.362 0.583 -9.169 193 HD3 LYS 625 HD3 LYS 625 -11.924 0.860 -8.372 194 HE2 LYS 625 HE2 LYS 625 -11.940 3.193 -9.256 195 HE3 LYS 625 HE3 LYS 625 -10.365 2.919 -10.008 196 HZ1 LYS 625 HZ1 LYS 625 -12.171 2.652 -11.578 197 HZ2 LYS 625 HZ2 LYS 625 -12.854 1.467 -10.668 198 HZ3 LYS 625 HZ3 LYS 625 -11.390 1.218 -11.379 199 H MET 626 H MET 626 -7.939 2.791 -5.905 200 HA MET 626 HA MET 626 -7.942 0.586 -4.096 201 HB2 MET 626 HB2 MET 626 -5.663 2.141 -5.377 202 HB3 MET 626 HB3 MET 626 -5.476 0.611 -4.522 203 HG2 MET 626 HG2 MET 626 -6.902 -0.538 -6.144 204 HG3 MET 626 HG3 MET 626 -7.290 0.968 -6.940 205 HE1 MET 626 HE1 MET 626 -3.432 -1.476 -7.369 206 HE2 MET 626 HE2 MET 626 -4.192 -1.136 -5.794 207 HE3 MET 626 HE3 MET 626 -5.055 -2.100 -7.016 208 H MET 627 H MET 627 -6.849 3.924 -3.799 209 HA MET 627 HA MET 627 -5.629 3.679 -1.247 210 HB2 MET 627 HB2 MET 627 -4.906 5.794 -1.561 211 HB3 MET 627 HB3 MET 627 -5.166 5.293 -3.213 212 HG2 MET 627 HG2 MET 627 -6.128 7.306 -3.393 213 HG3 MET 627 HG3 MET 627 -7.552 6.477 -2.801 214 HE1 MET 627 HE1 MET 627 -4.839 9.139 -2.260 215 HE2 MET 627 HE2 MET 627 -4.893 9.488 -0.520 216 HE3 MET 627 HE3 MET 627 -4.233 7.942 -1.092 217 H LYS 628 H LYS 628 -8.896 4.025 -2.270 218 HA LYS 628 HA LYS 628 -9.823 4.896 0.404 219 HB2 LYS 628 HB2 LYS 628 -11.108 4.422 -2.290 220 HB3 LYS 628 HB3 LYS 628 -12.091 4.127 -0.873 221 HG2 LYS 628 HG2 LYS 628 -10.610 6.692 -0.661 222 HG3 LYS 628 HG3 LYS 628 -11.588 6.601 -2.118 223 HD2 LYS 628 HD2 LYS 628 -12.889 7.589 -0.304 224 HD3 LYS 628 HD3 LYS 628 -13.575 6.080 -0.870 225 HE2 LYS 628 HE2 LYS 628 -13.768 6.181 1.532 226 HE3 LYS 628 HE3 LYS 628 -12.708 4.866 1.044 227 HZ1 LYS 628 HZ1 LYS 628 -11.624 5.988 2.896 228 HZ2 LYS 628 HZ2 LYS 628 -11.866 7.455 2.214 229 HZ3 LYS 628 HZ3 LYS 628 -10.804 6.387 1.564 230 H ILE 629 H ILE 629 -9.900 1.986 -1.708 231 HA ILE 629 HA ILE 629 -11.232 0.278 0.059 232 HB ILE 629 HB ILE 629 -9.113 -0.256 -2.029 233 HG12 ILE 629 HG12 ILE 629 -12.086 -0.908 -2.169 234 HG13 ILE 629 HG13 ILE 629 -11.539 0.729 -2.474 235 HG21 ILE 629 HG21 ILE 629 -9.846 -2.639 -2.033 236 HG22 ILE 629 HG22 ILE 629 -9.036 -2.205 -0.535 237 HG23 ILE 629 HG23 ILE 629 -10.803 -2.336 -0.563 238 HD11 ILE 629 HD11 ILE 629 -10.906 -1.728 -4.071 239 HD12 ILE 629 HD12 ILE 629 -11.587 -0.151 -4.576 240 HD13 ILE 629 HD13 ILE 629 -9.883 -0.283 -4.183 241 H ILE 630 H ILE 630 -7.669 0.671 -0.238 242 HA ILE 630 HA ILE 630 -6.889 -1.104 1.824 243 HB ILE 630 HB ILE 630 -5.008 0.569 2.280 244 HG12 ILE 630 HG12 ILE 630 -4.966 1.932 -0.218 245 HG13 ILE 630 HG13 ILE 630 -6.466 2.355 0.605 246 HG21 ILE 630 HG21 ILE 630 -4.975 -1.483 0.711 247 HG22 ILE 630 HG22 ILE 630 -5.307 -0.389 -0.633 248 HG23 ILE 630 HG23 ILE 630 -3.791 -0.228 0.284 249 HD11 ILE 630 HD11 ILE 630 -5.177 2.998 2.625 250 HD12 ILE 630 HD12 ILE 630 -3.668 2.565 1.785 251 HD13 ILE 630 HD13 ILE 630 -4.666 3.906 1.189 252 H GLU 631 H GLU 631 -8.148 2.124 1.999 253 HA GLU 631 HA GLU 631 -7.239 2.591 4.698 254 HB2 GLU 631 HB2 GLU 631 -7.358 4.354 3.034 255 HB3 GLU 631 HB3 GLU 631 -9.105 4.172 2.863 256 HG2 GLU 631 HG2 GLU 631 -7.833 4.614 5.554 257 HG3 GLU 631 HG3 GLU 631 -8.038 5.961 4.428 258 H ILE 632 H ILE 632 -10.388 1.692 3.102 259 HA ILE 632 HA ILE 632 -11.809 1.539 5.579 260 HB ILE 632 HB ILE 632 -12.342 -0.582 3.526 261 HG12 ILE 632 HG12 ILE 632 -12.133 1.108 1.937 262 HG13 ILE 632 HG13 ILE 632 -13.835 0.849 2.206 263 HG21 ILE 632 HG21 ILE 632 -14.174 1.200 5.187 264 HG22 ILE 632 HG22 ILE 632 -14.657 -0.210 4.213 265 HG23 ILE 632 HG23 ILE 632 -13.630 -0.416 5.630 266 HD11 ILE 632 HD11 ILE 632 -12.203 3.219 3.213 267 HD12 ILE 632 HD12 ILE 632 -13.410 3.193 1.922 268 HD13 ILE 632 HD13 ILE 632 -13.915 2.930 3.603 269 H ILE 633 H ILE 633 -9.575 -0.745 3.931 270 HA ILE 633 HA ILE 633 -10.237 -2.917 5.668 271 HB ILE 633 HB ILE 633 -7.758 -2.560 3.931 272 HG12 ILE 633 HG12 ILE 633 -10.599 -3.545 3.544 273 HG13 ILE 633 HG13 ILE 633 -9.646 -2.494 2.540 274 HG21 ILE 633 HG21 ILE 633 -8.824 -5.108 5.200 275 HG22 ILE 633 HG22 ILE 633 -7.427 -4.953 4.119 276 HG23 ILE 633 HG23 ILE 633 -7.378 -4.224 5.721 277 HD11 ILE 633 HD11 ILE 633 -8.329 -4.319 1.708 278 HD12 ILE 633 HD12 ILE 633 -9.295 -5.480 2.672 279 HD13 ILE 633 HD13 ILE 633 -10.041 -4.532 1.370 280 H ASP 634 H ASP 634 -7.590 -0.463 5.755 281 HA ASP 634 HA ASP 634 -6.549 -1.581 8.179 282 HB2 ASP 634 HB2 ASP 634 -6.064 0.984 6.673 283 HB3 ASP 634 HB3 ASP 634 -5.531 0.868 8.350 284 H SER 635 H SER 635 -8.898 1.078 7.511 285 HA SER 635 HA SER 635 -9.133 1.933 10.187 286 HB2 SER 635 HB2 SER 635 -10.986 2.149 7.783 287 HB3 SER 635 HB3 SER 635 -11.298 2.949 9.333 288 HG SER 635 HG SER 635 -9.953 4.069 7.443 289 H LEU 636 H LEU 636 -10.601 -0.816 8.522 290 HA LEU 636 HA LEU 636 -12.340 -1.456 10.805 291 HB2 LEU 636 HB2 LEU 636 -11.545 -2.932 8.279 292 HB3 LEU 636 HB3 LEU 636 -12.579 -3.652 9.512 293 HG LEU 636 HG LEU 636 -13.279 -1.004 8.167 294 HD11 LEU 636 HD11 LEU 636 -14.137 -3.812 7.343 295 HD12 LEU 636 HD12 LEU 636 -13.071 -2.712 6.427 296 HD13 LEU 636 HD13 LEU 636 -14.765 -2.288 6.682 297 HD21 LEU 636 HD21 LEU 636 -14.476 -1.456 10.278 298 HD22 LEU 636 HD22 LEU 636 -14.984 -3.044 9.661 299 HD23 LEU 636 HD23 LEU 636 -15.565 -1.556 8.894 300 H ALA 637 H ALA 637 -9.242 -2.665 9.405 301 HA ALA 637 HA ALA 637 -8.953 -4.804 11.263 302 HB1 ALA 637 HB1 ALA 637 -8.011 -4.809 8.994 303 HB2 ALA 637 HB2 ALA 637 -6.897 -3.492 9.452 304 HB3 ALA 637 HB3 ALA 637 -6.774 -5.079 10.226 305 H VAL 638 H VAL 638 -8.066 -1.435 11.584 306 HA VAL 638 HA VAL 638 -5.949 -1.515 13.350 307 HB VAL 638 HB VAL 638 -6.981 0.459 12.215 308 HG11 VAL 638 HG11 VAL 638 -8.810 1.685 13.190 309 HG12 VAL 638 HG12 VAL 638 -9.360 0.027 12.928 310 HG13 VAL 638 HG13 VAL 638 -8.923 0.564 14.560 311 HG21 VAL 638 HG21 VAL 638 -6.378 2.117 13.830 312 HG22 VAL 638 HG22 VAL 638 -6.505 0.957 15.164 313 HG23 VAL 638 HG23 VAL 638 -5.242 0.761 13.927 314 H SER 639 H SER 639 -9.120 -2.696 14.069 315 HA SER 639 HA SER 639 -8.128 -3.490 16.710 316 HB2 SER 639 HB2 SER 639 -10.672 -1.842 16.417 317 HB3 SER 639 HB3 SER 639 -10.178 -2.708 17.890 318 HG SER 639 HG SER 639 -8.140 -1.210 16.868 319 H SER 640 H SER 640 -8.613 -4.845 14.165 320 HA SER 640 HA SER 640 -10.579 -6.844 15.098 321 HB2 SER 640 HB2 SER 640 -10.495 -5.914 12.206 322 HB3 SER 640 HB3 SER 640 -11.658 -6.999 12.971 323 HG SER 640 HG SER 640 -11.506 -4.217 12.928 324 H GLU 641 H GLU 641 -10.186 -8.969 14.047 325 HA GLU 641 HA GLU 641 -7.484 -9.705 13.540 326 HB2 GLU 641 HB2 GLU 641 -10.052 -10.939 12.442 327 HB3 GLU 641 HB3 GLU 641 -8.457 -11.694 12.445 328 HG2 GLU 641 HG2 GLU 641 -8.482 -11.654 14.951 329 HG3 GLU 641 HG3 GLU 641 -10.133 -11.009 14.896 330 H CYS 642 H CYS 642 -10.186 -8.751 11.402 331 HA CYS 642 HA CYS 642 -8.461 -8.002 9.170 332 HB2 CYS 642 HB2 CYS 642 -9.700 -9.544 7.700 333 HB3 CYS 642 HB3 CYS 642 -8.758 -10.400 8.911 334 H ALA 643 H ALA 643 -9.903 -7.192 7.391 335 HA ALA 643 HA ALA 643 -12.263 -5.716 8.359 336 HB1 ALA 643 HB1 ALA 643 -10.882 -5.899 5.651 337 HB2 ALA 643 HB2 ALA 643 -12.252 -4.849 6.053 338 HB3 ALA 643 HB3 ALA 643 -10.680 -4.603 6.852 339 H LYS 644 H LYS 644 -14.043 -6.922 8.496 340 HA LYS 644 HA LYS 644 -14.694 -9.253 6.935 341 HB2 LYS 644 HB2 LYS 644 -17.101 -8.504 7.388 342 HB3 LYS 644 HB3 LYS 644 -16.110 -9.025 8.749 343 HG2 LYS 644 HG2 LYS 644 -15.827 -6.167 8.455 344 HG3 LYS 644 HG3 LYS 644 -17.537 -6.589 8.307 345 HD2 LYS 644 HD2 LYS 644 -15.985 -7.857 10.525 346 HD3 LYS 644 HD3 LYS 644 -16.213 -6.114 10.619 347 HE2 LYS 644 HE2 LYS 644 -18.543 -8.010 10.117 348 HE3 LYS 644 HE3 LYS 644 -17.984 -7.600 11.754 349 HZ1 LYS 644 HZ1 LYS 644 -19.234 -5.802 9.770 350 HZ2 LYS 644 HZ2 LYS 644 -18.263 -5.171 10.796 351 HZ3 LYS 644 HZ3 LYS 644 -19.604 -5.995 11.380 352 H VAL 645 H VAL 645 -15.050 -9.307 4.954 353 HA VAL 645 HA VAL 645 -14.990 -7.148 3.069 354 HB VAL 645 HB VAL 645 -15.839 -10.040 2.839 355 HG11 VAL 645 HG11 VAL 645 -17.072 -9.088 1.061 356 HG12 VAL 645 HG12 VAL 645 -15.763 -7.983 0.611 357 HG13 VAL 645 HG13 VAL 645 -15.614 -9.730 0.324 358 HG21 VAL 645 HG21 VAL 645 -13.397 -8.537 1.807 359 HG22 VAL 645 HG22 VAL 645 -13.430 -9.559 3.250 360 HG23 VAL 645 HG23 VAL 645 -13.718 -10.270 1.652 361 H LYS 646 H LYS 646 -17.692 -8.555 4.862 362 HA LYS 646 HA LYS 646 -19.821 -7.448 3.323 363 HB2 LYS 646 HB2 LYS 646 -19.902 -9.249 5.014 364 HB3 LYS 646 HB3 LYS 646 -19.612 -8.069 6.307 365 HG2 LYS 646 HG2 LYS 646 -21.747 -6.940 5.705 366 HG3 LYS 646 HG3 LYS 646 -22.001 -8.113 4.404 367 HD2 LYS 646 HD2 LYS 646 -21.908 -8.719 7.401 368 HD3 LYS 646 HD3 LYS 646 -23.331 -8.674 6.367 369 HE2 LYS 646 HE2 LYS 646 -23.012 -10.934 6.379 370 HE3 LYS 646 HE3 LYS 646 -22.040 -10.520 4.963 371 HZ1 LYS 646 HZ1 LYS 646 -21.002 -11.067 7.695 372 HZ2 LYS 646 HZ2 LYS 646 -20.041 -10.630 6.409 373 HZ3 LYS 646 HZ3 LYS 646 -20.761 -11.990 6.337 374 H ASP 647 H ASP 647 -17.740 -6.115 5.984 375 HA ASP 647 HA ASP 647 -19.252 -3.671 6.124 376 HB2 ASP 647 HB2 ASP 647 -16.623 -4.664 7.203 377 HB3 ASP 647 HB3 ASP 647 -16.961 -2.964 7.260 378 H ILE 648 H ILE 648 -16.351 -4.816 4.402 379 HA ILE 648 HA ILE 648 -15.654 -2.228 3.384 380 HB ILE 648 HB ILE 648 -15.123 -4.821 1.888 381 HG12 ILE 648 HG12 ILE 648 -13.410 -3.726 4.165 382 HG13 ILE 648 HG13 ILE 648 -14.433 -5.126 4.264 383 HG21 ILE 648 HG21 ILE 648 -13.125 -3.590 1.065 384 HG22 ILE 648 HG22 ILE 648 -14.583 -2.667 0.735 385 HG23 ILE 648 HG23 ILE 648 -13.541 -2.208 2.095 386 HD11 ILE 648 HD11 ILE 648 -12.015 -4.903 2.473 387 HD12 ILE 648 HD12 ILE 648 -12.263 -5.999 3.840 388 HD13 ILE 648 HD13 ILE 648 -13.190 -6.204 2.353 389 H LEU 649 H LEU 649 -17.663 -4.866 2.070 390 HA LEU 649 HA LEU 649 -18.510 -3.632 -0.300 391 HB2 LEU 649 HB2 LEU 649 -19.740 -5.657 1.575 392 HB3 LEU 649 HB3 LEU 649 -20.637 -5.093 0.169 393 HG LEU 649 HG LEU 649 -17.794 -6.126 -0.142 394 HD11 LEU 649 HD11 LEU 649 -18.678 -8.351 -0.658 395 HD12 LEU 649 HD12 LEU 649 -20.324 -7.824 -0.243 396 HD13 LEU 649 HD13 LEU 649 -19.075 -7.907 1.012 397 HD21 LEU 649 HD21 LEU 649 -18.439 -6.495 -2.419 398 HD22 LEU 649 HD22 LEU 649 -19.027 -4.872 -2.005 399 HD23 LEU 649 HD23 LEU 649 -20.157 -6.219 -2.061 400 H LYS 650 H LYS 650 -19.876 -3.324 3.017 401 HA LYS 650 HA LYS 650 -22.017 -1.550 2.246 402 HB2 LYS 650 HB2 LYS 650 -20.445 -1.774 4.841 403 HB3 LYS 650 HB3 LYS 650 -21.757 -0.628 4.589 404 HG2 LYS 650 HG2 LYS 650 -23.402 -2.352 4.452 405 HG3 LYS 650 HG3 LYS 650 -22.174 -3.601 4.241 406 HD2 LYS 650 HD2 LYS 650 -22.851 -3.854 6.460 407 HD3 LYS 650 HD3 LYS 650 -21.307 -3.045 6.577 408 HE2 LYS 650 HE2 LYS 650 -24.070 -1.816 6.960 409 HE3 LYS 650 HE3 LYS 650 -22.873 -2.183 8.205 410 HZ1 LYS 650 HZ1 LYS 650 -22.725 0.111 7.806 411 HZ2 LYS 650 HZ2 LYS 650 -22.687 -0.057 6.173 412 HZ3 LYS 650 HZ3 LYS 650 -21.399 -0.483 7.042 413 H GLU 651 H GLU 651 -18.765 -0.720 3.651 414 HA GLU 651 HA GLU 651 -19.456 2.047 3.312 415 HB2 GLU 651 HB2 GLU 651 -16.683 0.998 3.893 416 HB3 GLU 651 HB3 GLU 651 -17.333 2.592 4.227 417 HG2 GLU 651 HG2 GLU 651 -17.598 0.065 5.757 418 HG3 GLU 651 HG3 GLU 651 -17.432 1.705 6.330 419 H ALA 652 H ALA 652 -17.612 -0.170 1.223 420 HA ALA 652 HA ALA 652 -16.666 1.912 -0.556 421 HB1 ALA 652 HB1 ALA 652 -17.050 -1.047 -0.976 422 HB2 ALA 652 HB2 ALA 652 -16.230 0.068 -2.091 423 HB3 ALA 652 HB3 ALA 652 -15.563 -0.225 -0.472 424 H GLN 653 H GLN 653 -19.736 -0.026 -0.360 425 HA GLN 653 HA GLN 653 -20.818 1.098 -2.791 426 HB2 GLN 653 HB2 GLN 653 -22.077 -0.198 -0.360 427 HB3 GLN 653 HB3 GLN 653 -23.038 0.474 -1.681 428 HG2 GLN 653 HG2 GLN 653 -22.157 -1.036 -3.289 429 HG3 GLN 653 HG3 GLN 653 -20.805 -1.479 -2.267 430 HE21 GLN 653 HE21 GLN 653 -24.192 -1.381 -1.051 431 HE22 GLN 653 HE22 GLN 653 -24.258 -3.127 -0.828 432 H GLN 654 H GLN 654 -20.896 2.140 0.659 433 HA GLN 654 HA GLN 654 -22.406 4.522 0.175 434 HB2 GLN 654 HB2 GLN 654 -20.293 3.955 2.299 435 HB3 GLN 654 HB3 GLN 654 -21.311 5.382 2.271 436 HG2 GLN 654 HG2 GLN 654 -22.336 2.521 2.509 437 HG3 GLN 654 HG3 GLN 654 -22.133 3.651 3.839 438 HE21 GLN 654 HE21 GLN 654 -23.378 5.865 3.508 439 HE22 GLN 654 HE22 GLN 654 -24.981 5.673 2.807 440 H VAL 655 H VAL 655 -18.843 3.963 -0.038 441 HA VAL 655 HA VAL 655 -18.133 6.623 -0.779 442 HB VAL 655 HB VAL 655 -16.949 3.880 -1.206 443 HG11 VAL 655 HG11 VAL 655 -15.643 6.411 -2.242 444 HG12 VAL 655 HG12 VAL 655 -14.895 4.790 -2.131 445 HG13 VAL 655 HG13 VAL 655 -16.236 5.058 -3.227 446 HG21 VAL 655 HG21 VAL 655 -15.267 4.630 0.345 447 HG22 VAL 655 HG22 VAL 655 -15.880 6.307 0.282 448 HG23 VAL 655 HG23 VAL 655 -16.840 5.030 1.037 449 H GLY 656 H GLY 656 -19.356 3.887 -2.728 450 HA2 GLY 656 HA2 GLY 656 -20.971 4.916 -4.387 451 HA3 GLY 656 HA3 GLY 656 -19.556 5.747 -5.053 452 H ILE 657 H ILE 657 -18.808 2.516 -4.040 453 HA ILE 657 HA ILE 657 -18.371 1.856 -6.887 454 HB ILE 657 HB ILE 657 -17.284 0.626 -4.320 455 HG12 ILE 657 HG12 ILE 657 -15.805 2.493 -6.241 456 HG13 ILE 657 HG13 ILE 657 -16.594 3.087 -4.788 457 HG21 ILE 657 HG21 ILE 657 -17.211 -0.903 -6.282 458 HG22 ILE 657 HG22 ILE 657 -16.336 0.321 -7.211 459 HG23 ILE 657 HG23 ILE 657 -15.608 -0.444 -5.771 460 HD11 ILE 657 HD11 ILE 657 -15.211 1.675 -3.363 461 HD12 ILE 657 HD12 ILE 657 -14.318 1.095 -4.793 462 HD13 ILE 657 HD13 ILE 657 -14.268 2.809 -4.341 463 H GLU 658 H GLU 658 -18.834 -0.566 -7.548 464 HA GLU 658 HA GLU 658 -21.540 -1.161 -6.510 465 HB2 GLU 658 HB2 GLU 658 -21.045 -0.818 -8.987 466 HB3 GLU 658 HB3 GLU 658 -20.157 -2.340 -8.952 467 HG2 GLU 658 HG2 GLU 658 -22.968 -2.342 -7.839 468 HG3 GLU 658 HG3 GLU 658 -22.804 -2.074 -9.571 469 H LYS 659 H LYS 659 -21.976 -3.144 -5.684 470 HA LYS 659 HA LYS 659 -20.410 -4.640 -4.064 471 HB2 LYS 659 HB2 LYS 659 -22.207 -6.391 -5.631 472 HB3 LYS 659 HB3 LYS 659 -22.082 -6.166 -3.912 473 HG2 LYS 659 HG2 LYS 659 -23.594 -4.339 -3.924 474 HG3 LYS 659 HG3 LYS 659 -23.474 -4.097 -5.671 475 HD2 LYS 659 HD2 LYS 659 -24.631 -6.630 -4.477 476 HD3 LYS 659 HD3 LYS 659 -25.594 -5.197 -4.896 477 HE2 LYS 659 HE2 LYS 659 -24.727 -5.279 -7.228 478 HE3 LYS 659 HE3 LYS 659 -23.794 -6.712 -6.847 479 HZ1 LYS 659 HZ1 LYS 659 -25.854 -7.876 -6.383 480 HZ2 LYS 659 HZ2 LYS 659 -25.846 -7.272 -7.915 481 HZ3 LYS 659 HZ3 LYS 659 -26.736 -6.529 -6.748 482 H SER 660 H SER 660 -21.019 -5.547 -7.503 483 HA SER 660 HA SER 660 -19.320 -7.810 -7.477 484 HB2 SER 660 HB2 SER 660 -21.034 -7.284 -9.253 485 HB3 SER 660 HB3 SER 660 -19.970 -5.983 -9.826 486 HG SER 660 HG SER 660 -19.521 -8.754 -9.919 487 H ASN 661 H ASN 661 -18.681 -4.379 -8.139 488 HA ASN 661 HA ASN 661 -16.014 -4.739 -9.150 489 HB2 ASN 661 HB2 ASN 661 -17.346 -2.263 -8.062 490 HB3 ASN 661 HB3 ASN 661 -15.702 -2.403 -8.633 491 HD21 ASN 661 HD21 ASN 661 -17.736 -0.719 -9.981 492 HD22 ASN 661 HD22 ASN 661 -18.004 -1.459 -11.545 493 H ILE 662 H ILE 662 -17.395 -4.215 -5.910 494 HA ILE 662 HA ILE 662 -14.813 -3.808 -4.649 495 HB ILE 662 HB ILE 662 -17.542 -4.590 -3.597 496 HG12 ILE 662 HG12 ILE 662 -16.216 -1.907 -3.187 497 HG13 ILE 662 HG13 ILE 662 -17.012 -2.249 -4.699 498 HG21 ILE 662 HG21 ILE 662 -14.993 -3.868 -2.096 499 HG22 ILE 662 HG22 ILE 662 -16.573 -3.735 -1.341 500 HG23 ILE 662 HG23 ILE 662 -16.031 -5.304 -1.912 501 HD11 ILE 662 HD11 ILE 662 -18.423 -2.402 -2.037 502 HD12 ILE 662 HD12 ILE 662 -18.562 -1.108 -3.240 503 HD13 ILE 662 HD13 ILE 662 -19.132 -2.740 -3.617 504 H GLU 663 H GLU 663 -16.807 -6.567 -5.563 505 HA GLU 663 HA GLU 663 -15.392 -8.495 -3.881 506 HB2 GLU 663 HB2 GLU 663 -17.137 -8.881 -6.347 507 HB3 GLU 663 HB3 GLU 663 -16.511 -10.205 -5.373 508 HG2 GLU 663 HG2 GLU 663 -18.064 -7.987 -4.013 509 HG3 GLU 663 HG3 GLU 663 -18.929 -9.172 -4.946 510 H LYS 664 H LYS 664 -15.241 -7.706 -7.382 511 HA LYS 664 HA LYS 664 -12.930 -9.364 -7.784 512 HB2 LYS 664 HB2 LYS 664 -12.767 -8.478 -10.012 513 HB3 LYS 664 HB3 LYS 664 -14.446 -8.825 -9.611 514 HG2 LYS 664 HG2 LYS 664 -14.617 -6.313 -9.019 515 HG3 LYS 664 HG3 LYS 664 -13.074 -6.118 -9.838 516 HD2 LYS 664 HD2 LYS 664 -14.833 -5.521 -11.358 517 HD3 LYS 664 HD3 LYS 664 -14.150 -7.051 -11.928 518 HE2 LYS 664 HE2 LYS 664 -16.118 -8.162 -11.637 519 HE3 LYS 664 HE3 LYS 664 -16.310 -7.517 -10.019 520 HZ1 LYS 664 HZ1 LYS 664 -17.152 -5.418 -11.134 521 HZ2 LYS 664 HZ2 LYS 664 -18.112 -6.773 -11.191 522 HZ3 LYS 664 HZ3 LYS 664 -17.242 -6.296 -12.517 523 H LEU 665 H LEU 665 -13.230 -5.888 -6.918 524 HA LEU 665 HA LEU 665 -10.454 -5.275 -7.124 525 HB2 LEU 665 HB2 LEU 665 -12.659 -4.175 -5.330 526 HB3 LEU 665 HB3 LEU 665 -11.008 -3.672 -5.128 527 HG LEU 665 HG LEU 665 -12.175 -3.583 -7.936 528 HD11 LEU 665 HD11 LEU 665 -12.631 -1.417 -5.859 529 HD12 LEU 665 HD12 LEU 665 -13.861 -2.371 -6.649 530 HD13 LEU 665 HD13 LEU 665 -12.900 -1.244 -7.606 531 HD21 LEU 665 HD21 LEU 665 -10.131 -1.821 -6.510 532 HD22 LEU 665 HD22 LEU 665 -10.562 -1.772 -8.234 533 HD23 LEU 665 HD23 LEU 665 -9.740 -3.186 -7.570 534 H LEU 666 H LEU 666 -12.332 -6.276 -4.179 535 HA LEU 666 HA LEU 666 -10.049 -6.289 -2.515 536 HB2 LEU 666 HB2 LEU 666 -12.689 -7.766 -2.411 537 HB3 LEU 666 HB3 LEU 666 -11.523 -7.837 -1.107 538 HG LEU 666 HG LEU 666 -11.920 -5.697 -0.393 539 HD11 LEU 666 HD11 LEU 666 -12.975 -4.535 -2.900 540 HD12 LEU 666 HD12 LEU 666 -11.356 -4.364 -2.243 541 HD13 LEU 666 HD13 LEU 666 -12.744 -3.776 -1.334 542 HD21 LEU 666 HD21 LEU 666 -14.488 -6.694 -1.495 543 HD22 LEU 666 HD22 LEU 666 -14.331 -5.407 -0.259 544 HD23 LEU 666 HD23 LEU 666 -13.742 -7.041 0.059 545 H THR 667 H THR 667 -11.459 -8.865 -4.531 546 HA THR 667 HA THR 667 -9.697 -11.001 -3.902 547 HB THR 667 HB THR 667 -10.965 -10.268 -6.585 548 HG1 THR 667 HG1 THR 667 -12.596 -10.471 -5.166 549 HG21 THR 667 HG21 THR 667 -10.846 -12.693 -7.052 550 HG22 THR 667 HG22 THR 667 -9.932 -12.936 -5.545 551 HG23 THR 667 HG23 THR 667 -9.237 -11.983 -6.876 552 H ASP 668 H ASP 668 -9.388 -8.489 -6.559 553 HA ASP 668 HA ASP 668 -6.860 -9.289 -7.508 554 HB2 ASP 668 HB2 ASP 668 -8.391 -7.502 -8.505 555 HB3 ASP 668 HB3 ASP 668 -7.792 -6.396 -7.273 556 H MET 669 H MET 669 -7.758 -6.980 -4.951 557 HA MET 669 HA MET 669 -5.149 -6.053 -4.573 558 HB2 MET 669 HB2 MET 669 -7.557 -6.031 -2.714 559 HB3 MET 669 HB3 MET 669 -6.154 -4.995 -2.492 560 HG2 MET 669 HG2 MET 669 -7.635 -4.980 -5.144 561 HG3 MET 669 HG3 MET 669 -8.329 -4.142 -3.781 562 HE1 MET 669 HE1 MET 669 -7.566 -1.760 -3.117 563 HE2 MET 669 HE2 MET 669 -6.271 -2.743 -2.388 564 HE3 MET 669 HE3 MET 669 -5.854 -1.267 -3.298 565 H ARG 670 H ARG 670 -6.891 -8.626 -2.845 566 HA ARG 670 HA ARG 670 -4.788 -9.457 -1.090 567 HB2 ARG 670 HB2 ARG 670 -6.673 -10.356 -0.360 568 HB3 ARG 670 HB3 ARG 670 -7.472 -10.276 -1.857 569 HG2 ARG 670 HG2 ARG 670 -6.185 -12.525 -0.564 570 HG3 ARG 670 HG3 ARG 670 -7.738 -12.331 -1.396 571 HD2 ARG 670 HD2 ARG 670 -6.888 -13.896 -2.694 572 HD3 ARG 670 HD3 ARG 670 -6.303 -12.502 -3.560 573 HE ARG 670 HE ARG 670 -4.114 -12.848 -2.595 574 HH11 ARG 670 HH11 ARG 670 -6.358 -15.292 -1.228 575 HH12 ARG 670 HH12 ARG 670 -5.089 -16.399 -0.854 576 HH21 ARG 670 HH21 ARG 670 -2.476 -14.288 -2.050 577 HH22 ARG 670 HH22 ARG 670 -2.831 -15.777 -1.243 578 H LYS 671 H LYS 671 -5.556 -10.164 -4.327 579 HA LYS 671 HA LYS 671 -3.706 -12.406 -4.652 580 HB2 LYS 671 HB2 LYS 671 -5.814 -12.225 -5.879 581 HB3 LYS 671 HB3 LYS 671 -5.245 -10.780 -6.712 582 HG2 LYS 671 HG2 LYS 671 -3.558 -12.045 -7.907 583 HG3 LYS 671 HG3 LYS 671 -3.941 -13.510 -6.967 584 HD2 LYS 671 HD2 LYS 671 -6.212 -13.572 -7.896 585 HD3 LYS 671 HD3 LYS 671 -5.974 -12.010 -8.684 586 HE2 LYS 671 HE2 LYS 671 -5.822 -13.804 -10.308 587 HE3 LYS 671 HE3 LYS 671 -4.289 -12.931 -10.170 588 HZ1 LYS 671 HZ1 LYS 671 -3.958 -15.312 -10.247 589 HZ2 LYS 671 HZ2 LYS 671 -4.890 -15.534 -8.908 590 HZ3 LYS 671 HZ3 LYS 671 -3.461 -14.721 -8.794 591 H SER 672 H SER 672 -3.643 -9.015 -5.606 592 HA SER 672 HA SER 672 -1.053 -9.016 -6.852 593 HB2 SER 672 HB2 SER 672 -3.019 -6.837 -5.998 594 HB3 SER 672 HB3 SER 672 -1.554 -6.556 -6.960 595 HG SER 672 HG SER 672 -3.943 -7.181 -7.950 596 H GLY 673 H GLY 673 -2.276 -8.464 -3.513 597 HA2 GLY 673 HA2 GLY 673 -0.759 -9.153 -1.796 598 HA3 GLY 673 HA3 GLY 673 0.606 -8.507 -2.714 599 H ILE 674 H ILE 674 -2.180 -6.555 -2.732 600 HA ILE 674 HA ILE 674 -1.101 -4.317 -1.275 601 HB ILE 674 HB ILE 674 -4.023 -4.878 -1.712 602 HG12 ILE 674 HG12 ILE 674 -2.997 -5.466 -3.895 603 HG13 ILE 674 HG13 ILE 674 -4.260 -4.272 -3.815 604 HG21 ILE 674 HG21 ILE 674 -2.362 -2.331 -1.773 605 HG22 ILE 674 HG22 ILE 674 -4.112 -2.405 -2.032 606 HG23 ILE 674 HG23 ILE 674 -3.430 -2.880 -0.470 607 HD11 ILE 674 HD11 ILE 674 -1.379 -3.625 -4.192 608 HD12 ILE 674 HD12 ILE 674 -2.627 -3.788 -5.466 609 HD13 ILE 674 HD13 ILE 674 -2.787 -2.498 -4.254 610 H ILE 675 H ILE 675 -3.417 -6.959 -0.763 611 HA ILE 675 HA ILE 675 -3.363 -6.683 2.176 612 HB ILE 675 HB ILE 675 -5.775 -6.862 2.288 613 HG12 ILE 675 HG12 ILE 675 -5.763 -6.798 -0.730 614 HG13 ILE 675 HG13 ILE 675 -6.192 -8.190 0.280 615 HG21 ILE 675 HG21 ILE 675 -6.263 -4.639 1.879 616 HG22 ILE 675 HG22 ILE 675 -4.519 -4.562 1.794 617 HG23 ILE 675 HG23 ILE 675 -5.443 -4.611 0.302 618 HD11 ILE 675 HD11 ILE 675 -8.114 -6.886 1.167 619 HD12 ILE 675 HD12 ILE 675 -7.728 -5.603 -0.024 620 HD13 ILE 675 HD13 ILE 675 -8.194 -7.207 -0.576 621 H TYR 676 H TYR 676 -4.756 -8.909 2.830 622 HA TYR 676 HA TYR 676 -4.390 -11.021 0.815 623 HB2 TYR 676 HB2 TYR 676 -3.410 -12.483 2.731 624 HB3 TYR 676 HB3 TYR 676 -2.353 -11.389 1.836 625 HD1 TYR 676 HD1 TYR 676 -4.161 -11.816 5.077 626 HD2 TYR 676 HD2 TYR 676 -1.163 -9.622 2.872 627 HE1 TYR 676 HE1 TYR 676 -3.540 -10.586 7.142 628 HE2 TYR 676 HE2 TYR 676 -0.559 -8.406 4.921 629 HH TYR 676 HH TYR 676 -1.857 -7.604 6.891 630 H GLU 677 H GLU 677 -5.621 -12.988 1.492 631 HA GLU 677 HA GLU 677 -8.036 -12.343 2.977 632 HB2 GLU 677 HB2 GLU 677 -6.961 -14.781 1.550 633 HB3 GLU 677 HB3 GLU 677 -8.222 -15.000 2.767 634 HG2 GLU 677 HG2 GLU 677 -9.842 -14.002 1.614 635 HG3 GLU 677 HG3 GLU 677 -8.785 -12.779 0.943 636 H ALA 678 H ALA 678 -8.429 -13.249 5.081 637 HA ALA 678 HA ALA 678 -6.199 -14.753 6.393 638 HB1 ALA 678 HB1 ALA 678 -7.045 -13.827 8.534 639 HB2 ALA 678 HB2 ALA 678 -6.465 -12.547 7.440 640 HB3 ALA 678 HB3 ALA 678 -8.211 -12.832 7.638 641 H LYS 679 H LYS 679 -9.732 -14.363 5.885 642 HA LYS 679 HA LYS 679 -10.146 -17.189 6.369 643 HB2 LYS 679 HB2 LYS 679 -11.819 -15.212 7.997 644 HB3 LYS 679 HB3 LYS 679 -11.905 -16.939 8.056 645 HG2 LYS 679 HG2 LYS 679 -9.686 -17.062 9.116 646 HG3 LYS 679 HG3 LYS 679 -9.558 -15.291 9.047 647 HD2 LYS 679 HD2 LYS 679 -11.607 -15.093 10.444 648 HD3 LYS 679 HD3 LYS 679 -11.636 -16.867 10.612 649 HE2 LYS 679 HE2 LYS 679 -9.377 -16.809 11.632 650 HE3 LYS 679 HE3 LYS 679 -9.301 -15.058 11.384 651 HZ1 LYS 679 HZ1 LYS 679 -11.117 -14.768 12.930 652 HZ2 LYS 679 HZ2 LYS 679 -9.892 -15.406 13.611 653 HZ3 LYS 679 HZ3 LYS 679 -11.177 -16.420 13.230 654 HA PRO 680 HA PRO 680 -13.186 -16.240 3.162 655 HB2 PRO 680 HB2 PRO 680 -15.608 -17.280 4.146 656 HB3 PRO 680 HB3 PRO 680 -14.361 -18.173 3.225 657 HG2 PRO 680 HG2 PRO 680 -14.743 -18.032 6.221 658 HG3 PRO 680 HG3 PRO 680 -14.368 -19.467 5.212 659 HD2 PRO 680 HD2 PRO 680 -12.416 -18.232 6.585 660 HD3 PRO 680 HD3 PRO 680 -12.095 -18.754 4.918 661 H GLU 681 H GLU 681 -14.207 -14.451 2.702 662 HA GLU 681 HA GLU 681 -14.865 -12.360 2.802 663 HB2 GLU 681 HB2 GLU 681 -16.874 -11.772 3.721 664 HB3 GLU 681 HB3 GLU 681 -17.028 -13.467 3.330 665 HG2 GLU 681 HG2 GLU 681 -17.188 -14.104 5.578 666 HG3 GLU 681 HG3 GLU 681 -16.330 -12.692 6.181 667 H CYS 682 H CYS 682 -12.516 -13.110 4.599 668 HA CYS 682 HA CYS 682 -12.535 -10.668 6.324 669 HB2 CYS 682 HB2 CYS 682 -13.160 -12.448 7.715 670 HB3 CYS 682 HB3 CYS 682 -12.143 -13.576 6.858 671 H TYR 683 H TYR 683 -11.079 -9.401 5.315 672 HA TYR 683 HA TYR 683 -8.550 -10.614 4.267 673 HB2 TYR 683 HB2 TYR 683 -10.213 -8.299 3.162 674 HB3 TYR 683 HB3 TYR 683 -8.582 -8.667 2.672 675 HD1 TYR 683 HD2 TYR 683 -11.508 -11.117 3.073 676 HD2 TYR 683 HD1 TYR 683 -8.757 -9.152 0.395 677 HE1 TYR 683 HE2 TYR 683 -12.270 -12.552 1.249 678 HE2 TYR 683 HE1 TYR 683 -9.621 -10.549 -1.460 679 HH TYR 683 HH TYR 683 -10.829 -13.364 -1.138 680 H LYS 684 H LYS 684 -6.597 -9.272 4.626 681 HA LYS 684 HA LYS 684 -7.067 -6.896 6.350 682 HB2 LYS 684 HB2 LYS 684 -6.526 -9.112 7.740 683 HB3 LYS 684 HB3 LYS 684 -4.885 -8.781 7.185 684 HG2 LYS 684 HG2 LYS 684 -5.559 -6.303 8.090 685 HG3 LYS 684 HG3 LYS 684 -6.613 -7.244 9.094 686 HD2 LYS 684 HD2 LYS 684 -4.579 -8.605 9.840 687 HD3 LYS 684 HD3 LYS 684 -3.598 -7.446 8.931 688 HE2 LYS 684 HE2 LYS 684 -3.526 -6.538 11.075 689 HE3 LYS 684 HE3 LYS 684 -4.792 -5.602 10.293 690 HZ1 LYS 684 HZ1 LYS 684 -5.926 -6.199 12.193 691 HZ2 LYS 684 HZ2 LYS 684 -5.004 -7.534 12.448 692 HZ3 LYS 684 HZ3 LYS 684 -6.212 -7.604 11.373 693 H LYS 685 H LYS 685 -5.380 -5.369 6.291 694 HA LYS 685 HA LYS 685 -4.138 -5.177 3.755 695 HB2 LYS 685 HB2 LYS 685 -4.798 -3.495 5.992 696 HB3 LYS 685 HB3 LYS 685 -3.082 -3.294 5.721 697 HG2 LYS 685 HG2 LYS 685 -5.182 -3.099 3.516 698 HG3 LYS 685 HG3 LYS 685 -4.715 -1.714 4.467 699 HD2 LYS 685 HD2 LYS 685 -2.487 -3.259 3.151 700 HD3 LYS 685 HD3 LYS 685 -3.542 -2.335 2.120 701 HE2 LYS 685 HE2 LYS 685 -1.566 -1.095 2.704 702 HE3 LYS 685 HE3 LYS 685 -3.028 -0.278 3.313 703 HZ1 LYS 685 HZ1 LYS 685 -1.137 -0.381 4.899 704 HZ2 LYS 685 HZ2 LYS 685 -1.317 -2.018 4.979 705 HZ3 LYS 685 HZ3 LYS 685 -2.554 -0.951 5.477 706 H VAL 686 H VAL 686 -1.920 -5.140 3.131 707 HA VAL 686 HA VAL 686 -0.004 -6.462 4.917 708 HB VAL 686 HB VAL 686 -0.274 -6.574 2.242 709 HG11 VAL 686 HG11 VAL 686 0.130 -4.092 1.977 710 HG12 VAL 686 HG12 VAL 686 1.792 -4.367 2.527 711 HG13 VAL 686 HG13 VAL 686 1.209 -5.141 1.037 712 HG21 VAL 686 HG21 VAL 686 1.285 -7.937 3.501 713 HG22 VAL 686 HG22 VAL 686 2.075 -7.252 2.074 714 HG23 VAL 686 HG23 VAL 686 2.392 -6.556 3.682 Start of MODEL 17 1 H1 GLY 600 H1 GLY 600 -2.862 6.247 5.088 2 H2 GLY 600 H2 GLY 600 -2.479 7.846 5.111 3 H3 GLY 600 H3 GLY 600 -3.919 7.315 4.444 4 HA2 GLY 600 HA2 GLY 600 -2.841 6.235 2.678 5 HA3 GLY 600 HA3 GLY 600 -2.251 7.911 2.753 6 H SER 601 H SER 601 -0.013 8.221 2.931 7 HA SER 601 HA SER 601 1.861 6.246 3.848 8 HB2 SER 601 HB2 SER 601 3.152 8.469 4.191 9 HB3 SER 601 HB3 SER 601 2.708 8.018 2.536 10 HG SER 601 HG SER 601 2.214 10.200 3.017 11 H HIS 602 H HIS 602 3.071 7.083 6.073 12 HA HIS 602 HA HIS 602 0.939 7.372 8.100 13 HB2 HIS 602 HB2 HIS 602 2.961 5.380 8.814 14 HB3 HIS 602 HB3 HIS 602 1.222 5.337 8.990 15 HD1 HIS 602 HD1 HIS 602 0.094 4.868 6.145 16 HD2 HIS 602 HD2 HIS 602 3.872 3.468 7.408 17 HE1 HIS 602 HE1 HIS 602 0.758 3.040 4.539 18 H MET 603 H MET 603 2.013 7.478 10.339 19 HA MET 603 HA MET 603 3.601 9.882 10.235 20 HB2 MET 603 HB2 MET 603 1.659 9.423 11.752 21 HB3 MET 603 HB3 MET 603 2.667 8.295 12.669 22 HG2 MET 603 HG2 MET 603 3.283 11.241 12.274 23 HG3 MET 603 HG3 MET 603 2.352 10.595 13.618 24 HE1 MET 603 HE1 MET 603 5.716 11.149 12.016 25 HE2 MET 603 HE2 MET 603 5.325 12.297 13.313 26 HE3 MET 603 HE3 MET 603 6.725 11.200 13.481 27 H GLY 604 H GLY 604 4.182 6.707 11.897 28 HA2 GLY 604 HA2 GLY 604 6.758 7.475 12.801 29 HA3 GLY 604 HA3 GLY 604 6.100 5.833 12.801 30 H GLU 605 H GLU 605 5.735 5.813 9.798 31 HA GLU 605 HA GLU 605 8.266 6.343 8.608 32 HB2 GLU 605 HB2 GLU 605 8.752 4.055 7.896 33 HB3 GLU 605 HB3 GLU 605 8.778 4.150 9.654 34 HG2 GLU 605 HG2 GLU 605 6.422 3.197 9.676 35 HG3 GLU 605 HG3 GLU 605 6.541 2.990 7.927 36 H SER 606 H SER 606 8.031 6.013 6.181 37 HA SER 606 HA SER 606 5.268 5.783 5.205 38 HB2 SER 606 HB2 SER 606 6.670 5.945 2.987 39 HB3 SER 606 HB3 SER 606 6.345 7.399 3.939 40 HG SER 606 HG SER 606 8.580 7.002 3.204 41 H GLY 607 H GLY 607 4.543 3.671 5.081 42 HA2 GLY 607 HA2 GLY 607 6.283 1.381 4.881 43 HA3 GLY 607 HA3 GLY 607 4.535 1.454 4.558 44 H LYS 608 H LYS 608 6.035 -0.061 2.833 45 HA LYS 608 HA LYS 608 7.279 1.420 0.796 46 HB2 LYS 608 HB2 LYS 608 7.123 -1.269 1.523 47 HB3 LYS 608 HB3 LYS 608 6.373 -1.272 -0.058 48 HG2 LYS 608 HG2 LYS 608 9.157 -0.175 0.610 49 HG3 LYS 608 HG3 LYS 608 8.799 -1.764 -0.043 50 HD2 LYS 608 HD2 LYS 608 9.434 -0.677 -1.952 51 HD3 LYS 608 HD3 LYS 608 7.686 -0.506 -2.033 52 HE2 LYS 608 HE2 LYS 608 8.566 1.757 -0.575 53 HE3 LYS 608 HE3 LYS 608 9.836 1.522 -1.773 54 HZ1 LYS 608 HZ1 LYS 608 8.024 2.977 -2.532 55 HZ2 LYS 608 HZ2 LYS 608 6.950 1.742 -2.333 56 HZ3 LYS 608 HZ3 LYS 608 8.127 1.635 -3.489 57 H ILE 609 H ILE 609 4.098 1.736 1.242 58 HA ILE 609 HA ILE 609 3.531 2.138 -1.612 59 HB ILE 609 HB ILE 609 1.518 0.894 0.311 60 HG12 ILE 609 HG12 ILE 609 1.524 -0.862 -1.693 61 HG13 ILE 609 HG13 ILE 609 3.162 -0.282 -1.959 62 HG21 ILE 609 HG21 ILE 609 0.040 0.879 -1.686 63 HG22 ILE 609 HG22 ILE 609 0.504 2.521 -1.250 64 HG23 ILE 609 HG23 ILE 609 1.295 1.721 -2.621 65 HD11 ILE 609 HD11 ILE 609 3.041 -2.342 -0.575 66 HD12 ILE 609 HD12 ILE 609 3.766 -1.029 0.352 67 HD13 ILE 609 HD13 ILE 609 2.074 -1.480 0.638 68 H ASP 610 H ASP 610 3.267 4.185 -1.824 69 HA ASP 610 HA ASP 610 2.009 5.920 0.237 70 HB2 ASP 610 HB2 ASP 610 3.983 6.692 -1.951 71 HB3 ASP 610 HB3 ASP 610 3.230 7.777 -0.786 72 H ILE 611 H ILE 611 1.078 7.885 -1.145 73 HA ILE 611 HA ILE 611 -0.798 6.873 -3.152 74 HB ILE 611 HB ILE 611 -0.108 9.698 -2.171 75 HG12 ILE 611 HG12 ILE 611 -2.506 9.592 -1.273 76 HG13 ILE 611 HG13 ILE 611 -2.447 7.847 -1.504 77 HG21 ILE 611 HG21 ILE 611 -2.171 10.393 -3.359 78 HG22 ILE 611 HG22 ILE 611 -0.939 9.788 -4.457 79 HG23 ILE 611 HG23 ILE 611 -2.315 8.740 -4.018 80 HD11 ILE 611 HD11 ILE 611 -0.754 7.645 0.231 81 HD12 ILE 611 HD12 ILE 611 -0.474 9.408 0.233 82 HD13 ILE 611 HD13 ILE 611 -2.002 8.739 0.832 83 H ASP 612 H ASP 612 2.045 8.939 -2.928 84 HA ASP 612 HA ASP 612 2.142 9.840 -5.500 85 HB2 ASP 612 HB2 ASP 612 4.367 9.483 -3.472 86 HB3 ASP 612 HB3 ASP 612 4.408 10.579 -4.874 87 H THR 613 H THR 613 3.947 7.137 -4.085 88 HA THR 613 HA THR 613 5.512 6.451 -6.343 89 HB THR 613 HB THR 613 5.870 5.725 -3.962 90 HG1 THR 613 HG1 THR 613 5.898 3.936 -6.125 91 HG21 THR 613 HG21 THR 613 3.536 4.885 -3.546 92 HG22 THR 613 HG22 THR 613 4.849 3.796 -3.046 93 HG23 THR 613 HG23 THR 613 3.934 3.463 -4.529 94 H ILE 614 H ILE 614 2.155 6.111 -5.991 95 HA ILE 614 HA ILE 614 1.967 3.861 -7.949 96 HB ILE 614 HB ILE 614 -0.094 5.143 -6.090 97 HG12 ILE 614 HG12 ILE 614 1.544 3.948 -4.789 98 HG13 ILE 614 HG13 ILE 614 0.014 3.096 -4.769 99 HG21 ILE 614 HG21 ILE 614 -1.563 3.247 -6.665 100 HG22 ILE 614 HG22 ILE 614 -1.241 4.303 -8.044 101 HG23 ILE 614 HG23 ILE 614 -0.404 2.746 -7.914 102 HD11 ILE 614 HD11 ILE 614 2.471 2.410 -6.428 103 HD12 ILE 614 HD12 ILE 614 1.858 1.548 -5.007 104 HD13 ILE 614 HD13 ILE 614 0.915 1.545 -6.520 105 H MET 615 H MET 615 0.520 6.968 -7.164 106 HA MET 615 HA MET 615 -0.782 7.222 -9.717 107 HB2 MET 615 HB2 MET 615 -1.513 9.391 -8.975 108 HB3 MET 615 HB3 MET 615 -1.520 8.303 -7.587 109 HG2 MET 615 HG2 MET 615 -0.554 10.139 -6.625 110 HG3 MET 615 HG3 MET 615 0.892 9.291 -7.159 111 HE1 MET 615 HE1 MET 615 2.606 11.255 -7.243 112 HE2 MET 615 HE2 MET 615 2.126 12.909 -7.667 113 HE3 MET 615 HE3 MET 615 1.353 12.090 -6.293 114 H THR 616 H THR 616 2.524 8.031 -8.731 115 HA THR 616 HA THR 616 3.039 9.793 -10.847 116 HB THR 616 HB THR 616 4.501 9.423 -8.878 117 HG1 THR 616 HG1 THR 616 5.254 10.333 -10.930 118 HG21 THR 616 HG21 THR 616 4.497 6.881 -8.915 119 HG22 THR 616 HG22 THR 616 6.102 7.618 -8.773 120 HG23 THR 616 HG23 THR 616 5.567 6.957 -10.328 121 H GLY 617 H GLY 617 2.586 6.310 -10.892 122 HA2 GLY 617 HA2 GLY 617 3.484 6.181 -13.752 123 HA3 GLY 617 HA3 GLY 617 3.784 4.912 -12.570 124 H LYS 618 H LYS 618 0.752 5.866 -11.701 125 HA LYS 618 HA LYS 618 -0.638 4.235 -13.772 126 HB2 LYS 618 HB2 LYS 618 -0.757 4.110 -10.731 127 HB3 LYS 618 HB3 LYS 618 -2.096 3.555 -11.710 128 HG2 LYS 618 HG2 LYS 618 -0.589 1.978 -12.918 129 HG3 LYS 618 HG3 LYS 618 0.785 2.545 -11.952 130 HD2 LYS 618 HD2 LYS 618 -0.290 1.723 -9.900 131 HD3 LYS 618 HD3 LYS 618 -1.694 1.162 -10.840 132 HE2 LYS 618 HE2 LYS 618 -0.216 -0.352 -12.132 133 HE3 LYS 618 HE3 LYS 618 1.190 0.236 -11.234 134 HZ1 LYS 618 HZ1 LYS 618 -1.099 -1.218 -10.056 135 HZ2 LYS 618 HZ2 LYS 618 0.216 -0.671 -9.226 136 HZ3 LYS 618 HZ3 LYS 618 0.386 -1.849 -10.359 137 HA PRO 619 HA PRO 619 -3.340 7.667 -14.140 138 HB2 PRO 619 HB2 PRO 619 -5.814 6.511 -14.565 139 HB3 PRO 619 HB3 PRO 619 -4.509 6.594 -15.794 140 HG2 PRO 619 HG2 PRO 619 -5.189 4.287 -13.936 141 HG3 PRO 619 HG3 PRO 619 -4.873 4.223 -15.700 142 HD2 PRO 619 HD2 PRO 619 -2.944 3.619 -13.912 143 HD3 PRO 619 HD3 PRO 619 -2.543 4.564 -15.377 144 H LYS 620 H LYS 620 -4.316 8.982 -12.687 145 HA LYS 620 HA LYS 620 -4.046 8.279 -10.102 146 HB2 LYS 620 HB2 LYS 620 -4.792 10.425 -9.471 147 HB3 LYS 620 HB3 LYS 620 -3.981 10.543 -11.012 148 HG2 LYS 620 HG2 LYS 620 -5.732 11.972 -11.315 149 HG3 LYS 620 HG3 LYS 620 -6.387 10.521 -12.073 150 HD2 LYS 620 HD2 LYS 620 -7.845 10.115 -10.180 151 HD3 LYS 620 HD3 LYS 620 -6.905 11.217 -9.161 152 HE2 LYS 620 HE2 LYS 620 -7.614 13.128 -10.560 153 HE3 LYS 620 HE3 LYS 620 -8.608 12.045 -11.551 154 HZ1 LYS 620 HZ1 LYS 620 -8.936 12.325 -8.621 155 HZ2 LYS 620 HZ2 LYS 620 -9.971 11.606 -9.662 156 HZ3 LYS 620 HZ3 LYS 620 -9.788 13.246 -9.707 157 H SER 621 H SER 621 -7.037 7.780 -11.835 158 HA SER 621 HA SER 621 -8.923 7.392 -9.761 159 HB2 SER 621 HB2 SER 621 -9.518 7.324 -12.105 160 HB3 SER 621 HB3 SER 621 -8.476 5.922 -12.399 161 HG SER 621 HG SER 621 -10.928 5.762 -11.975 162 H ALA 622 H ALA 622 -6.148 5.341 -10.747 163 HA ALA 622 HA ALA 622 -6.747 2.938 -9.378 164 HB1 ALA 622 HB1 ALA 622 -4.307 2.617 -9.354 165 HB2 ALA 622 HB2 ALA 622 -4.862 3.177 -10.946 166 HB3 ALA 622 HB3 ALA 622 -4.059 4.308 -9.837 167 H ARG 623 H ARG 623 -4.738 5.717 -8.210 168 HA ARG 623 HA ARG 623 -4.870 4.920 -5.475 169 HB2 ARG 623 HB2 ARG 623 -3.550 6.783 -5.142 170 HB3 ARG 623 HB3 ARG 623 -3.511 6.913 -6.890 171 HG2 ARG 623 HG2 ARG 623 -5.687 8.378 -6.533 172 HG3 ARG 623 HG3 ARG 623 -5.114 8.520 -4.885 173 HD2 ARG 623 HD2 ARG 623 -3.177 9.764 -5.780 174 HD3 ARG 623 HD3 ARG 623 -3.678 9.343 -7.440 175 HE ARG 623 HE ARG 623 -5.914 10.462 -6.173 176 HH11 ARG 623 HH11 ARG 623 -2.739 11.776 -7.020 177 HH12 ARG 623 HH12 ARG 623 -3.345 13.350 -7.403 178 HH21 ARG 623 HH21 ARG 623 -6.767 12.372 -6.842 179 HH22 ARG 623 HH22 ARG 623 -5.729 13.745 -7.159 180 H GLU 624 H GLU 624 -6.976 7.041 -7.425 181 HA GLU 624 HA GLU 624 -8.393 8.094 -5.330 182 HB2 GLU 624 HB2 GLU 624 -8.300 8.423 -8.069 183 HB3 GLU 624 HB3 GLU 624 -9.927 7.775 -7.864 184 HG2 GLU 624 HG2 GLU 624 -10.055 10.123 -7.912 185 HG3 GLU 624 HG3 GLU 624 -10.317 9.632 -6.252 186 H LYS 625 H LYS 625 -8.833 4.952 -6.654 187 HA LYS 625 HA LYS 625 -10.980 4.597 -4.549 188 HB2 LYS 625 HB2 LYS 625 -11.752 2.572 -5.620 189 HB3 LYS 625 HB3 LYS 625 -11.865 3.990 -6.655 190 HG2 LYS 625 HG2 LYS 625 -9.495 3.090 -7.545 191 HG3 LYS 625 HG3 LYS 625 -10.089 1.561 -6.914 192 HD2 LYS 625 HD2 LYS 625 -12.046 1.643 -8.338 193 HD3 LYS 625 HD3 LYS 625 -11.742 3.319 -8.804 194 HE2 LYS 625 HE2 LYS 625 -9.812 1.060 -9.414 195 HE3 LYS 625 HE3 LYS 625 -11.100 1.565 -10.527 196 HZ1 LYS 625 HZ1 LYS 625 -9.070 3.438 -9.485 197 HZ2 LYS 625 HZ2 LYS 625 -10.114 3.738 -10.677 198 HZ3 LYS 625 HZ3 LYS 625 -8.912 2.636 -10.933 199 H MET 626 H MET 626 -7.776 3.258 -5.594 200 HA MET 626 HA MET 626 -7.820 1.073 -3.777 201 HB2 MET 626 HB2 MET 626 -5.513 2.675 -4.968 202 HB3 MET 626 HB3 MET 626 -5.298 1.237 -3.971 203 HG2 MET 626 HG2 MET 626 -6.659 -0.054 -5.532 204 HG3 MET 626 HG3 MET 626 -6.808 1.288 -6.617 205 HE1 MET 626 HE1 MET 626 -4.055 -1.950 -7.255 206 HE2 MET 626 HE2 MET 626 -4.958 -1.854 -5.735 207 HE3 MET 626 HE3 MET 626 -5.812 -1.678 -7.278 208 H MET 627 H MET 627 -6.684 4.443 -3.461 209 HA MET 627 HA MET 627 -5.457 4.131 -0.938 210 HB2 MET 627 HB2 MET 627 -4.966 6.385 -1.105 211 HB3 MET 627 HB3 MET 627 -5.126 5.906 -2.781 212 HG2 MET 627 HG2 MET 627 -6.325 7.819 -2.890 213 HG3 MET 627 HG3 MET 627 -7.640 6.756 -2.437 214 HE1 MET 627 HE1 MET 627 -5.337 9.678 -1.582 215 HE2 MET 627 HE2 MET 627 -5.598 9.979 0.150 216 HE3 MET 627 HE3 MET 627 -4.689 8.546 -0.371 217 H LYS 628 H LYS 628 -8.693 4.496 -1.881 218 HA LYS 628 HA LYS 628 -9.695 5.322 0.791 219 HB2 LYS 628 HB2 LYS 628 -11.343 4.268 -1.564 220 HB3 LYS 628 HB3 LYS 628 -11.933 4.890 -0.028 221 HG2 LYS 628 HG2 LYS 628 -10.650 7.091 -0.693 222 HG3 LYS 628 HG3 LYS 628 -10.672 6.397 -2.327 223 HD2 LYS 628 HD2 LYS 628 -13.216 6.112 -2.034 224 HD3 LYS 628 HD3 LYS 628 -13.051 6.989 -0.510 225 HE2 LYS 628 HE2 LYS 628 -13.673 8.691 -1.940 226 HE3 LYS 628 HE3 LYS 628 -11.911 8.855 -1.921 227 HZ1 LYS 628 HZ1 LYS 628 -12.780 8.962 -4.155 228 HZ2 LYS 628 HZ2 LYS 628 -13.510 7.495 -4.007 229 HZ3 LYS 628 HZ3 LYS 628 -11.867 7.602 -4.024 230 H ILE 629 H ILE 629 -9.902 2.450 -1.371 231 HA ILE 629 HA ILE 629 -11.180 0.706 0.354 232 HB ILE 629 HB ILE 629 -9.130 0.165 -1.813 233 HG12 ILE 629 HG12 ILE 629 -12.134 -0.357 -1.853 234 HG13 ILE 629 HG13 ILE 629 -11.495 1.226 -2.257 235 HG21 ILE 629 HG21 ILE 629 -9.963 -2.203 -1.816 236 HG22 ILE 629 HG22 ILE 629 -9.100 -1.806 -0.341 237 HG23 ILE 629 HG23 ILE 629 -10.875 -1.863 -0.331 238 HD11 ILE 629 HD11 ILE 629 -11.846 -0.019 -4.284 239 HD12 ILE 629 HD12 ILE 629 -10.104 0.236 -4.064 240 HD13 ILE 629 HD13 ILE 629 -10.823 -1.352 -3.717 241 H ILE 630 H ILE 630 -7.623 0.995 -0.027 242 HA ILE 630 HA ILE 630 -6.970 -0.925 1.945 243 HB ILE 630 HB ILE 630 -4.726 0.118 1.956 244 HG12 ILE 630 HG12 ILE 630 -4.782 1.893 -0.243 245 HG13 ILE 630 HG13 ILE 630 -6.114 2.428 0.778 246 HG21 ILE 630 HG21 ILE 630 -5.466 -1.572 0.264 247 HG22 ILE 630 HG22 ILE 630 -5.848 -0.238 -0.834 248 HG23 ILE 630 HG23 ILE 630 -4.176 -0.496 -0.315 249 HD11 ILE 630 HD11 ILE 630 -3.214 2.120 1.567 250 HD12 ILE 630 HD12 ILE 630 -4.168 3.618 1.417 251 HD13 ILE 630 HD13 ILE 630 -4.529 2.455 2.720 252 H GLU 631 H GLU 631 -8.004 2.502 2.461 253 HA GLU 631 HA GLU 631 -6.928 2.501 5.138 254 HB2 GLU 631 HB2 GLU 631 -8.174 4.539 3.246 255 HB3 GLU 631 HB3 GLU 631 -7.942 4.814 4.949 256 HG2 GLU 631 HG2 GLU 631 -5.472 4.035 4.573 257 HG3 GLU 631 HG3 GLU 631 -5.842 4.235 2.866 258 H ILE 632 H ILE 632 -9.937 1.828 3.357 259 HA ILE 632 HA ILE 632 -11.626 1.965 5.730 260 HB ILE 632 HB ILE 632 -12.101 -0.051 3.529 261 HG12 ILE 632 HG12 ILE 632 -11.823 1.807 2.133 262 HG13 ILE 632 HG13 ILE 632 -13.531 1.525 2.290 263 HG21 ILE 632 HG21 ILE 632 -13.508 -0.083 5.553 264 HG22 ILE 632 HG22 ILE 632 -13.995 1.587 5.268 265 HG23 ILE 632 HG23 ILE 632 -14.452 0.310 4.117 266 HD11 ILE 632 HD11 ILE 632 -13.025 3.908 2.286 267 HD12 ILE 632 HD12 ILE 632 -13.721 3.442 3.852 268 HD13 ILE 632 HD13 ILE 632 -11.969 3.732 3.696 269 H ILE 633 H ILE 633 -9.524 -0.461 4.136 270 HA ILE 633 HA ILE 633 -10.133 -2.633 5.893 271 HB ILE 633 HB ILE 633 -7.538 -2.161 4.339 272 HG12 ILE 633 HG12 ILE 633 -10.206 -3.423 3.626 273 HG13 ILE 633 HG13 ILE 633 -9.425 -2.083 2.849 274 HG21 ILE 633 HG21 ILE 633 -7.164 -4.537 4.525 275 HG22 ILE 633 HG22 ILE 633 -7.355 -3.880 6.146 276 HG23 ILE 633 HG23 ILE 633 -8.696 -4.767 5.393 277 HD11 ILE 633 HD11 ILE 633 -8.451 -4.929 2.659 278 HD12 ILE 633 HD12 ILE 633 -9.269 -3.972 1.413 279 HD13 ILE 633 HD13 ILE 633 -7.670 -3.463 1.974 280 H ASP 634 H ASP 634 -7.499 -0.126 5.938 281 HA ASP 634 HA ASP 634 -6.351 -1.105 8.302 282 HB2 ASP 634 HB2 ASP 634 -5.305 0.475 6.643 283 HB3 ASP 634 HB3 ASP 634 -6.323 1.767 7.298 284 H SER 635 H SER 635 -8.941 1.315 7.737 285 HA SER 635 HA SER 635 -9.153 2.163 10.403 286 HB2 SER 635 HB2 SER 635 -11.348 2.055 8.285 287 HB3 SER 635 HB3 SER 635 -11.404 2.996 9.787 288 HG SER 635 HG SER 635 -9.661 3.286 7.555 289 H LEU 636 H LEU 636 -11.010 -0.361 8.631 290 HA LEU 636 HA LEU 636 -12.636 -1.138 10.865 291 HB2 LEU 636 HB2 LEU 636 -11.786 -2.516 8.307 292 HB3 LEU 636 HB3 LEU 636 -12.905 -3.269 9.445 293 HG LEU 636 HG LEU 636 -13.434 -0.559 8.140 294 HD11 LEU 636 HD11 LEU 636 -14.313 -3.351 7.301 295 HD12 LEU 636 HD12 LEU 636 -13.227 -2.267 6.406 296 HD13 LEU 636 HD13 LEU 636 -14.934 -1.833 6.611 297 HD21 LEU 636 HD21 LEU 636 -14.745 -0.950 10.195 298 HD22 LEU 636 HD22 LEU 636 -15.272 -2.531 9.573 299 HD23 LEU 636 HD23 LEU 636 -15.781 -1.034 8.766 300 H ALA 637 H ALA 637 -9.437 -2.212 9.682 301 HA ALA 637 HA ALA 637 -9.342 -4.399 11.619 302 HB1 ALA 637 HB1 ALA 637 -8.643 -4.586 9.208 303 HB2 ALA 637 HB2 ALA 637 -7.243 -3.557 9.619 304 HB3 ALA 637 HB3 ALA 637 -7.478 -5.135 10.419 305 H VAL 638 H VAL 638 -8.795 -1.181 12.115 306 HA VAL 638 HA VAL 638 -6.263 -1.208 13.397 307 HB VAL 638 HB VAL 638 -7.708 0.770 12.644 308 HG11 VAL 638 HG11 VAL 638 -8.907 0.606 15.434 309 HG12 VAL 638 HG12 VAL 638 -9.249 1.783 14.151 310 HG13 VAL 638 HG13 VAL 638 -9.773 0.104 13.971 311 HG21 VAL 638 HG21 VAL 638 -6.737 2.277 14.294 312 HG22 VAL 638 HG22 VAL 638 -6.392 0.909 15.375 313 HG23 VAL 638 HG23 VAL 638 -5.577 1.035 13.799 314 H SER 639 H SER 639 -9.443 -2.248 14.466 315 HA SER 639 HA SER 639 -8.472 -2.954 17.179 316 HB2 SER 639 HB2 SER 639 -10.917 -2.526 17.752 317 HB3 SER 639 HB3 SER 639 -9.967 -1.105 17.283 318 HG SER 639 HG SER 639 -12.009 -1.196 16.222 319 H SER 640 H SER 640 -8.632 -4.532 14.510 320 HA SER 640 HA SER 640 -9.959 -6.947 15.530 321 HB2 SER 640 HB2 SER 640 -11.697 -5.914 14.168 322 HB3 SER 640 HB3 SER 640 -10.544 -5.537 12.889 323 HG SER 640 HG SER 640 -11.199 -7.307 12.053 324 H GLU 641 H GLU 641 -9.185 -8.822 14.147 325 HA GLU 641 HA GLU 641 -6.358 -8.706 13.493 326 HB2 GLU 641 HB2 GLU 641 -8.521 -10.679 12.625 327 HB3 GLU 641 HB3 GLU 641 -6.785 -10.860 12.354 328 HG2 GLU 641 HG2 GLU 641 -6.492 -10.753 14.895 329 HG3 GLU 641 HG3 GLU 641 -8.256 -10.918 15.017 330 H CYS 642 H CYS 642 -9.429 -8.382 11.714 331 HA CYS 642 HA CYS 642 -8.143 -7.351 9.283 332 HB2 CYS 642 HB2 CYS 642 -9.048 -9.266 7.976 333 HB3 CYS 642 HB3 CYS 642 -7.813 -9.735 9.113 334 H ALA 643 H ALA 643 -9.886 -7.101 7.567 335 HA ALA 643 HA ALA 643 -12.314 -5.833 8.737 336 HB1 ALA 643 HB1 ALA 643 -10.632 -4.355 7.646 337 HB2 ALA 643 HB2 ALA 643 -10.768 -5.314 6.158 338 HB3 ALA 643 HB3 ALA 643 -12.164 -4.397 6.733 339 H LYS 644 H LYS 644 -14.234 -6.834 8.245 340 HA LYS 644 HA LYS 644 -14.420 -9.101 6.464 341 HB2 LYS 644 HB2 LYS 644 -16.675 -7.380 7.567 342 HB3 LYS 644 HB3 LYS 644 -16.828 -8.967 6.871 343 HG2 LYS 644 HG2 LYS 644 -16.664 -9.844 8.927 344 HG3 LYS 644 HG3 LYS 644 -14.952 -9.419 8.891 345 HD2 LYS 644 HD2 LYS 644 -15.762 -8.385 10.852 346 HD3 LYS 644 HD3 LYS 644 -15.691 -7.069 9.660 347 HE2 LYS 644 HE2 LYS 644 -18.159 -7.630 9.148 348 HE3 LYS 644 HE3 LYS 644 -18.150 -8.609 10.629 349 HZ1 LYS 644 HZ1 LYS 644 -18.941 -6.307 10.901 350 HZ2 LYS 644 HZ2 LYS 644 -17.529 -5.738 10.364 351 HZ3 LYS 644 HZ3 LYS 644 -17.561 -6.543 11.820 352 H VAL 645 H VAL 645 -14.916 -9.141 4.319 353 HA VAL 645 HA VAL 645 -14.996 -6.692 2.782 354 HB VAL 645 HB VAL 645 -14.153 -8.606 1.706 355 HG11 VAL 645 HG11 VAL 645 -15.492 -10.526 0.976 356 HG12 VAL 645 HG12 VAL 645 -15.460 -10.419 2.735 357 HG13 VAL 645 HG13 VAL 645 -16.907 -9.902 1.868 358 HG21 VAL 645 HG21 VAL 645 -16.774 -8.115 0.279 359 HG22 VAL 645 HG22 VAL 645 -15.512 -6.890 0.357 360 HG23 VAL 645 HG23 VAL 645 -15.189 -8.464 -0.417 361 H LYS 646 H LYS 646 -17.544 -8.502 4.442 362 HA LYS 646 HA LYS 646 -19.792 -7.368 3.150 363 HB2 LYS 646 HB2 LYS 646 -19.731 -9.184 4.875 364 HB3 LYS 646 HB3 LYS 646 -19.326 -7.981 6.110 365 HG2 LYS 646 HG2 LYS 646 -21.496 -6.842 5.686 366 HG3 LYS 646 HG3 LYS 646 -21.873 -8.036 4.423 367 HD2 LYS 646 HD2 LYS 646 -21.679 -9.857 6.144 368 HD3 LYS 646 HD3 LYS 646 -21.433 -8.631 7.392 369 HE2 LYS 646 HE2 LYS 646 -23.890 -8.907 5.599 370 HE3 LYS 646 HE3 LYS 646 -23.781 -9.461 7.276 371 HZ1 LYS 646 HZ1 LYS 646 -24.852 -7.317 7.118 372 HZ2 LYS 646 HZ2 LYS 646 -23.528 -6.659 6.392 373 HZ3 LYS 646 HZ3 LYS 646 -23.437 -7.177 7.949 374 H ASP 647 H ASP 647 -17.514 -6.019 5.626 375 HA ASP 647 HA ASP 647 -19.236 -3.788 6.138 376 HB2 ASP 647 HB2 ASP 647 -16.303 -4.249 6.776 377 HB3 ASP 647 HB3 ASP 647 -17.235 -2.858 7.329 378 H ILE 648 H ILE 648 -16.365 -4.525 4.211 379 HA ILE 648 HA ILE 648 -15.861 -1.851 3.286 380 HB ILE 648 HB ILE 648 -15.076 -4.461 1.899 381 HG12 ILE 648 HG12 ILE 648 -13.492 -2.987 4.054 382 HG13 ILE 648 HG13 ILE 648 -14.366 -4.462 4.323 383 HG21 ILE 648 HG21 ILE 648 -14.740 -2.366 0.567 384 HG22 ILE 648 HG22 ILE 648 -13.744 -1.708 1.880 385 HG23 ILE 648 HG23 ILE 648 -13.213 -3.134 0.962 386 HD11 ILE 648 HD11 ILE 648 -12.984 -5.646 2.616 387 HD12 ILE 648 HD12 ILE 648 -11.979 -4.188 2.497 388 HD13 ILE 648 HD13 ILE 648 -12.087 -5.067 4.030 389 H LEU 649 H LEU 649 -17.703 -4.602 1.925 390 HA LEU 649 HA LEU 649 -18.550 -3.385 -0.466 391 HB2 LEU 649 HB2 LEU 649 -19.685 -5.522 1.337 392 HB3 LEU 649 HB3 LEU 649 -20.650 -4.926 -0.005 393 HG LEU 649 HG LEU 649 -17.798 -5.884 -0.446 394 HD11 LEU 649 HD11 LEU 649 -18.754 -8.061 -1.150 395 HD12 LEU 649 HD12 LEU 649 -20.372 -7.531 -0.644 396 HD13 LEU 649 HD13 LEU 649 -19.091 -7.754 0.564 397 HD21 LEU 649 HD21 LEU 649 -20.203 -5.752 -2.318 398 HD22 LEU 649 HD22 LEU 649 -18.538 -6.192 -2.751 399 HD23 LEU 649 HD23 LEU 649 -18.919 -4.538 -2.251 400 H LYS 650 H LYS 650 -19.989 -3.245 2.841 401 HA LYS 650 HA LYS 650 -22.138 -1.499 1.986 402 HB2 LYS 650 HB2 LYS 650 -22.589 -2.375 4.060 403 HB3 LYS 650 HB3 LYS 650 -20.941 -2.183 4.666 404 HG2 LYS 650 HG2 LYS 650 -21.184 0.062 5.128 405 HG3 LYS 650 HG3 LYS 650 -22.557 0.293 4.025 406 HD2 LYS 650 HD2 LYS 650 -24.094 -0.654 5.513 407 HD3 LYS 650 HD3 LYS 650 -22.837 -1.376 6.525 408 HE2 LYS 650 HE2 LYS 650 -24.070 0.761 7.367 409 HE3 LYS 650 HE3 LYS 650 -22.325 0.599 7.600 410 HZ1 LYS 650 HZ1 LYS 650 -23.435 2.158 5.329 411 HZ2 LYS 650 HZ2 LYS 650 -21.873 2.084 5.896 412 HZ3 LYS 650 HZ3 LYS 650 -23.021 2.798 6.794 413 H GLU 651 H GLU 651 -18.939 -0.679 3.512 414 HA GLU 651 HA GLU 651 -19.559 2.085 3.432 415 HB2 GLU 651 HB2 GLU 651 -16.932 0.629 3.791 416 HB3 GLU 651 HB3 GLU 651 -17.086 2.388 3.889 417 HG2 GLU 651 HG2 GLU 651 -18.567 0.384 5.653 418 HG3 GLU 651 HG3 GLU 651 -17.186 1.365 6.128 419 H ALA 652 H ALA 652 -17.816 0.072 1.088 420 HA ALA 652 HA ALA 652 -17.164 2.349 -0.600 421 HB1 ALA 652 HB1 ALA 652 -15.737 0.467 -0.631 422 HB2 ALA 652 HB2 ALA 652 -17.065 -0.599 -1.123 423 HB3 ALA 652 HB3 ALA 652 -16.484 0.673 -2.228 424 H GLN 653 H GLN 653 -20.044 0.154 -0.457 425 HA GLN 653 HA GLN 653 -21.202 1.330 -2.847 426 HB2 GLN 653 HB2 GLN 653 -22.440 -0.041 -0.445 427 HB3 GLN 653 HB3 GLN 653 -23.381 0.621 -1.768 428 HG2 GLN 653 HG2 GLN 653 -21.176 -1.157 -2.677 429 HG3 GLN 653 HG3 GLN 653 -22.320 -1.957 -1.616 430 HE21 GLN 653 HE21 GLN 653 -24.814 -0.929 -2.356 431 HE22 GLN 653 HE22 GLN 653 -25.081 -1.354 -4.042 432 H GLN 654 H GLN 654 -20.876 2.416 0.545 433 HA GLN 654 HA GLN 654 -22.505 4.799 0.003 434 HB2 GLN 654 HB2 GLN 654 -20.384 4.938 2.090 435 HB3 GLN 654 HB3 GLN 654 -21.969 5.670 2.045 436 HG2 GLN 654 HG2 GLN 654 -21.334 2.780 2.681 437 HG3 GLN 654 HG3 GLN 654 -21.697 4.028 3.829 438 HE21 GLN 654 HE21 GLN 654 -23.534 3.324 0.766 439 HE22 GLN 654 HE22 GLN 654 -24.997 2.887 1.640 440 H VAL 655 H VAL 655 -18.894 4.200 -0.113 441 HA VAL 655 HA VAL 655 -18.409 6.916 -0.813 442 HB VAL 655 HB VAL 655 -16.208 6.477 -1.204 443 HG11 VAL 655 HG11 VAL 655 -16.690 4.173 0.643 444 HG12 VAL 655 HG12 VAL 655 -15.373 5.339 0.620 445 HG13 VAL 655 HG13 VAL 655 -16.990 5.858 1.126 446 HG21 VAL 655 HG21 VAL 655 -16.824 3.712 -2.128 447 HG22 VAL 655 HG22 VAL 655 -16.008 5.034 -2.953 448 HG23 VAL 655 HG23 VAL 655 -15.196 4.205 -1.618 449 H GLY 656 H GLY 656 -19.432 4.276 -2.838 450 HA2 GLY 656 HA2 GLY 656 -20.953 5.141 -4.597 451 HA3 GLY 656 HA3 GLY 656 -19.676 6.255 -5.093 452 H ILE 657 H ILE 657 -19.341 2.762 -4.221 453 HA ILE 657 HA ILE 657 -18.429 2.203 -6.997 454 HB ILE 657 HB ILE 657 -17.345 1.084 -4.383 455 HG12 ILE 657 HG12 ILE 657 -16.020 3.124 -6.243 456 HG13 ILE 657 HG13 ILE 657 -16.736 3.515 -4.681 457 HG21 ILE 657 HG21 ILE 657 -17.141 -0.406 -6.409 458 HG22 ILE 657 HG22 ILE 657 -16.196 0.862 -7.201 459 HG23 ILE 657 HG23 ILE 657 -15.608 0.050 -5.722 460 HD11 ILE 657 HD11 ILE 657 -14.402 3.356 -4.353 461 HD12 ILE 657 HD12 ILE 657 -15.158 1.963 -3.558 462 HD13 ILE 657 HD13 ILE 657 -14.316 1.757 -5.115 463 H GLU 658 H GLU 658 -18.824 -0.135 -7.610 464 HA GLU 658 HA GLU 658 -21.476 -0.922 -6.567 465 HB2 GLU 658 HB2 GLU 658 -21.219 -0.424 -8.925 466 HB3 GLU 658 HB3 GLU 658 -19.869 -1.541 -9.060 467 HG2 GLU 658 HG2 GLU 658 -22.641 -2.487 -8.267 468 HG3 GLU 658 HG3 GLU 658 -22.254 -2.143 -9.960 469 H LYS 659 H LYS 659 -21.763 -2.893 -5.714 470 HA LYS 659 HA LYS 659 -20.264 -4.439 -4.275 471 HB2 LYS 659 HB2 LYS 659 -21.750 -6.241 -6.094 472 HB3 LYS 659 HB3 LYS 659 -21.797 -6.125 -4.368 473 HG2 LYS 659 HG2 LYS 659 -23.528 -4.539 -4.382 474 HG3 LYS 659 HG3 LYS 659 -23.220 -4.009 -6.041 475 HD2 LYS 659 HD2 LYS 659 -24.210 -6.801 -5.410 476 HD3 LYS 659 HD3 LYS 659 -25.270 -5.420 -5.771 477 HE2 LYS 659 HE2 LYS 659 -24.099 -5.063 -7.936 478 HE3 LYS 659 HE3 LYS 659 -23.043 -6.419 -7.615 479 HZ1 LYS 659 HZ1 LYS 659 -25.962 -6.598 -7.958 480 HZ2 LYS 659 HZ2 LYS 659 -24.957 -7.872 -7.645 481 HZ3 LYS 659 HZ3 LYS 659 -24.813 -7.035 -9.053 482 H SER 660 H SER 660 -20.332 -5.098 -7.843 483 HA SER 660 HA SER 660 -18.568 -7.368 -7.384 484 HB2 SER 660 HB2 SER 660 -20.327 -7.508 -9.065 485 HB3 SER 660 HB3 SER 660 -19.518 -6.268 -10.036 486 HG SER 660 HG SER 660 -18.033 -8.608 -9.164 487 H ASN 661 H ASN 661 -18.401 -4.056 -8.576 488 HA ASN 661 HA ASN 661 -15.668 -4.004 -9.334 489 HB2 ASN 661 HB2 ASN 661 -17.349 -1.769 -8.239 490 HB3 ASN 661 HB3 ASN 661 -15.643 -1.690 -8.592 491 HD21 ASN 661 HD21 ASN 661 -18.756 -2.886 -10.259 492 HD22 ASN 661 HD22 ASN 661 -18.231 -2.252 -11.805 493 H ILE 662 H ILE 662 -17.141 -3.696 -6.093 494 HA ILE 662 HA ILE 662 -14.684 -2.933 -4.759 495 HB ILE 662 HB ILE 662 -17.290 -4.157 -3.778 496 HG12 ILE 662 HG12 ILE 662 -16.313 -1.334 -3.303 497 HG13 ILE 662 HG13 ILE 662 -17.113 -1.757 -4.792 498 HG21 ILE 662 HG21 ILE 662 -14.927 -3.134 -2.157 499 HG22 ILE 662 HG22 ILE 662 -16.548 -3.387 -1.480 500 HG23 ILE 662 HG23 ILE 662 -15.650 -4.759 -2.122 501 HD11 ILE 662 HD11 ILE 662 -19.125 -2.504 -3.644 502 HD12 ILE 662 HD12 ILE 662 -18.412 -2.052 -2.089 503 HD13 ILE 662 HD13 ILE 662 -18.738 -0.811 -3.305 504 H GLU 663 H GLU 663 -16.331 -5.933 -5.499 505 HA GLU 663 HA GLU 663 -14.431 -7.523 -3.882 506 HB2 GLU 663 HB2 GLU 663 -15.662 -9.532 -4.618 507 HB3 GLU 663 HB3 GLU 663 -16.683 -8.246 -3.949 508 HG2 GLU 663 HG2 GLU 663 -17.966 -8.888 -5.650 509 HG3 GLU 663 HG3 GLU 663 -17.064 -7.531 -6.237 510 H LYS 664 H LYS 664 -14.759 -6.887 -7.422 511 HA LYS 664 HA LYS 664 -12.458 -8.511 -7.963 512 HB2 LYS 664 HB2 LYS 664 -12.402 -7.615 -10.183 513 HB3 LYS 664 HB3 LYS 664 -14.036 -8.038 -9.697 514 HG2 LYS 664 HG2 LYS 664 -14.501 -6.074 -10.707 515 HG3 LYS 664 HG3 LYS 664 -14.195 -5.488 -9.080 516 HD2 LYS 664 HD2 LYS 664 -11.882 -4.844 -9.750 517 HD3 LYS 664 HD3 LYS 664 -12.255 -5.347 -11.407 518 HE2 LYS 664 HE2 LYS 664 -13.739 -3.228 -9.802 519 HE3 LYS 664 HE3 LYS 664 -12.472 -2.876 -10.980 520 HZ1 LYS 664 HZ1 LYS 664 -14.815 -2.692 -11.777 521 HZ2 LYS 664 HZ2 LYS 664 -14.935 -4.326 -11.693 522 HZ3 LYS 664 HZ3 LYS 664 -13.837 -3.650 -12.720 523 H LEU 665 H LEU 665 -12.783 -5.076 -6.975 524 HA LEU 665 HA LEU 665 -9.978 -4.497 -7.376 525 HB2 LEU 665 HB2 LEU 665 -12.119 -3.223 -5.641 526 HB3 LEU 665 HB3 LEU 665 -10.449 -2.660 -5.638 527 HG LEU 665 HG LEU 665 -12.018 -2.875 -8.231 528 HD11 LEU 665 HD11 LEU 665 -13.231 -1.381 -6.608 529 HD12 LEU 665 HD12 LEU 665 -12.663 -0.578 -8.073 530 HD13 LEU 665 HD13 LEU 665 -11.779 -0.361 -6.543 531 HD21 LEU 665 HD21 LEU 665 -10.408 -1.196 -9.029 532 HD22 LEU 665 HD22 LEU 665 -9.568 -2.641 -8.466 533 HD23 LEU 665 HD23 LEU 665 -9.600 -1.195 -7.443 534 H LEU 666 H LEU 666 -11.835 -5.540 -4.429 535 HA LEU 666 HA LEU 666 -9.573 -5.909 -2.756 536 HB2 LEU 666 HB2 LEU 666 -12.237 -7.352 -2.963 537 HB3 LEU 666 HB3 LEU 666 -11.051 -7.792 -1.742 538 HG LEU 666 HG LEU 666 -12.072 -4.928 -2.002 539 HD11 LEU 666 HD11 LEU 666 -13.129 -7.149 -0.232 540 HD12 LEU 666 HD12 LEU 666 -13.976 -6.441 -1.630 541 HD13 LEU 666 HD13 LEU 666 -13.639 -5.441 -0.206 542 HD21 LEU 666 HD21 LEU 666 -11.348 -4.804 0.357 543 HD22 LEU 666 HD22 LEU 666 -9.981 -5.271 -0.661 544 HD23 LEU 666 HD23 LEU 666 -10.822 -6.497 0.316 545 H THR 667 H THR 667 -10.990 -8.101 -5.204 546 HA THR 667 HA THR 667 -9.192 -10.230 -4.776 547 HB THR 667 HB THR 667 -10.656 -9.474 -7.318 548 HG1 THR 667 HG1 THR 667 -12.073 -9.886 -5.719 549 HG21 THR 667 HG21 THR 667 -8.836 -11.019 -7.881 550 HG22 THR 667 HG22 THR 667 -10.377 -11.879 -7.908 551 HG23 THR 667 HG23 THR 667 -9.270 -12.083 -6.531 552 H ASP 668 H ASP 668 -8.835 -7.378 -7.022 553 HA ASP 668 HA ASP 668 -6.324 -8.143 -8.108 554 HB2 ASP 668 HB2 ASP 668 -7.476 -6.389 -9.145 555 HB3 ASP 668 HB3 ASP 668 -7.767 -5.530 -7.643 556 H MET 669 H MET 669 -7.167 -6.303 -5.168 557 HA MET 669 HA MET 669 -4.523 -5.848 -4.297 558 HB2 MET 669 HB2 MET 669 -7.037 -6.143 -2.599 559 HB3 MET 669 HB3 MET 669 -5.502 -5.455 -2.073 560 HG2 MET 669 HG2 MET 669 -5.920 -3.948 -4.270 561 HG3 MET 669 HG3 MET 669 -7.581 -4.300 -3.843 562 HE1 MET 669 HE1 MET 669 -5.494 -1.439 -3.647 563 HE2 MET 669 HE2 MET 669 -7.202 -1.686 -4.096 564 HE3 MET 669 HE3 MET 669 -6.783 -0.640 -2.719 565 H ARG 670 H ARG 670 -6.729 -8.496 -3.147 566 HA ARG 670 HA ARG 670 -4.649 -9.670 -1.540 567 HB2 ARG 670 HB2 ARG 670 -6.189 -11.547 -1.158 568 HB3 ARG 670 HB3 ARG 670 -6.972 -10.007 -0.922 569 HG2 ARG 670 HG2 ARG 670 -8.540 -10.425 -2.414 570 HG3 ARG 670 HG3 ARG 670 -7.365 -10.763 -3.669 571 HD2 ARG 670 HD2 ARG 670 -7.229 -13.098 -2.997 572 HD3 ARG 670 HD3 ARG 670 -8.353 -12.786 -1.663 573 HE ARG 670 HE ARG 670 -9.095 -12.227 -4.498 574 HH11 ARG 670 HH11 ARG 670 -9.930 -14.113 -1.539 575 HH12 ARG 670 HH12 ARG 670 -11.582 -14.154 -1.923 576 HH21 ARG 670 HH21 ARG 670 -11.381 -12.162 -4.881 577 HH22 ARG 670 HH22 ARG 670 -12.374 -13.239 -3.965 578 H LYS 671 H LYS 671 -5.615 -10.178 -4.918 579 HA LYS 671 HA LYS 671 -4.063 -12.581 -5.142 580 HB2 LYS 671 HB2 LYS 671 -6.057 -11.947 -6.571 581 HB3 LYS 671 HB3 LYS 671 -5.060 -10.696 -7.328 582 HG2 LYS 671 HG2 LYS 671 -5.164 -12.584 -8.775 583 HG3 LYS 671 HG3 LYS 671 -3.518 -12.506 -8.129 584 HD2 LYS 671 HD2 LYS 671 -4.115 -14.320 -6.487 585 HD3 LYS 671 HD3 LYS 671 -5.766 -14.324 -7.128 586 HE2 LYS 671 HE2 LYS 671 -4.613 -16.144 -8.146 587 HE3 LYS 671 HE3 LYS 671 -4.858 -14.899 -9.380 588 HZ1 LYS 671 HZ1 LYS 671 -2.347 -15.360 -7.878 589 HZ2 LYS 671 HZ2 LYS 671 -2.566 -14.195 -9.010 590 HZ3 LYS 671 HZ3 LYS 671 -2.611 -15.783 -9.447 591 H SER 672 H SER 672 -3.415 -9.108 -5.716 592 HA SER 672 HA SER 672 -0.748 -9.582 -6.780 593 HB2 SER 672 HB2 SER 672 -1.921 -7.039 -5.591 594 HB3 SER 672 HB3 SER 672 -0.518 -7.178 -6.670 595 HG SER 672 HG SER 672 -3.278 -7.519 -7.181 596 H GLY 673 H GLY 673 -2.154 -9.076 -3.552 597 HA2 GLY 673 HA2 GLY 673 -1.044 -9.903 -1.602 598 HA3 GLY 673 HA3 GLY 673 0.525 -9.542 -2.327 599 H ILE 674 H ILE 674 -1.891 -7.094 -2.800 600 HA ILE 674 HA ILE 674 -0.511 -5.084 -1.217 601 HB ILE 674 HB ILE 674 -3.338 -5.162 -2.363 602 HG12 ILE 674 HG12 ILE 674 -0.778 -3.993 -3.497 603 HG13 ILE 674 HG13 ILE 674 -1.708 -5.345 -4.135 604 HG21 ILE 674 HG21 ILE 674 -1.804 -2.724 -1.384 605 HG22 ILE 674 HG22 ILE 674 -3.449 -2.749 -2.069 606 HG23 ILE 674 HG23 ILE 674 -3.153 -3.496 -0.523 607 HD11 ILE 674 HD11 ILE 674 -2.536 -2.429 -4.158 608 HD12 ILE 674 HD12 ILE 674 -2.146 -3.473 -5.530 609 HD13 ILE 674 HD13 ILE 674 -3.617 -3.775 -4.591 610 H ILE 675 H ILE 675 -3.249 -7.276 -0.805 611 HA ILE 675 HA ILE 675 -3.179 -6.955 2.111 612 HB ILE 675 HB ILE 675 -5.628 -7.125 2.246 613 HG12 ILE 675 HG12 ILE 675 -5.564 -7.242 -0.759 614 HG13 ILE 675 HG13 ILE 675 -6.137 -8.451 0.379 615 HG21 ILE 675 HG21 ILE 675 -4.690 -4.787 0.540 616 HG22 ILE 675 HG22 ILE 675 -6.263 -4.887 1.298 617 HG23 ILE 675 HG23 ILE 675 -4.866 -4.898 2.313 618 HD11 ILE 675 HD11 ILE 675 -7.482 -5.818 -0.289 619 HD12 ILE 675 HD12 ILE 675 -8.055 -7.458 -0.612 620 HD13 ILE 675 HD13 ILE 675 -7.972 -6.865 1.062 621 H TYR 676 H TYR 676 -4.475 -8.964 2.971 622 HA TYR 676 HA TYR 676 -4.518 -11.279 1.139 623 HB2 TYR 676 HB2 TYR 676 -3.674 -12.646 3.188 624 HB3 TYR 676 HB3 TYR 676 -2.486 -11.764 2.231 625 HD1 TYR 676 HD2 TYR 676 -4.462 -11.594 5.440 626 HD2 TYR 676 HD1 TYR 676 -1.115 -10.089 3.153 627 HE1 TYR 676 HE2 TYR 676 -3.771 -10.197 7.361 628 HE2 TYR 676 HE1 TYR 676 -0.432 -8.705 5.069 629 HH TYR 676 HH TYR 676 -1.541 -7.574 6.921 630 H GLU 677 H GLU 677 -5.953 -12.944 2.079 631 HA GLU 677 HA GLU 677 -8.153 -11.874 3.724 632 HB2 GLU 677 HB2 GLU 677 -7.629 -14.425 2.156 633 HB3 GLU 677 HB3 GLU 677 -8.840 -14.444 3.466 634 HG2 GLU 677 HG2 GLU 677 -10.080 -12.715 2.571 635 HG3 GLU 677 HG3 GLU 677 -8.773 -12.266 1.444 636 H ALA 678 H ALA 678 -6.521 -14.921 3.871 637 HA ALA 678 HA ALA 678 -5.851 -16.227 5.379 638 HB1 ALA 678 HB1 ALA 678 -4.156 -14.455 5.948 639 HB2 ALA 678 HB2 ALA 678 -5.262 -13.819 7.173 640 HB3 ALA 678 HB3 ALA 678 -4.588 -15.443 7.373 641 H LYS 679 H LYS 679 -8.328 -13.958 6.404 642 HA LYS 679 HA LYS 679 -9.410 -16.021 8.283 643 HB2 LYS 679 HB2 LYS 679 -9.324 -12.993 8.377 644 HB3 LYS 679 HB3 LYS 679 -10.588 -13.869 9.222 645 HG2 LYS 679 HG2 LYS 679 -8.852 -13.283 10.756 646 HG3 LYS 679 HG3 LYS 679 -8.966 -15.036 10.616 647 HD2 LYS 679 HD2 LYS 679 -6.906 -15.192 9.451 648 HD3 LYS 679 HD3 LYS 679 -6.924 -13.475 9.004 649 HE2 LYS 679 HE2 LYS 679 -5.235 -13.988 10.729 650 HE3 LYS 679 HE3 LYS 679 -6.437 -12.806 11.263 651 HZ1 LYS 679 HZ1 LYS 679 -6.037 -14.341 12.991 652 HZ2 LYS 679 HZ2 LYS 679 -6.489 -15.667 12.047 653 HZ3 LYS 679 HZ3 LYS 679 -7.517 -14.424 12.557 654 HA PRO 680 HA PRO 680 -12.785 -16.440 5.611 655 HB2 PRO 680 HB2 PRO 680 -15.023 -16.633 7.235 656 HB3 PRO 680 HB3 PRO 680 -13.789 -17.914 7.036 657 HG2 PRO 680 HG2 PRO 680 -13.976 -15.828 9.227 658 HG3 PRO 680 HG3 PRO 680 -13.690 -17.591 9.395 659 HD2 PRO 680 HD2 PRO 680 -11.640 -15.837 9.463 660 HD3 PRO 680 HD3 PRO 680 -11.461 -17.391 8.596 661 H GLU 681 H GLU 681 -13.457 -14.946 4.269 662 HA GLU 681 HA GLU 681 -14.074 -13.090 3.295 663 HB2 GLU 681 HB2 GLU 681 -16.171 -12.308 3.590 664 HB3 GLU 681 HB3 GLU 681 -16.290 -13.895 4.278 665 HG2 GLU 681 HG2 GLU 681 -16.859 -13.112 6.334 666 HG3 GLU 681 HG3 GLU 681 -15.676 -11.820 6.327 667 H CYS 682 H CYS 682 -11.985 -12.849 5.610 668 HA CYS 682 HA CYS 682 -12.433 -9.972 6.253 669 HB2 CYS 682 HB2 CYS 682 -13.181 -11.602 7.924 670 HB3 CYS 682 HB3 CYS 682 -11.555 -12.243 8.035 671 H TYR 683 H TYR 683 -10.825 -8.698 5.612 672 HA TYR 683 HA TYR 683 -8.344 -9.983 4.630 673 HB2 TYR 683 HB2 TYR 683 -9.860 -7.461 3.792 674 HB3 TYR 683 HB3 TYR 683 -8.365 -8.017 3.067 675 HD1 TYR 683 HD2 TYR 683 -11.927 -9.186 3.685 676 HD2 TYR 683 HD1 TYR 683 -8.457 -9.314 1.113 677 HE1 TYR 683 HE2 TYR 683 -13.118 -10.684 2.136 678 HE2 TYR 683 HE1 TYR 683 -9.730 -10.694 -0.508 679 HH TYR 683 HH TYR 683 -11.792 -12.620 0.186 680 H LYS 684 H LYS 684 -6.288 -8.777 4.783 681 HA LYS 684 HA LYS 684 -6.461 -6.196 6.129 682 HB2 LYS 684 HB2 LYS 684 -5.915 -8.293 7.861 683 HB3 LYS 684 HB3 LYS 684 -4.299 -7.796 7.377 684 HG2 LYS 684 HG2 LYS 684 -5.521 -5.348 7.884 685 HG3 LYS 684 HG3 LYS 684 -6.328 -6.402 9.013 686 HD2 LYS 684 HD2 LYS 684 -4.008 -7.131 9.849 687 HD3 LYS 684 HD3 LYS 684 -3.350 -5.864 8.805 688 HE2 LYS 684 HE2 LYS 684 -3.520 -4.697 10.814 689 HE3 LYS 684 HE3 LYS 684 -5.049 -4.283 10.038 690 HZ1 LYS 684 HZ1 LYS 684 -5.785 -4.926 12.097 691 HZ2 LYS 684 HZ2 LYS 684 -4.566 -6.009 12.338 692 HZ3 LYS 684 HZ3 LYS 684 -5.812 -6.417 11.368 693 H LYS 685 H LYS 685 -4.538 -4.911 5.927 694 HA LYS 685 HA LYS 685 -3.145 -5.206 3.451 695 HB2 LYS 685 HB2 LYS 685 -2.952 -3.394 5.883 696 HB3 LYS 685 HB3 LYS 685 -1.703 -3.309 4.667 697 HG2 LYS 685 HG2 LYS 685 -4.657 -2.948 4.061 698 HG3 LYS 685 HG3 LYS 685 -3.548 -1.625 4.408 699 HD2 LYS 685 HD2 LYS 685 -3.234 -3.539 2.049 700 HD3 LYS 685 HD3 LYS 685 -3.994 -1.980 2.004 701 HE2 LYS 685 HE2 LYS 685 -1.970 -1.363 1.255 702 HE3 LYS 685 HE3 LYS 685 -1.684 -1.157 2.987 703 HZ1 LYS 685 HZ1 LYS 685 -0.399 -3.164 3.017 704 HZ2 LYS 685 HZ2 LYS 685 0.047 -2.426 1.659 705 HZ3 LYS 685 HZ3 LYS 685 -1.030 -3.683 1.588 706 H VAL 686 H VAL 686 -1.094 -5.676 2.910 707 HA VAL 686 HA VAL 686 0.692 -6.918 4.902 708 HB VAL 686 HB VAL 686 0.402 -7.595 2.349 709 HG11 VAL 686 HG11 VAL 686 2.035 -6.557 0.846 710 HG12 VAL 686 HG12 VAL 686 0.848 -5.357 1.374 711 HG13 VAL 686 HG13 VAL 686 2.479 -5.373 2.081 712 HG21 VAL 686 HG21 VAL 686 2.715 -8.407 2.316 713 HG22 VAL 686 HG22 VAL 686 3.123 -7.320 3.665 714 HG23 VAL 686 HG23 VAL 686 1.962 -8.645 3.902 Start of MODEL 18 1 H1 GLY 600 H1 GLY 600 2.494 5.799 22.048 2 H2 GLY 600 H2 GLY 600 4.095 5.977 22.333 3 H3 GLY 600 H3 GLY 600 3.124 7.318 22.256 4 HA2 GLY 600 HA2 GLY 600 2.680 6.912 19.937 5 HA3 GLY 600 HA3 GLY 600 4.425 7.075 20.242 6 H SER 601 H SER 601 4.173 5.791 17.982 7 HA SER 601 HA SER 601 4.824 3.032 18.513 8 HB2 SER 601 HB2 SER 601 3.172 2.255 16.769 9 HB3 SER 601 HB3 SER 601 2.422 2.807 18.273 10 HG SER 601 HG SER 601 1.404 3.639 16.370 11 H HIS 602 H HIS 602 5.265 2.108 16.031 12 HA HIS 602 HA HIS 602 6.221 4.172 14.237 13 HB2 HIS 602 HB2 HIS 602 8.469 2.997 14.052 14 HB3 HIS 602 HB3 HIS 602 8.222 3.959 15.499 15 HD1 HIS 602 HD1 HIS 602 8.932 2.775 17.669 16 HD2 HIS 602 HD2 HIS 602 7.831 0.129 14.578 17 HE1 HIS 602 HE1 HIS 602 9.314 0.401 18.546 18 H MET 603 H MET 603 6.703 3.189 12.123 19 HA MET 603 HA MET 603 4.981 0.839 11.613 20 HB2 MET 603 HB2 MET 603 6.268 2.814 9.687 21 HB3 MET 603 HB3 MET 603 5.074 1.572 9.282 22 HG2 MET 603 HG2 MET 603 3.472 2.667 10.881 23 HG3 MET 603 HG3 MET 603 4.621 3.993 11.067 24 HE1 MET 603 HE1 MET 603 5.720 4.332 7.967 25 HE2 MET 603 HE2 MET 603 4.604 5.611 7.464 26 HE3 MET 603 HE3 MET 603 5.320 5.657 9.091 27 H GLY 604 H GLY 604 8.187 1.160 12.352 28 HA2 GLY 604 HA2 GLY 604 10.106 -0.049 11.911 29 HA3 GLY 604 HA3 GLY 604 9.069 -1.306 11.216 30 H GLU 605 H GLU 605 9.252 2.041 10.094 31 HA GLU 605 HA GLU 605 9.735 3.063 8.186 32 HB2 GLU 605 HB2 GLU 605 11.969 2.070 8.661 33 HB3 GLU 605 HB3 GLU 605 11.643 0.797 7.502 34 HG2 GLU 605 HG2 GLU 605 11.305 3.661 6.595 35 HG3 GLU 605 HG3 GLU 605 12.931 3.117 6.967 36 H SER 606 H SER 606 8.607 -0.215 7.932 37 HA SER 606 HA SER 606 8.073 -0.798 5.471 38 HB2 SER 606 HB2 SER 606 5.714 -1.135 7.298 39 HB3 SER 606 HB3 SER 606 6.528 -2.315 6.267 40 HG SER 606 HG SER 606 7.139 -1.379 8.866 41 H GLY 607 H GLY 607 6.117 1.678 7.107 42 HA2 GLY 607 HA2 GLY 607 3.907 1.587 5.225 43 HA3 GLY 607 HA3 GLY 607 4.156 2.767 6.515 44 H LYS 608 H LYS 608 5.532 1.805 3.411 45 HA LYS 608 HA LYS 608 6.320 4.628 2.849 46 HB2 LYS 608 HB2 LYS 608 7.938 2.794 3.662 47 HB3 LYS 608 HB3 LYS 608 7.789 2.104 2.047 48 HG2 LYS 608 HG2 LYS 608 8.770 4.157 1.068 49 HG3 LYS 608 HG3 LYS 608 8.654 4.980 2.636 50 HD2 LYS 608 HD2 LYS 608 10.939 4.289 2.363 51 HD3 LYS 608 HD3 LYS 608 10.197 3.270 3.602 52 HE2 LYS 608 HE2 LYS 608 9.729 1.594 1.649 53 HE3 LYS 608 HE3 LYS 608 10.863 2.580 0.713 54 HZ1 LYS 608 HZ1 LYS 608 12.388 2.188 2.767 55 HZ2 LYS 608 HZ2 LYS 608 12.134 0.849 1.769 56 HZ3 LYS 608 HZ3 LYS 608 11.392 1.114 3.246 57 H ILE 609 H ILE 609 4.180 2.419 1.572 58 HA ILE 609 HA ILE 609 4.726 2.923 -1.260 59 HB ILE 609 HB ILE 609 2.155 2.038 0.100 60 HG12 ILE 609 HG12 ILE 609 2.677 -0.141 -1.237 61 HG13 ILE 609 HG13 ILE 609 4.330 0.450 -1.343 62 HG21 ILE 609 HG21 ILE 609 2.867 2.262 -2.853 63 HG22 ILE 609 HG22 ILE 609 1.407 1.460 -2.223 64 HG23 ILE 609 HG23 ILE 609 1.630 3.180 -1.976 65 HD11 ILE 609 HD11 ILE 609 3.899 -1.218 0.479 66 HD12 ILE 609 HD12 ILE 609 4.541 0.298 1.112 67 HD13 ILE 609 HD13 ILE 609 2.801 -0.066 1.257 68 H ASP 610 H ASP 610 4.697 4.971 -1.931 69 HA ASP 610 HA ASP 610 3.352 7.120 -0.618 70 HB2 ASP 610 HB2 ASP 610 4.160 7.289 -3.507 71 HB3 ASP 610 HB3 ASP 610 4.337 8.478 -2.230 72 H ILE 611 H ILE 611 1.879 8.573 -1.925 73 HA ILE 611 HA ILE 611 -0.211 7.126 -3.469 74 HB ILE 611 HB ILE 611 0.075 10.080 -2.743 75 HG12 ILE 611 HG12 ILE 611 -2.105 9.594 -1.445 76 HG13 ILE 611 HG13 ILE 611 -1.716 7.883 -1.589 77 HG21 ILE 611 HG21 ILE 611 -2.197 8.589 -4.121 78 HG22 ILE 611 HG22 ILE 611 -2.256 10.289 -3.590 79 HG23 ILE 611 HG23 ILE 611 -1.138 9.811 -4.863 80 HD11 ILE 611 HD11 ILE 611 0.237 8.180 -0.156 81 HD12 ILE 611 HD12 ILE 611 0.107 9.956 -0.275 82 HD13 ILE 611 HD13 ILE 611 -1.119 9.015 0.597 83 H ASP 612 H ASP 612 2.476 9.399 -3.727 84 HA ASP 612 HA ASP 612 2.252 10.435 -6.224 85 HB2 ASP 612 HB2 ASP 612 4.780 9.702 -4.699 86 HB3 ASP 612 HB3 ASP 612 4.623 10.947 -5.947 87 H THR 613 H THR 613 3.960 7.539 -5.217 88 HA THR 613 HA THR 613 5.171 6.696 -7.590 89 HB THR 613 HB THR 613 5.365 6.044 -5.104 90 HG1 THR 613 HG1 THR 613 6.550 4.402 -5.633 91 HG21 THR 613 HG21 THR 613 4.373 4.067 -4.297 92 HG22 THR 613 HG22 THR 613 3.582 3.733 -5.854 93 HG23 THR 613 HG23 THR 613 3.064 5.115 -4.857 94 H ILE 614 H ILE 614 1.805 6.564 -6.712 95 HA ILE 614 HA ILE 614 1.155 4.590 -8.831 96 HB ILE 614 HB ILE 614 -0.529 5.911 -6.666 97 HG12 ILE 614 HG12 ILE 614 -0.027 2.935 -6.801 98 HG13 ILE 614 HG13 ILE 614 1.274 3.942 -6.204 99 HG21 ILE 614 HG21 ILE 614 -1.972 5.464 -8.565 100 HG22 ILE 614 HG22 ILE 614 -1.350 3.801 -8.697 101 HG23 ILE 614 HG23 ILE 614 -2.308 4.295 -7.287 102 HD11 ILE 614 HD11 ILE 614 0.004 3.208 -4.324 103 HD12 ILE 614 HD12 ILE 614 -0.207 4.956 -4.520 104 HD13 ILE 614 HD13 ILE 614 -1.507 3.848 -5.019 105 H MET 615 H MET 615 0.243 7.938 -7.741 106 HA MET 615 HA MET 615 -1.322 8.323 -10.113 107 HB2 MET 615 HB2 MET 615 -1.656 10.606 -9.301 108 HB3 MET 615 HB3 MET 615 -1.892 9.401 -8.044 109 HG2 MET 615 HG2 MET 615 -0.762 11.153 -6.989 110 HG3 MET 615 HG3 MET 615 0.416 9.882 -7.204 111 HE1 MET 615 HE1 MET 615 -0.739 13.468 -8.189 112 HE2 MET 615 HE2 MET 615 0.416 13.935 -9.456 113 HE3 MET 615 HE3 MET 615 -0.823 12.710 -9.802 114 H THR 616 H THR 616 2.110 8.778 -9.549 115 HA THR 616 HA THR 616 2.544 10.573 -11.689 116 HB THR 616 HB THR 616 4.162 9.962 -9.874 117 HG1 THR 616 HG1 THR 616 4.868 11.050 -11.709 118 HG21 THR 616 HG21 THR 616 4.841 7.528 -11.582 119 HG22 THR 616 HG22 THR 616 3.948 7.446 -10.049 120 HG23 THR 616 HG23 THR 616 5.614 8.044 -10.073 121 H GLY 617 H GLY 617 1.690 7.181 -11.708 122 HA2 GLY 617 HA2 GLY 617 2.077 7.045 -14.673 123 HA3 GLY 617 HA3 GLY 617 2.673 5.781 -13.601 124 H LYS 618 H LYS 618 -0.247 6.915 -12.289 125 HA LYS 618 HA LYS 618 -1.998 5.224 -13.982 126 HB2 LYS 618 HB2 LYS 618 -1.670 5.160 -10.939 127 HB3 LYS 618 HB3 LYS 618 -3.151 4.688 -11.710 128 HG2 LYS 618 HG2 LYS 618 -2.133 2.633 -11.517 129 HG3 LYS 618 HG3 LYS 618 -1.697 3.085 -13.158 130 HD2 LYS 618 HD2 LYS 618 0.489 4.074 -11.871 131 HD3 LYS 618 HD3 LYS 618 -0.021 2.948 -10.641 132 HE2 LYS 618 HE2 LYS 618 1.687 1.993 -12.107 133 HE3 LYS 618 HE3 LYS 618 0.182 1.070 -12.222 134 HZ1 LYS 618 HZ1 LYS 618 1.367 1.669 -14.372 135 HZ2 LYS 618 HZ2 LYS 618 0.806 3.216 -14.156 136 HZ3 LYS 618 HZ3 LYS 618 -0.249 1.988 -14.313 137 HA PRO 619 HA PRO 619 -4.512 8.807 -13.843 138 HB2 PRO 619 HB2 PRO 619 -7.078 7.843 -14.058 139 HB3 PRO 619 HB3 PRO 619 -5.880 7.776 -15.392 140 HG2 PRO 619 HG2 PRO 619 -6.587 5.593 -13.402 141 HG3 PRO 619 HG3 PRO 619 -6.465 5.459 -15.188 142 HD2 PRO 619 HD2 PRO 619 -4.423 4.733 -13.556 143 HD3 PRO 619 HD3 PRO 619 -4.093 5.539 -15.113 144 H LYS 620 H LYS 620 -6.187 9.966 -12.677 145 HA LYS 620 HA LYS 620 -5.974 9.926 -9.893 146 HB2 LYS 620 HB2 LYS 620 -8.294 11.001 -11.577 147 HB3 LYS 620 HB3 LYS 620 -8.067 11.283 -9.861 148 HG2 LYS 620 HG2 LYS 620 -7.268 13.223 -10.757 149 HG3 LYS 620 HG3 LYS 620 -5.778 12.329 -10.463 150 HD2 LYS 620 HD2 LYS 620 -5.596 11.777 -12.845 151 HD3 LYS 620 HD3 LYS 620 -7.190 12.466 -13.180 152 HE2 LYS 620 HE2 LYS 620 -4.775 14.022 -12.142 153 HE3 LYS 620 HE3 LYS 620 -5.239 13.904 -13.843 154 HZ1 LYS 620 HZ1 LYS 620 -7.326 14.974 -13.302 155 HZ2 LYS 620 HZ2 LYS 620 -6.058 15.922 -12.864 156 HZ3 LYS 620 HZ3 LYS 620 -6.898 15.100 -11.716 157 H SER 621 H SER 621 -8.762 8.592 -11.830 158 HA SER 621 HA SER 621 -10.287 7.654 -9.791 159 HB2 SER 621 HB2 SER 621 -9.837 6.217 -12.426 160 HB3 SER 621 HB3 SER 621 -11.335 6.297 -11.474 161 HG SER 621 HG SER 621 -11.560 8.424 -12.041 162 H ALA 622 H ALA 622 -7.208 6.186 -10.835 163 HA ALA 622 HA ALA 622 -7.775 3.502 -9.963 164 HB1 ALA 622 HB1 ALA 622 -5.895 4.046 -11.519 165 HB2 ALA 622 HB2 ALA 622 -5.096 4.976 -10.231 166 HB3 ALA 622 HB3 ALA 622 -5.310 3.231 -10.051 167 H ARG 623 H ARG 623 -5.735 6.091 -8.461 168 HA ARG 623 HA ARG 623 -5.801 4.909 -5.820 169 HB2 ARG 623 HB2 ARG 623 -4.642 6.743 -5.089 170 HB3 ARG 623 HB3 ARG 623 -4.216 6.773 -6.798 171 HG2 ARG 623 HG2 ARG 623 -6.124 8.381 -7.131 172 HG3 ARG 623 HG3 ARG 623 -6.360 8.372 -5.390 173 HD2 ARG 623 HD2 ARG 623 -4.212 9.474 -5.087 174 HD3 ARG 623 HD3 ARG 623 -3.838 9.248 -6.812 175 HE ARG 623 HE ARG 623 -4.803 11.230 -7.181 176 HH11 ARG 623 HH11 ARG 623 -6.617 10.121 -4.315 177 HH12 ARG 623 HH12 ARG 623 -8.137 10.763 -4.882 178 HH21 ARG 623 HH21 ARG 623 -6.785 12.335 -7.745 179 HH22 ARG 623 HH22 ARG 623 -8.217 11.918 -6.842 180 H GLU 624 H GLU 624 -8.024 7.179 -7.519 181 HA GLU 624 HA GLU 624 -9.504 7.891 -5.246 182 HB2 GLU 624 HB2 GLU 624 -9.610 8.545 -7.906 183 HB3 GLU 624 HB3 GLU 624 -11.045 7.532 -7.784 184 HG2 GLU 624 HG2 GLU 624 -11.708 9.784 -7.517 185 HG3 GLU 624 HG3 GLU 624 -11.797 9.051 -5.923 186 H LYS 625 H LYS 625 -9.625 4.883 -7.036 187 HA LYS 625 HA LYS 625 -11.806 3.897 -5.224 188 HB2 LYS 625 HB2 LYS 625 -10.379 2.489 -7.518 189 HB3 LYS 625 HB3 LYS 625 -11.652 1.804 -6.493 190 HG2 LYS 625 HG2 LYS 625 -13.226 3.589 -7.275 191 HG3 LYS 625 HG3 LYS 625 -11.967 4.178 -8.379 192 HD2 LYS 625 HD2 LYS 625 -11.874 1.876 -9.409 193 HD3 LYS 625 HD3 LYS 625 -13.258 1.424 -8.376 194 HE2 LYS 625 HE2 LYS 625 -14.608 3.226 -9.414 195 HE3 LYS 625 HE3 LYS 625 -13.229 3.651 -10.441 196 HZ1 LYS 625 HZ1 LYS 625 -14.713 1.061 -10.535 197 HZ2 LYS 625 HZ2 LYS 625 -13.371 1.420 -11.406 198 HZ3 LYS 625 HZ3 LYS 625 -14.761 2.262 -11.631 199 H MET 626 H MET 626 -8.404 2.995 -6.121 200 HA MET 626 HA MET 626 -8.241 0.788 -4.348 201 HB2 MET 626 HB2 MET 626 -6.068 2.561 -5.529 202 HB3 MET 626 HB3 MET 626 -5.791 1.011 -4.741 203 HG2 MET 626 HG2 MET 626 -6.988 -0.158 -6.500 204 HG3 MET 626 HG3 MET 626 -7.489 1.360 -7.236 205 HE1 MET 626 HE1 MET 626 -3.082 -0.132 -7.210 206 HE2 MET 626 HE2 MET 626 -3.921 0.374 -5.735 207 HE3 MET 626 HE3 MET 626 -4.441 -1.092 -6.598 208 H MET 627 H MET 627 -7.263 4.209 -3.999 209 HA MET 627 HA MET 627 -5.845 3.851 -1.590 210 HB2 MET 627 HB2 MET 627 -5.239 5.960 -1.749 211 HB3 MET 627 HB3 MET 627 -5.727 5.728 -3.408 212 HG2 MET 627 HG2 MET 627 -7.842 6.948 -2.948 213 HG3 MET 627 HG3 MET 627 -7.399 7.066 -1.273 214 HE1 MET 627 HE1 MET 627 -4.560 8.026 -0.884 215 HE2 MET 627 HE2 MET 627 -4.744 9.784 -1.065 216 HE3 MET 627 HE3 MET 627 -5.995 8.843 -0.223 217 H LYS 628 H LYS 628 -9.193 4.551 -2.431 218 HA LYS 628 HA LYS 628 -10.000 5.104 0.317 219 HB2 LYS 628 HB2 LYS 628 -11.673 4.598 -2.170 220 HB3 LYS 628 HB3 LYS 628 -12.291 5.021 -0.567 221 HG2 LYS 628 HG2 LYS 628 -10.432 7.002 -0.810 222 HG3 LYS 628 HG3 LYS 628 -10.680 6.688 -2.508 223 HD2 LYS 628 HD2 LYS 628 -12.141 8.484 -1.861 224 HD3 LYS 628 HD3 LYS 628 -13.147 7.070 -2.175 225 HE2 LYS 628 HE2 LYS 628 -13.905 8.227 -0.154 226 HE3 LYS 628 HE3 LYS 628 -13.314 6.617 0.254 227 HZ1 LYS 628 HZ1 LYS 628 -12.514 8.310 1.801 228 HZ2 LYS 628 HZ2 LYS 628 -11.719 9.093 0.587 229 HZ3 LYS 628 HZ3 LYS 628 -11.242 7.609 1.075 230 H ILE 629 H ILE 629 -10.019 2.225 -1.806 231 HA ILE 629 HA ILE 629 -11.254 0.482 0.094 232 HB ILE 629 HB ILE 629 -9.219 -0.051 -2.095 233 HG12 ILE 629 HG12 ILE 629 -12.157 -0.853 -1.947 234 HG13 ILE 629 HG13 ILE 629 -11.665 0.713 -2.575 235 HG21 ILE 629 HG21 ILE 629 -9.761 -2.479 -1.829 236 HG22 ILE 629 HG22 ILE 629 -8.923 -1.833 -0.428 237 HG23 ILE 629 HG23 ILE 629 -10.677 -2.095 -0.357 238 HD11 ILE 629 HD11 ILE 629 -11.975 -0.795 -4.421 239 HD12 ILE 629 HD12 ILE 629 -10.254 -0.386 -4.296 240 HD13 ILE 629 HD13 ILE 629 -10.841 -1.968 -3.731 241 H ILE 630 H ILE 630 -7.695 1.120 -0.396 242 HA ILE 630 HA ILE 630 -7.007 -0.405 1.890 243 HB ILE 630 HB ILE 630 -4.810 0.593 1.848 244 HG12 ILE 630 HG12 ILE 630 -4.334 2.043 -0.306 245 HG13 ILE 630 HG13 ILE 630 -6.011 2.491 -0.116 246 HG21 ILE 630 HG21 ILE 630 -5.611 -1.256 0.257 247 HG22 ILE 630 HG22 ILE 630 -5.757 0.011 -0.965 248 HG23 ILE 630 HG23 ILE 630 -4.171 -0.357 -0.267 249 HD11 ILE 630 HD11 ILE 630 -3.826 2.906 1.970 250 HD12 ILE 630 HD12 ILE 630 -4.446 4.145 0.852 251 HD13 ILE 630 HD13 ILE 630 -5.490 3.496 2.105 252 H GLU 631 H GLU 631 -8.097 2.998 1.732 253 HA GLU 631 HA GLU 631 -7.317 3.830 4.327 254 HB2 GLU 631 HB2 GLU 631 -9.376 4.514 2.247 255 HB3 GLU 631 HB3 GLU 631 -9.618 5.146 3.849 256 HG2 GLU 631 HG2 GLU 631 -7.680 6.481 3.770 257 HG3 GLU 631 HG3 GLU 631 -7.022 5.608 2.390 258 H ILE 632 H ILE 632 -10.317 2.281 3.018 259 HA ILE 632 HA ILE 632 -11.590 2.030 5.557 260 HB ILE 632 HB ILE 632 -11.913 0.361 3.041 261 HG12 ILE 632 HG12 ILE 632 -13.879 2.449 4.070 262 HG13 ILE 632 HG13 ILE 632 -12.521 2.949 3.083 263 HG21 ILE 632 HG21 ILE 632 -13.569 0.478 5.606 264 HG22 ILE 632 HG22 ILE 632 -14.158 -0.261 4.103 265 HG23 ILE 632 HG23 ILE 632 -12.741 -0.925 4.908 266 HD11 ILE 632 HD11 ILE 632 -13.223 1.409 1.268 267 HD12 ILE 632 HD12 ILE 632 -14.645 0.942 2.224 268 HD13 ILE 632 HD13 ILE 632 -14.462 2.614 1.665 269 H ILE 633 H ILE 633 -9.302 -0.181 3.787 270 HA ILE 633 HA ILE 633 -9.747 -2.286 5.664 271 HB ILE 633 HB ILE 633 -7.282 -1.975 3.920 272 HG12 ILE 633 HG12 ILE 633 -10.086 -2.627 3.223 273 HG13 ILE 633 HG13 ILE 633 -8.743 -2.068 2.237 274 HG21 ILE 633 HG21 ILE 633 -6.962 -3.578 5.731 275 HG22 ILE 633 HG22 ILE 633 -8.497 -4.370 5.373 276 HG23 ILE 633 HG23 ILE 633 -7.159 -4.484 4.239 277 HD11 ILE 633 HD11 ILE 633 -9.492 -4.156 1.382 278 HD12 ILE 633 HD12 ILE 633 -7.892 -4.396 2.094 279 HD13 ILE 633 HD13 ILE 633 -9.344 -4.933 2.973 280 H ASP 634 H ASP 634 -7.241 0.309 5.469 281 HA ASP 634 HA ASP 634 -5.817 -0.690 7.722 282 HB2 ASP 634 HB2 ASP 634 -5.817 1.953 6.240 283 HB3 ASP 634 HB3 ASP 634 -5.031 1.852 7.810 284 H SER 635 H SER 635 -8.399 1.785 7.384 285 HA SER 635 HA SER 635 -8.244 2.534 10.141 286 HB2 SER 635 HB2 SER 635 -10.400 3.724 9.710 287 HB3 SER 635 HB3 SER 635 -9.078 4.148 8.613 288 HG SER 635 HG SER 635 -9.980 2.940 7.002 289 H LEU 636 H LEU 636 -10.142 0.023 8.464 290 HA LEU 636 HA LEU 636 -11.632 -0.655 10.873 291 HB2 LEU 636 HB2 LEU 636 -11.080 -2.146 8.306 292 HB3 LEU 636 HB3 LEU 636 -12.024 -2.835 9.629 293 HG LEU 636 HG LEU 636 -12.740 -0.219 8.217 294 HD11 LEU 636 HD11 LEU 636 -12.875 -2.164 6.718 295 HD12 LEU 636 HD12 LEU 636 -14.481 -1.529 7.093 296 HD13 LEU 636 HD13 LEU 636 -13.904 -3.014 7.887 297 HD21 LEU 636 HD21 LEU 636 -14.967 -0.581 9.281 298 HD22 LEU 636 HD22 LEU 636 -13.701 -0.283 10.469 299 HD23 LEU 636 HD23 LEU 636 -14.290 -1.942 10.200 300 H ALA 637 H ALA 637 -8.677 -1.963 9.263 301 HA ALA 637 HA ALA 637 -8.241 -4.129 10.982 302 HB1 ALA 637 HB1 ALA 637 -6.241 -2.431 9.429 303 HB2 ALA 637 HB2 ALA 637 -5.889 -4.004 10.157 304 HB3 ALA 637 HB3 ALA 637 -7.085 -3.887 8.846 305 H VAL 638 H VAL 638 -7.317 -0.704 11.437 306 HA VAL 638 HA VAL 638 -5.501 -1.059 13.514 307 HB VAL 638 HB VAL 638 -6.350 1.065 12.179 308 HG11 VAL 638 HG11 VAL 638 -7.766 1.579 14.821 309 HG12 VAL 638 HG12 VAL 638 -7.698 2.619 13.385 310 HG13 VAL 638 HG13 VAL 638 -8.609 1.100 13.340 311 HG21 VAL 638 HG21 VAL 638 -5.189 2.511 13.791 312 HG22 VAL 638 HG22 VAL 638 -5.263 1.221 15.013 313 HG23 VAL 638 HG23 VAL 638 -4.322 0.991 13.522 314 H SER 639 H SER 639 -8.905 -1.677 13.662 315 HA SER 639 HA SER 639 -8.787 -2.011 16.627 316 HB2 SER 639 HB2 SER 639 -11.098 -1.034 14.907 317 HB3 SER 639 HB3 SER 639 -11.132 -1.268 16.666 318 HG SER 639 HG SER 639 -10.727 0.923 15.941 319 H SER 640 H SER 640 -8.665 -3.943 13.994 320 HA SER 640 HA SER 640 -10.858 -5.756 14.903 321 HB2 SER 640 HB2 SER 640 -10.354 -5.086 11.985 322 HB3 SER 640 HB3 SER 640 -11.705 -5.988 12.686 323 HG SER 640 HG SER 640 -11.147 -3.229 12.674 324 H GLU 641 H GLU 641 -10.742 -7.927 13.905 325 HA GLU 641 HA GLU 641 -8.230 -9.239 13.771 326 HB2 GLU 641 HB2 GLU 641 -10.765 -9.866 12.189 327 HB3 GLU 641 HB3 GLU 641 -9.464 -10.991 12.571 328 HG2 GLU 641 HG2 GLU 641 -10.173 -10.961 14.942 329 HG3 GLU 641 HG3 GLU 641 -11.407 -9.742 14.561 330 H CYS 642 H CYS 642 -10.383 -7.880 11.291 331 HA CYS 642 HA CYS 642 -8.479 -7.343 9.216 332 HB2 CYS 642 HB2 CYS 642 -9.623 -9.044 7.733 333 HB3 CYS 642 HB3 CYS 642 -8.548 -9.737 8.938 334 H ALA 643 H ALA 643 -9.736 -6.561 7.331 335 HA ALA 643 HA ALA 643 -12.218 -5.114 8.146 336 HB1 ALA 643 HB1 ALA 643 -11.911 -3.995 5.967 337 HB2 ALA 643 HB2 ALA 643 -10.424 -3.890 6.948 338 HB3 ALA 643 HB3 ALA 643 -10.544 -5.051 5.599 339 H LYS 644 H LYS 644 -14.239 -6.129 7.642 340 HA LYS 644 HA LYS 644 -14.042 -8.640 6.119 341 HB2 LYS 644 HB2 LYS 644 -16.488 -7.310 7.293 342 HB3 LYS 644 HB3 LYS 644 -16.389 -8.944 6.672 343 HG2 LYS 644 HG2 LYS 644 -15.363 -9.786 8.551 344 HG3 LYS 644 HG3 LYS 644 -14.423 -8.338 8.849 345 HD2 LYS 644 HD2 LYS 644 -15.939 -8.438 10.632 346 HD3 LYS 644 HD3 LYS 644 -16.484 -7.141 9.576 347 HE2 LYS 644 HE2 LYS 644 -18.412 -8.327 10.316 348 HE3 LYS 644 HE3 LYS 644 -18.197 -8.680 8.597 349 HZ1 LYS 644 HZ1 LYS 644 -17.211 -10.494 10.716 350 HZ2 LYS 644 HZ2 LYS 644 -17.372 -10.841 9.128 351 HZ3 LYS 644 HZ3 LYS 644 -18.707 -10.643 10.031 352 H VAL 645 H VAL 645 -14.976 -8.999 4.198 353 HA VAL 645 HA VAL 645 -15.021 -6.892 2.304 354 HB VAL 645 HB VAL 645 -14.611 -9.284 1.819 355 HG11 VAL 645 HG11 VAL 645 -16.319 -10.881 1.462 356 HG12 VAL 645 HG12 VAL 645 -16.500 -10.293 3.126 357 HG13 VAL 645 HG13 VAL 645 -17.598 -9.716 1.869 358 HG21 VAL 645 HG21 VAL 645 -15.479 -9.216 -0.390 359 HG22 VAL 645 HG22 VAL 645 -16.936 -8.340 0.120 360 HG23 VAL 645 HG23 VAL 645 -15.402 -7.503 0.118 361 H LYS 646 H LYS 646 -17.529 -8.144 4.407 362 HA LYS 646 HA LYS 646 -19.806 -6.973 3.156 363 HB2 LYS 646 HB2 LYS 646 -19.627 -8.722 5.094 364 HB3 LYS 646 HB3 LYS 646 -19.347 -7.344 6.152 365 HG2 LYS 646 HG2 LYS 646 -21.655 -7.979 6.276 366 HG3 LYS 646 HG3 LYS 646 -21.579 -6.409 5.471 367 HD2 LYS 646 HD2 LYS 646 -21.961 -7.414 3.299 368 HD3 LYS 646 HD3 LYS 646 -21.758 -9.050 3.935 369 HE2 LYS 646 HE2 LYS 646 -23.983 -7.125 4.747 370 HE3 LYS 646 HE3 LYS 646 -24.136 -8.355 3.484 371 HZ1 LYS 646 HZ1 LYS 646 -25.007 -9.142 5.569 372 HZ2 LYS 646 HZ2 LYS 646 -23.565 -8.905 6.325 373 HZ3 LYS 646 HZ3 LYS 646 -23.699 -10.043 5.142 374 H ASP 647 H ASP 647 -17.306 -5.683 5.422 375 HA ASP 647 HA ASP 647 -18.757 -3.306 6.086 376 HB2 ASP 647 HB2 ASP 647 -15.748 -3.671 6.218 377 HB3 ASP 647 HB3 ASP 647 -16.769 -2.645 7.217 378 H ILE 648 H ILE 648 -16.175 -4.307 3.887 379 HA ILE 648 HA ILE 648 -15.633 -1.687 2.853 380 HB ILE 648 HB ILE 648 -14.947 -4.364 1.550 381 HG12 ILE 648 HG12 ILE 648 -13.322 -2.753 3.578 382 HG13 ILE 648 HG13 ILE 648 -14.147 -4.224 3.944 383 HG21 ILE 648 HG21 ILE 648 -14.682 -2.354 0.085 384 HG22 ILE 648 HG22 ILE 648 -13.672 -1.584 1.326 385 HG23 ILE 648 HG23 ILE 648 -13.116 -3.039 0.481 386 HD11 ILE 648 HD11 ILE 648 -11.849 -4.758 3.629 387 HD12 ILE 648 HD12 ILE 648 -12.791 -5.488 2.323 388 HD13 ILE 648 HD13 ILE 648 -11.829 -4.013 2.027 389 H LEU 649 H LEU 649 -17.581 -4.453 1.601 390 HA LEU 649 HA LEU 649 -18.561 -3.213 -0.731 391 HB2 LEU 649 HB2 LEU 649 -19.647 -5.287 1.174 392 HB3 LEU 649 HB3 LEU 649 -20.679 -4.675 -0.099 393 HG LEU 649 HG LEU 649 -17.936 -5.827 -0.721 394 HD11 LEU 649 HD11 LEU 649 -19.288 -7.549 0.433 395 HD12 LEU 649 HD12 LEU 649 -19.107 -7.936 -1.286 396 HD13 LEU 649 HD13 LEU 649 -20.637 -7.260 -0.686 397 HD21 LEU 649 HD21 LEU 649 -18.909 -6.144 -2.978 398 HD22 LEU 649 HD22 LEU 649 -18.974 -4.442 -2.512 399 HD23 LEU 649 HD23 LEU 649 -20.442 -5.429 -2.433 400 H LYS 650 H LYS 650 -19.787 -3.009 2.654 401 HA LYS 650 HA LYS 650 -22.075 -1.435 2.007 402 HB2 LYS 650 HB2 LYS 650 -21.673 -2.646 4.187 403 HB3 LYS 650 HB3 LYS 650 -20.434 -1.462 4.583 404 HG2 LYS 650 HG2 LYS 650 -22.251 -0.646 5.735 405 HG3 LYS 650 HG3 LYS 650 -22.314 0.321 4.261 406 HD2 LYS 650 HD2 LYS 650 -23.974 -1.502 3.380 407 HD3 LYS 650 HD3 LYS 650 -24.009 -2.086 5.043 408 HE2 LYS 650 HE2 LYS 650 -25.136 0.435 3.857 409 HE3 LYS 650 HE3 LYS 650 -25.886 -0.731 4.956 410 HZ1 LYS 650 HZ1 LYS 650 -24.214 0.206 6.640 411 HZ2 LYS 650 HZ2 LYS 650 -25.455 1.215 6.184 412 HZ3 LYS 650 HZ3 LYS 650 -23.987 1.418 5.517 413 H GLU 651 H GLU 651 -18.841 -0.374 3.267 414 HA GLU 651 HA GLU 651 -19.598 2.381 3.035 415 HB2 GLU 651 HB2 GLU 651 -16.891 1.048 3.465 416 HB3 GLU 651 HB3 GLU 651 -17.159 2.790 3.540 417 HG2 GLU 651 HG2 GLU 651 -18.371 0.675 5.371 418 HG3 GLU 651 HG3 GLU 651 -17.199 1.919 5.800 419 H ALA 652 H ALA 652 -17.709 0.260 0.827 420 HA ALA 652 HA ALA 652 -16.980 2.455 -0.893 421 HB1 ALA 652 HB1 ALA 652 -17.077 -0.525 -1.393 422 HB2 ALA 652 HB2 ALA 652 -16.359 0.665 -2.492 423 HB3 ALA 652 HB3 ALA 652 -15.677 0.422 -0.870 424 H GLN 653 H GLN 653 -19.881 0.251 -0.852 425 HA GLN 653 HA GLN 653 -20.938 1.415 -3.295 426 HB2 GLN 653 HB2 GLN 653 -22.233 -0.148 -1.050 427 HB3 GLN 653 HB3 GLN 653 -23.133 0.479 -2.434 428 HG2 GLN 653 HG2 GLN 653 -21.821 -0.756 -4.025 429 HG3 GLN 653 HG3 GLN 653 -20.676 -1.274 -2.786 430 HE21 GLN 653 HE21 GLN 653 -21.799 -2.408 -0.869 431 HE22 GLN 653 HE22 GLN 653 -22.971 -3.679 -1.320 432 H GLN 654 H GLN 654 -21.171 2.303 0.172 433 HA GLN 654 HA GLN 654 -22.986 4.499 -0.258 434 HB2 GLN 654 HB2 GLN 654 -20.917 3.880 1.863 435 HB3 GLN 654 HB3 GLN 654 -21.842 5.385 1.893 436 HG2 GLN 654 HG2 GLN 654 -23.929 4.251 2.099 437 HG3 GLN 654 HG3 GLN 654 -23.219 2.694 1.694 438 HE21 GLN 654 HE21 GLN 654 -21.066 4.335 3.943 439 HE22 GLN 654 HE22 GLN 654 -21.445 3.235 5.188 440 H VAL 655 H VAL 655 -19.377 4.326 -0.431 441 HA VAL 655 HA VAL 655 -19.028 7.086 -1.120 442 HB VAL 655 HB VAL 655 -17.384 4.566 -1.530 443 HG11 VAL 655 HG11 VAL 655 -16.722 5.990 -3.395 444 HG12 VAL 655 HG12 VAL 655 -16.547 7.385 -2.307 445 HG13 VAL 655 HG13 VAL 655 -15.458 5.980 -2.167 446 HG21 VAL 655 HG21 VAL 655 -15.950 5.556 0.184 447 HG22 VAL 655 HG22 VAL 655 -16.922 7.048 0.187 448 HG23 VAL 655 HG23 VAL 655 -17.609 5.533 0.785 449 H GLY 656 H GLY 656 -19.783 4.200 -3.081 450 HA2 GLY 656 HA2 GLY 656 -21.617 4.837 -4.680 451 HA3 GLY 656 HA3 GLY 656 -20.511 6.044 -5.337 452 H ILE 657 H ILE 657 -18.883 3.123 -4.465 453 HA ILE 657 HA ILE 657 -18.367 2.542 -7.302 454 HB ILE 657 HB ILE 657 -17.307 1.333 -4.710 455 HG12 ILE 657 HG12 ILE 657 -15.798 3.240 -6.560 456 HG13 ILE 657 HG13 ILE 657 -16.736 3.841 -5.195 457 HG21 ILE 657 HG21 ILE 657 -17.050 -0.223 -6.570 458 HG22 ILE 657 HG22 ILE 657 -16.336 1.039 -7.595 459 HG23 ILE 657 HG23 ILE 657 -15.475 0.415 -6.167 460 HD11 ILE 657 HD11 ILE 657 -14.408 1.921 -4.965 461 HD12 ILE 657 HD12 ILE 657 -14.464 3.635 -4.507 462 HD13 ILE 657 HD13 ILE 657 -15.460 2.458 -3.630 463 H GLU 658 H GLU 658 -18.730 0.233 -8.121 464 HA GLU 658 HA GLU 658 -21.369 -0.669 -7.169 465 HB2 GLU 658 HB2 GLU 658 -21.026 -0.357 -9.535 466 HB3 GLU 658 HB3 GLU 658 -19.579 -1.338 -9.506 467 HG2 GLU 658 HG2 GLU 658 -22.043 -2.760 -8.600 468 HG3 GLU 658 HG3 GLU 658 -22.182 -2.124 -10.215 469 H LYS 659 H LYS 659 -21.723 -2.726 -6.450 470 HA LYS 659 HA LYS 659 -20.286 -4.356 -4.884 471 HB2 LYS 659 HB2 LYS 659 -22.657 -4.617 -5.694 472 HB3 LYS 659 HB3 LYS 659 -22.040 -5.247 -7.218 473 HG2 LYS 659 HG2 LYS 659 -20.783 -6.976 -5.626 474 HG3 LYS 659 HG3 LYS 659 -21.995 -6.447 -4.453 475 HD2 LYS 659 HD2 LYS 659 -23.033 -8.321 -5.452 476 HD3 LYS 659 HD3 LYS 659 -23.725 -6.970 -6.359 477 HE2 LYS 659 HE2 LYS 659 -23.071 -8.398 -8.108 478 HE3 LYS 659 HE3 LYS 659 -21.670 -7.333 -7.975 479 HZ1 LYS 659 HZ1 LYS 659 -21.858 -10.152 -7.292 480 HZ2 LYS 659 HZ2 LYS 659 -20.943 -9.231 -6.265 481 HZ3 LYS 659 HZ3 LYS 659 -20.523 -9.263 -7.763 482 H SER 660 H SER 660 -20.251 -4.995 -8.494 483 HA SER 660 HA SER 660 -18.331 -7.104 -8.034 484 HB2 SER 660 HB2 SER 660 -18.850 -5.984 -10.776 485 HB3 SER 660 HB3 SER 660 -18.528 -7.653 -10.275 486 HG SER 660 HG SER 660 -20.863 -6.019 -10.012 487 H ASN 661 H ASN 661 -18.124 -3.736 -9.053 488 HA ASN 661 HA ASN 661 -15.388 -3.537 -9.707 489 HB2 ASN 661 HB2 ASN 661 -17.200 -1.558 -8.355 490 HB3 ASN 661 HB3 ASN 661 -15.486 -1.328 -8.479 491 HD21 ASN 661 HD21 ASN 661 -18.157 -2.484 -10.793 492 HD22 ASN 661 HD22 ASN 661 -17.583 -1.405 -12.048 493 H ILE 662 H ILE 662 -16.940 -3.833 -6.429 494 HA ILE 662 HA ILE 662 -14.470 -3.137 -5.036 495 HB ILE 662 HB ILE 662 -17.225 -4.159 -4.225 496 HG12 ILE 662 HG12 ILE 662 -15.978 -1.538 -3.402 497 HG13 ILE 662 HG13 ILE 662 -16.638 -1.703 -5.014 498 HG21 ILE 662 HG21 ILE 662 -16.545 -3.685 -1.835 499 HG22 ILE 662 HG22 ILE 662 -15.892 -5.139 -2.561 500 HG23 ILE 662 HG23 ILE 662 -14.860 -3.699 -2.393 501 HD11 ILE 662 HD11 ILE 662 -18.353 -0.764 -3.641 502 HD12 ILE 662 HD12 ILE 662 -18.836 -2.408 -4.095 503 HD13 ILE 662 HD13 ILE 662 -18.221 -2.088 -2.470 504 H GLU 663 H GLU 663 -16.320 -5.955 -6.069 505 HA GLU 663 HA GLU 663 -14.821 -7.943 -4.609 506 HB2 GLU 663 HB2 GLU 663 -16.390 -8.227 -7.199 507 HB3 GLU 663 HB3 GLU 663 -15.866 -9.556 -6.156 508 HG2 GLU 663 HG2 GLU 663 -17.250 -8.667 -4.307 509 HG3 GLU 663 HG3 GLU 663 -17.733 -7.331 -5.243 510 H LYS 664 H LYS 664 -14.615 -6.778 -8.022 511 HA LYS 664 HA LYS 664 -12.316 -8.368 -8.525 512 HB2 LYS 664 HB2 LYS 664 -11.957 -7.228 -10.570 513 HB3 LYS 664 HB3 LYS 664 -13.681 -7.551 -10.367 514 HG2 LYS 664 HG2 LYS 664 -14.065 -5.196 -9.796 515 HG3 LYS 664 HG3 LYS 664 -12.339 -4.850 -9.848 516 HD2 LYS 664 HD2 LYS 664 -13.474 -4.045 -11.841 517 HD3 LYS 664 HD3 LYS 664 -12.228 -5.253 -12.205 518 HE2 LYS 664 HE2 LYS 664 -14.023 -6.998 -12.383 519 HE3 LYS 664 HE3 LYS 664 -15.241 -5.746 -12.087 520 HZ1 LYS 664 HZ1 LYS 664 -13.351 -5.819 -14.358 521 HZ2 LYS 664 HZ2 LYS 664 -14.490 -4.656 -14.108 522 HZ3 LYS 664 HZ3 LYS 664 -14.948 -6.204 -14.435 523 H LEU 665 H LEU 665 -12.578 -4.915 -7.426 524 HA LEU 665 HA LEU 665 -9.762 -4.548 -7.566 525 HB2 LEU 665 HB2 LEU 665 -11.908 -3.144 -5.955 526 HB3 LEU 665 HB3 LEU 665 -10.206 -2.659 -5.907 527 HG LEU 665 HG LEU 665 -11.708 -2.874 -8.549 528 HD11 LEU 665 HD11 LEU 665 -12.897 -1.269 -7.095 529 HD12 LEU 665 HD12 LEU 665 -12.068 -0.483 -8.449 530 HD13 LEU 665 HD13 LEU 665 -11.364 -0.410 -6.811 531 HD21 LEU 665 HD21 LEU 665 -9.957 -1.311 -9.324 532 HD22 LEU 665 HD22 LEU 665 -9.249 -2.814 -8.739 533 HD23 LEU 665 HD23 LEU 665 -9.192 -1.360 -7.719 534 H LEU 666 H LEU 666 -11.795 -5.576 -4.742 535 HA LEU 666 HA LEU 666 -9.718 -5.942 -2.852 536 HB2 LEU 666 HB2 LEU 666 -12.183 -7.610 -3.464 537 HB3 LEU 666 HB3 LEU 666 -11.168 -7.901 -2.062 538 HG LEU 666 HG LEU 666 -12.424 -5.155 -2.474 539 HD11 LEU 666 HD11 LEU 666 -14.302 -5.999 -1.080 540 HD12 LEU 666 HD12 LEU 666 -13.623 -7.647 -1.203 541 HD13 LEU 666 HD13 LEU 666 -14.235 -6.828 -2.639 542 HD21 LEU 666 HD21 LEU 666 -11.611 -6.734 -0.010 543 HD22 LEU 666 HD22 LEU 666 -12.383 -5.150 -0.011 544 HD23 LEU 666 HD23 LEU 666 -10.745 -5.340 -0.672 545 H THR 667 H THR 667 -10.799 -8.041 -5.527 546 HA THR 667 HA THR 667 -9.138 -10.307 -4.953 547 HB THR 667 HB THR 667 -10.508 -9.379 -7.489 548 HG1 THR 667 HG1 THR 667 -12.000 -9.792 -6.060 549 HG21 THR 667 HG21 THR 667 -8.716 -10.806 -8.126 550 HG22 THR 667 HG22 THR 667 -10.213 -11.736 -8.188 551 HG23 THR 667 HG23 THR 667 -9.074 -11.955 -6.818 552 H ASP 668 H ASP 668 -8.815 -7.651 -7.289 553 HA ASP 668 HA ASP 668 -6.363 -8.394 -8.429 554 HB2 ASP 668 HB2 ASP 668 -7.938 -5.854 -7.993 555 HB3 ASP 668 HB3 ASP 668 -6.396 -5.833 -8.858 556 H MET 669 H MET 669 -7.133 -6.335 -5.618 557 HA MET 669 HA MET 669 -4.465 -5.516 -5.033 558 HB2 MET 669 HB2 MET 669 -6.942 -5.678 -3.285 559 HB3 MET 669 HB3 MET 669 -5.483 -4.785 -2.860 560 HG2 MET 669 HG2 MET 669 -6.778 -4.195 -5.522 561 HG3 MET 669 HG3 MET 669 -7.607 -3.654 -4.086 562 HE1 MET 669 HE1 MET 669 -7.309 -1.435 -3.186 563 HE2 MET 669 HE2 MET 669 -6.024 -2.189 -2.200 564 HE3 MET 669 HE3 MET 669 -5.733 -0.626 -3.013 565 H ARG 670 H ARG 670 -6.453 -8.209 -3.594 566 HA ARG 670 HA ARG 670 -4.278 -9.126 -1.959 567 HB2 ARG 670 HB2 ARG 670 -5.593 -11.052 -1.424 568 HB3 ARG 670 HB3 ARG 670 -6.630 -9.623 -1.394 569 HG2 ARG 670 HG2 ARG 670 -7.522 -10.229 -3.572 570 HG3 ARG 670 HG3 ARG 670 -6.547 -11.689 -3.622 571 HD2 ARG 670 HD2 ARG 670 -7.850 -12.764 -2.007 572 HD3 ARG 670 HD3 ARG 670 -8.323 -11.232 -1.257 573 HE ARG 670 HE ARG 670 -9.661 -10.811 -3.353 574 HH11 ARG 670 HH11 ARG 670 -9.763 -13.927 -1.633 575 HH12 ARG 670 HH12 ARG 670 -10.939 -14.604 -2.679 576 HH21 ARG 670 HH21 ARG 670 -11.252 -11.751 -4.796 577 HH22 ARG 670 HH22 ARG 670 -11.915 -13.277 -4.342 578 H LYS 671 H LYS 671 -5.199 -9.824 -5.311 579 HA LYS 671 HA LYS 671 -3.309 -11.995 -5.491 580 HB2 LYS 671 HB2 LYS 671 -4.759 -10.310 -7.576 581 HB3 LYS 671 HB3 LYS 671 -3.617 -11.567 -8.036 582 HG2 LYS 671 HG2 LYS 671 -6.065 -12.103 -6.293 583 HG3 LYS 671 HG3 LYS 671 -6.048 -12.255 -8.051 584 HD2 LYS 671 HD2 LYS 671 -4.282 -13.984 -7.898 585 HD3 LYS 671 HD3 LYS 671 -4.286 -13.837 -6.124 586 HE2 LYS 671 HE2 LYS 671 -6.689 -14.456 -6.080 587 HE3 LYS 671 HE3 LYS 671 -6.672 -14.641 -7.841 588 HZ1 LYS 671 HZ1 LYS 671 -5.056 -16.222 -5.940 589 HZ2 LYS 671 HZ2 LYS 671 -5.042 -16.397 -7.576 590 HZ3 LYS 671 HZ3 LYS 671 -6.403 -16.750 -6.721 591 H SER 672 H SER 672 -3.156 -8.496 -6.195 592 HA SER 672 HA SER 672 -0.491 -8.465 -7.209 593 HB2 SER 672 HB2 SER 672 -2.188 -6.682 -7.494 594 HB3 SER 672 HB3 SER 672 -2.114 -6.323 -5.761 595 HG SER 672 HG SER 672 -0.807 -4.954 -7.114 596 H GLY 673 H GLY 673 -1.823 -8.190 -3.888 597 HA2 GLY 673 HA2 GLY 673 -0.584 -9.161 -2.025 598 HA3 GLY 673 HA3 GLY 673 0.926 -8.613 -2.764 599 H ILE 674 H ILE 674 -1.571 -6.350 -3.154 600 HA ILE 674 HA ILE 674 -0.463 -4.324 -1.415 601 HB ILE 674 HB ILE 674 -3.121 -4.607 -2.901 602 HG12 ILE 674 HG12 ILE 674 -0.583 -3.073 -3.607 603 HG13 ILE 674 HG13 ILE 674 -1.077 -4.584 -4.337 604 HG21 ILE 674 HG21 ILE 674 -3.427 -2.176 -2.558 605 HG22 ILE 674 HG22 ILE 674 -3.390 -3.020 -1.031 606 HG23 ILE 674 HG23 ILE 674 -1.954 -2.132 -1.559 607 HD11 ILE 674 HD11 ILE 674 -3.101 -3.554 -5.264 608 HD12 ILE 674 HD12 ILE 674 -2.593 -1.972 -4.613 609 HD13 ILE 674 HD13 ILE 674 -1.613 -2.788 -5.838 610 H ILE 675 H ILE 675 -3.048 -6.807 -1.215 611 HA ILE 675 HA ILE 675 -3.002 -6.412 1.697 612 HB ILE 675 HB ILE 675 -5.432 -6.460 1.864 613 HG12 ILE 675 HG12 ILE 675 -5.456 -7.007 -1.118 614 HG13 ILE 675 HG13 ILE 675 -5.941 -8.111 0.176 615 HG21 ILE 675 HG21 ILE 675 -6.084 -4.358 0.908 616 HG22 ILE 675 HG22 ILE 675 -4.353 -4.243 1.129 617 HG23 ILE 675 HG23 ILE 675 -4.998 -4.552 -0.474 618 HD11 ILE 675 HD11 ILE 675 -7.905 -7.293 -0.875 619 HD12 ILE 675 HD12 ILE 675 -7.809 -6.549 0.736 620 HD13 ILE 675 HD13 ILE 675 -7.386 -5.606 -0.719 621 H TYR 676 H TYR 676 -4.238 -8.434 2.685 622 HA TYR 676 HA TYR 676 -3.998 -10.824 0.981 623 HB2 TYR 676 HB2 TYR 676 -2.846 -12.067 2.659 624 HB3 TYR 676 HB3 TYR 676 -1.887 -10.648 2.252 625 HD1 TYR 676 HD1 TYR 676 -1.702 -8.741 3.899 626 HD2 TYR 676 HD2 TYR 676 -3.639 -12.462 4.878 627 HE1 TYR 676 HE1 TYR 676 -1.429 -8.242 6.313 628 HE2 TYR 676 HE2 TYR 676 -3.382 -11.988 7.280 629 HH TYR 676 HH TYR 676 -2.291 -10.602 8.840 630 H GLU 677 H GLU 677 -5.283 -12.675 1.956 631 HA GLU 677 HA GLU 677 -7.724 -11.669 3.198 632 HB2 GLU 677 HB2 GLU 677 -7.535 -12.924 1.003 633 HB3 GLU 677 HB3 GLU 677 -7.028 -14.349 1.921 634 HG2 GLU 677 HG2 GLU 677 -9.146 -14.344 3.137 635 HG3 GLU 677 HG3 GLU 677 -9.639 -12.837 2.348 636 H ALA 678 H ALA 678 -8.371 -12.341 5.191 637 HA ALA 678 HA ALA 678 -6.446 -14.012 6.786 638 HB1 ALA 678 HB1 ALA 678 -6.630 -11.686 7.543 639 HB2 ALA 678 HB2 ALA 678 -8.398 -11.859 7.669 640 HB3 ALA 678 HB3 ALA 678 -7.340 -12.802 8.736 641 H LYS 679 H LYS 679 -9.763 -13.729 5.666 642 HA LYS 679 HA LYS 679 -10.329 -16.427 6.568 643 HB2 LYS 679 HB2 LYS 679 -12.259 -14.120 7.024 644 HB3 LYS 679 HB3 LYS 679 -12.586 -15.806 7.376 645 HG2 LYS 679 HG2 LYS 679 -11.045 -15.735 9.313 646 HG3 LYS 679 HG3 LYS 679 -10.633 -14.047 8.922 647 HD2 LYS 679 HD2 LYS 679 -13.159 -13.590 8.944 648 HD3 LYS 679 HD3 LYS 679 -13.352 -15.161 9.734 649 HE2 LYS 679 HE2 LYS 679 -11.933 -14.267 11.620 650 HE3 LYS 679 HE3 LYS 679 -11.744 -12.762 10.715 651 HZ1 LYS 679 HZ1 LYS 679 -13.471 -12.388 12.178 652 HZ2 LYS 679 HZ2 LYS 679 -14.198 -13.831 11.892 653 HZ3 LYS 679 HZ3 LYS 679 -14.272 -12.681 10.710 654 HA PRO 680 HA PRO 680 -12.724 -15.614 2.656 655 HB2 PRO 680 HB2 PRO 680 -14.481 -17.693 2.601 656 HB3 PRO 680 HB3 PRO 680 -12.730 -17.949 2.342 657 HG2 PRO 680 HG2 PRO 680 -14.274 -18.256 4.944 658 HG3 PRO 680 HG3 PRO 680 -13.158 -19.434 4.182 659 HD2 PRO 680 HD2 PRO 680 -12.343 -17.699 6.149 660 HD3 PRO 680 HD3 PRO 680 -11.254 -18.171 4.814 661 H GLU 681 H GLU 681 -13.004 -13.925 4.295 662 HA GLU 681 HA GLU 681 -15.443 -12.871 3.590 663 HB2 GLU 681 HB2 GLU 681 -16.547 -12.381 5.599 664 HB3 GLU 681 HB3 GLU 681 -16.251 -14.120 5.631 665 HG2 GLU 681 HG2 GLU 681 -14.672 -14.006 7.314 666 HG3 GLU 681 HG3 GLU 681 -14.247 -12.334 7.009 667 H CYS 682 H CYS 682 -12.136 -12.500 4.764 668 HA CYS 682 HA CYS 682 -12.496 -9.601 4.776 669 HB2 CYS 682 HB2 CYS 682 -11.844 -9.295 7.043 670 HB3 CYS 682 HB3 CYS 682 -13.222 -10.374 7.069 671 H TYR 683 H TYR 683 -10.582 -8.405 5.133 672 HA TYR 683 HA TYR 683 -8.124 -9.858 4.307 673 HB2 TYR 683 HB2 TYR 683 -9.082 -7.239 3.123 674 HB3 TYR 683 HB3 TYR 683 -7.764 -8.243 2.553 675 HD1 TYR 683 HD1 TYR 683 -8.313 -10.502 1.455 676 HD2 TYR 683 HD2 TYR 683 -11.323 -7.573 2.408 677 HE1 TYR 683 HE1 TYR 683 -9.954 -11.703 0.011 678 HE2 TYR 683 HE2 TYR 683 -12.870 -8.646 0.825 679 HH TYR 683 HH TYR 683 -13.262 -10.517 -0.544 680 H LYS 684 H LYS 684 -6.167 -8.536 4.460 681 HA LYS 684 HA LYS 684 -6.257 -6.292 6.394 682 HB2 LYS 684 HB2 LYS 684 -4.763 -8.913 6.662 683 HB3 LYS 684 HB3 LYS 684 -4.003 -7.438 7.274 684 HG2 LYS 684 HG2 LYS 684 -6.833 -8.174 8.055 685 HG3 LYS 684 HG3 LYS 684 -5.478 -8.907 8.883 686 HD2 LYS 684 HD2 LYS 684 -5.523 -5.892 8.591 687 HD3 LYS 684 HD3 LYS 684 -6.606 -6.622 9.762 688 HE2 LYS 684 HE2 LYS 684 -3.590 -6.995 9.756 689 HE3 LYS 684 HE3 LYS 684 -4.513 -5.875 10.775 690 HZ1 LYS 684 HZ1 LYS 684 -4.534 -8.802 10.868 691 HZ2 LYS 684 HZ2 LYS 684 -5.782 -7.966 11.482 692 HZ3 LYS 684 HZ3 LYS 684 -4.260 -7.734 12.100 693 H LYS 685 H LYS 685 -4.698 -4.744 5.862 694 HA LYS 685 HA LYS 685 -3.611 -5.105 3.129 695 HB2 LYS 685 HB2 LYS 685 -5.436 -3.610 3.186 696 HB3 LYS 685 HB3 LYS 685 -4.854 -2.775 4.620 697 HG2 LYS 685 HG2 LYS 685 -3.096 -2.740 2.165 698 HG3 LYS 685 HG3 LYS 685 -4.607 -1.820 2.132 699 HD2 LYS 685 HD2 LYS 685 -4.055 -0.545 4.000 700 HD3 LYS 685 HD3 LYS 685 -2.712 -1.612 4.472 701 HE2 LYS 685 HE2 LYS 685 -1.586 -0.992 2.298 702 HE3 LYS 685 HE3 LYS 685 -2.844 0.249 2.091 703 HZ1 LYS 685 HZ1 LYS 685 -1.007 1.227 3.306 704 HZ2 LYS 685 HZ2 LYS 685 -0.829 -0.174 4.174 705 HZ3 LYS 685 HZ3 LYS 685 -2.131 0.860 4.500 706 H VAL 686 H VAL 686 -1.522 -4.076 2.649 707 HA VAL 686 HA VAL 686 0.160 -4.367 5.080 708 HB VAL 686 HB VAL 686 1.734 -5.480 3.848 709 HG11 VAL 686 HG11 VAL 686 -0.307 -6.784 4.362 710 HG12 VAL 686 HG12 VAL 686 -0.853 -6.524 2.683 711 HG13 VAL 686 HG13 VAL 686 0.639 -7.419 3.003 712 HG21 VAL 686 HG21 VAL 686 0.382 -4.767 1.237 713 HG22 VAL 686 HG22 VAL 686 1.948 -4.179 1.813 714 HG23 VAL 686 HG23 VAL 686 1.729 -5.892 1.428 Start of MODEL 19 1 H1 GLY 600 H1 GLY 600 -3.315 9.517 8.044 2 H2 GLY 600 H2 GLY 600 -2.373 9.543 6.685 3 H3 GLY 600 H3 GLY 600 -3.834 8.796 6.640 4 HA2 GLY 600 HA2 GLY 600 -1.458 7.946 8.132 5 HA3 GLY 600 HA3 GLY 600 -3.057 7.172 8.271 6 H SER 601 H SER 601 -1.121 5.478 7.482 7 HA SER 601 HA SER 601 -0.490 4.013 5.935 8 HB2 SER 601 HB2 SER 601 -3.233 4.319 5.791 9 HB3 SER 601 HB3 SER 601 -2.764 4.437 4.094 10 HG SER 601 HG SER 601 -2.982 2.291 5.745 11 H HIS 602 H HIS 602 0.505 6.785 5.468 12 HA HIS 602 HA HIS 602 0.500 7.370 2.678 13 HB2 HIS 602 HB2 HIS 602 2.799 8.134 4.480 14 HB3 HIS 602 HB3 HIS 602 2.042 9.064 3.196 15 HD1 HIS 602 HD1 HIS 602 2.478 9.438 6.637 16 HD2 HIS 602 HD2 HIS 602 -0.935 9.350 4.171 17 HE1 HIS 602 HE1 HIS 602 0.616 10.608 7.936 18 H MET 603 H MET 603 1.986 6.780 1.009 19 HA MET 603 HA MET 603 4.534 5.707 1.781 20 HB2 MET 603 HB2 MET 603 3.061 3.664 1.511 21 HB3 MET 603 HB3 MET 603 2.840 4.109 -0.185 22 HG2 MET 603 HG2 MET 603 5.293 3.940 -0.535 23 HG3 MET 603 HG3 MET 603 5.530 3.578 1.169 24 HE1 MET 603 HE1 MET 603 4.330 -0.053 1.563 25 HE2 MET 603 HE2 MET 603 5.255 1.297 2.257 26 HE3 MET 603 HE3 MET 603 3.495 1.443 2.033 27 H GLY 604 H GLY 604 6.044 6.008 0.071 28 HA2 GLY 604 HA2 GLY 604 5.294 6.708 -2.566 29 HA3 GLY 604 HA3 GLY 604 5.962 8.129 -1.731 30 H GLU 605 H GLU 605 8.154 8.292 -1.983 31 HA GLU 605 HA GLU 605 9.985 6.292 -2.713 32 HB2 GLU 605 HB2 GLU 605 10.386 8.809 -1.042 33 HB3 GLU 605 HB3 GLU 605 11.685 7.876 -1.795 34 HG2 GLU 605 HG2 GLU 605 10.791 8.358 -4.035 35 HG3 GLU 605 HG3 GLU 605 9.435 9.250 -3.331 36 H SER 606 H SER 606 8.396 6.705 0.343 37 HA SER 606 HA SER 606 10.249 5.313 2.046 38 HB2 SER 606 HB2 SER 606 8.089 5.113 3.428 39 HB3 SER 606 HB3 SER 606 8.687 6.741 3.074 40 HG SER 606 HG SER 606 6.460 6.554 2.719 41 H GLY 607 H GLY 607 8.425 4.179 -0.634 42 HA2 GLY 607 HA2 GLY 607 9.190 1.480 -0.031 43 HA3 GLY 607 HA3 GLY 607 7.433 1.692 0.035 44 H LYS 608 H LYS 608 6.473 1.244 -1.904 45 HA LYS 608 HA LYS 608 7.590 2.355 -4.357 46 HB2 LYS 608 HB2 LYS 608 8.367 -0.249 -3.673 47 HB3 LYS 608 HB3 LYS 608 7.054 -0.536 -4.794 48 HG2 LYS 608 HG2 LYS 608 9.503 1.237 -5.257 49 HG3 LYS 608 HG3 LYS 608 9.316 -0.400 -5.861 50 HD2 LYS 608 HD2 LYS 608 7.609 1.998 -6.678 51 HD3 LYS 608 HD3 LYS 608 8.942 1.334 -7.605 52 HE2 LYS 608 HE2 LYS 608 6.371 -0.147 -6.901 53 HE3 LYS 608 HE3 LYS 608 6.716 0.622 -8.450 54 HZ1 LYS 608 HZ1 LYS 608 8.248 -1.609 -7.279 55 HZ2 LYS 608 HZ2 LYS 608 8.557 -0.901 -8.733 56 HZ3 LYS 608 HZ3 LYS 608 7.155 -1.737 -8.504 57 H ILE 609 H ILE 609 5.104 2.614 -2.712 58 HA ILE 609 HA ILE 609 3.252 2.457 -4.967 59 HB ILE 609 HB ILE 609 2.532 1.930 -2.037 60 HG12 ILE 609 HG12 ILE 609 1.298 -0.064 -3.351 61 HG13 ILE 609 HG13 ILE 609 2.589 0.192 -4.519 62 HG21 ILE 609 HG21 ILE 609 0.177 1.870 -2.855 63 HG22 ILE 609 HG22 ILE 609 0.905 3.459 -3.023 64 HG23 ILE 609 HG23 ILE 609 0.734 2.420 -4.456 65 HD11 ILE 609 HD11 ILE 609 4.263 -0.290 -2.719 66 HD12 ILE 609 HD12 ILE 609 2.932 -0.456 -1.551 67 HD13 ILE 609 HD13 ILE 609 3.093 -1.603 -2.892 68 H ASP 610 H ASP 610 2.226 4.488 -5.194 69 HA ASP 610 HA ASP 610 3.007 6.665 -3.382 70 HB2 ASP 610 HB2 ASP 610 3.454 6.853 -6.381 71 HB3 ASP 610 HB3 ASP 610 3.963 7.973 -5.138 72 H ILE 611 H ILE 611 1.921 8.678 -4.271 73 HA ILE 611 HA ILE 611 -0.756 8.296 -5.416 74 HB ILE 611 HB ILE 611 1.022 10.685 -4.812 75 HG12 ILE 611 HG12 ILE 611 -1.675 10.296 -3.531 76 HG13 ILE 611 HG13 ILE 611 -0.424 9.166 -3.046 77 HG21 ILE 611 HG21 ILE 611 -0.215 11.448 -6.680 78 HG22 ILE 611 HG22 ILE 611 -1.705 10.672 -6.138 79 HG23 ILE 611 HG23 ILE 611 -1.044 12.101 -5.273 80 HD11 ILE 611 HD11 ILE 611 -0.438 11.090 -1.556 81 HD12 ILE 611 HD12 ILE 611 1.094 10.982 -2.442 82 HD13 ILE 611 HD13 ILE 611 -0.126 12.184 -2.929 83 H ASP 612 H ASP 612 2.487 9.460 -6.498 84 HA ASP 612 HA ASP 612 1.614 10.364 -9.023 85 HB2 ASP 612 HB2 ASP 612 3.730 11.111 -8.027 86 HB3 ASP 612 HB3 ASP 612 4.418 9.490 -8.227 87 H THR 613 H THR 613 3.318 7.357 -8.153 88 HA THR 613 HA THR 613 3.623 6.167 -10.579 89 HB THR 613 HB THR 613 4.300 5.518 -8.187 90 HG1 THR 613 HG1 THR 613 4.906 3.603 -8.847 91 HG21 THR 613 HG21 THR 613 1.906 3.670 -8.318 92 HG22 THR 613 HG22 THR 613 2.031 5.111 -7.282 93 HG23 THR 613 HG23 THR 613 3.156 3.761 -7.059 94 H ILE 614 H ILE 614 0.648 6.563 -8.907 95 HA ILE 614 HA ILE 614 -0.911 4.871 -10.725 96 HB ILE 614 HB ILE 614 -1.843 6.686 -8.460 97 HG12 ILE 614 HG12 ILE 614 -0.368 5.055 -7.485 98 HG13 ILE 614 HG13 ILE 614 -2.025 4.742 -7.032 99 HG21 ILE 614 HG21 ILE 614 -3.277 4.503 -10.009 100 HG22 ILE 614 HG22 ILE 614 -3.888 5.283 -8.536 101 HG23 ILE 614 HG23 ILE 614 -3.645 6.239 -10.005 102 HD11 ILE 614 HD11 ILE 614 -0.464 3.270 -9.193 103 HD12 ILE 614 HD12 ILE 614 -0.824 2.684 -7.559 104 HD13 ILE 614 HD13 ILE 614 -2.150 2.931 -8.723 105 H MET 615 H MET 615 -1.114 8.244 -9.625 106 HA MET 615 HA MET 615 -2.967 8.650 -11.784 107 HB2 MET 615 HB2 MET 615 -3.375 10.848 -10.858 108 HB3 MET 615 HB3 MET 615 -3.174 9.695 -9.535 109 HG2 MET 615 HG2 MET 615 -1.918 11.449 -8.747 110 HG3 MET 615 HG3 MET 615 -0.668 10.514 -9.558 111 HE1 MET 615 HE1 MET 615 1.083 11.704 -10.890 112 HE2 MET 615 HE2 MET 615 1.065 13.471 -11.007 113 HE3 MET 615 HE3 MET 615 0.897 12.690 -9.420 114 H THR 616 H THR 616 0.364 8.931 -11.751 115 HA THR 616 HA THR 616 0.810 10.987 -13.685 116 HB THR 616 HB THR 616 2.379 9.863 -12.053 117 HG1 THR 616 HG1 THR 616 3.950 10.601 -12.974 118 HG21 THR 616 HG21 THR 616 1.948 7.479 -12.826 119 HG22 THR 616 HG22 THR 616 3.653 7.936 -12.694 120 HG23 THR 616 HG23 THR 616 2.874 7.865 -14.293 121 H GLY 617 H GLY 617 -0.482 7.763 -13.979 122 HA2 GLY 617 HA2 GLY 617 -0.869 8.239 -16.882 123 HA3 GLY 617 HA3 GLY 617 0.003 6.777 -16.438 124 H LYS 618 H LYS 618 -2.294 7.256 -13.977 125 HA LYS 618 HA LYS 618 -4.411 5.718 -15.407 126 HB2 LYS 618 HB2 LYS 618 -3.259 5.403 -12.587 127 HB3 LYS 618 HB3 LYS 618 -4.877 4.913 -12.960 128 HG2 LYS 618 HG2 LYS 618 -3.614 2.953 -13.113 129 HG3 LYS 618 HG3 LYS 618 -4.027 3.405 -14.761 130 HD2 LYS 618 HD2 LYS 618 -1.791 2.600 -14.772 131 HD3 LYS 618 HD3 LYS 618 -1.686 4.344 -15.010 132 HE2 LYS 618 HE2 LYS 618 -1.142 4.647 -12.650 133 HE3 LYS 618 HE3 LYS 618 -1.270 2.913 -12.350 134 HZ1 LYS 618 HZ1 LYS 618 0.658 2.563 -13.641 135 HZ2 LYS 618 HZ2 LYS 618 0.993 3.864 -12.669 136 HZ3 LYS 618 HZ3 LYS 618 0.648 4.100 -14.252 137 HA PRO 619 HA PRO 619 -7.052 9.008 -13.739 138 HB2 PRO 619 HB2 PRO 619 -9.259 7.618 -12.826 139 HB3 PRO 619 HB3 PRO 619 -8.984 8.064 -14.541 140 HG2 PRO 619 HG2 PRO 619 -8.431 5.421 -13.160 141 HG3 PRO 619 HG3 PRO 619 -9.179 5.691 -14.765 142 HD2 PRO 619 HD2 PRO 619 -6.553 5.019 -14.488 143 HD3 PRO 619 HD3 PRO 619 -7.085 6.157 -15.759 144 H LYS 620 H LYS 620 -7.115 9.939 -11.678 145 HA LYS 620 HA LYS 620 -5.859 8.619 -9.545 146 HB2 LYS 620 HB2 LYS 620 -6.442 10.349 -8.101 147 HB3 LYS 620 HB3 LYS 620 -6.110 11.093 -9.660 148 HG2 LYS 620 HG2 LYS 620 -8.453 11.560 -10.034 149 HG3 LYS 620 HG3 LYS 620 -8.950 10.485 -8.714 150 HD2 LYS 620 HD2 LYS 620 -7.767 11.937 -7.083 151 HD3 LYS 620 HD3 LYS 620 -7.446 13.107 -8.378 152 HE2 LYS 620 HE2 LYS 620 -9.759 13.617 -8.639 153 HE3 LYS 620 HE3 LYS 620 -10.261 12.112 -7.843 154 HZ1 LYS 620 HZ1 LYS 620 -9.479 12.914 -5.776 155 HZ2 LYS 620 HZ2 LYS 620 -10.573 13.981 -6.385 156 HZ3 LYS 620 HZ3 LYS 620 -8.958 14.344 -6.430 157 H SER 621 H SER 621 -9.229 8.376 -10.522 158 HA SER 621 HA SER 621 -10.523 7.473 -8.263 159 HB2 SER 621 HB2 SER 621 -11.398 7.806 -10.613 160 HB3 SER 621 HB3 SER 621 -10.776 6.198 -11.015 161 HG SER 621 HG SER 621 -13.002 6.281 -10.388 162 H ALA 622 H ALA 622 -7.983 5.696 -10.062 163 HA ALA 622 HA ALA 622 -8.351 3.109 -8.926 164 HB1 ALA 622 HB1 ALA 622 -6.887 3.471 -10.827 165 HB2 ALA 622 HB2 ALA 622 -5.863 4.577 -9.896 166 HB3 ALA 622 HB3 ALA 622 -5.920 2.851 -9.472 167 H ARG 623 H ARG 623 -6.031 5.686 -7.858 168 HA ARG 623 HA ARG 623 -5.577 4.452 -5.272 169 HB2 ARG 623 HB2 ARG 623 -4.639 6.671 -4.591 170 HB3 ARG 623 HB3 ARG 623 -3.880 6.014 -6.038 171 HG2 ARG 623 HG2 ARG 623 -4.983 7.538 -7.433 172 HG3 ARG 623 HG3 ARG 623 -6.174 7.934 -6.179 173 HD2 ARG 623 HD2 ARG 623 -3.469 8.774 -5.493 174 HD3 ARG 623 HD3 ARG 623 -4.200 9.556 -6.922 175 HE ARG 623 HE ARG 623 -6.267 9.538 -5.082 176 HH11 ARG 623 HH11 ARG 623 -3.098 11.130 -4.964 177 HH12 ARG 623 HH12 ARG 623 -3.734 12.521 -4.145 178 HH21 ARG 623 HH21 ARG 623 -7.047 11.169 -4.171 179 HH22 ARG 623 HH22 ARG 623 -6.113 12.540 -3.573 180 H GLU 624 H GLU 624 -7.969 6.770 -6.513 181 HA GLU 624 HA GLU 624 -8.826 7.686 -3.988 182 HB2 GLU 624 HB2 GLU 624 -9.387 8.280 -6.648 183 HB3 GLU 624 HB3 GLU 624 -10.915 7.607 -6.095 184 HG2 GLU 624 HG2 GLU 624 -10.947 9.978 -5.903 185 HG3 GLU 624 HG3 GLU 624 -10.908 9.291 -4.290 186 H LYS 625 H LYS 625 -9.633 4.751 -5.683 187 HA LYS 625 HA LYS 625 -11.578 3.983 -3.566 188 HB2 LYS 625 HB2 LYS 625 -10.726 2.623 -6.159 189 HB3 LYS 625 HB3 LYS 625 -11.941 2.000 -5.025 190 HG2 LYS 625 HG2 LYS 625 -13.236 4.112 -5.288 191 HG3 LYS 625 HG3 LYS 625 -12.097 4.684 -6.499 192 HD2 LYS 625 HD2 LYS 625 -12.533 2.615 -7.831 193 HD3 LYS 625 HD3 LYS 625 -13.810 2.193 -6.684 194 HE2 LYS 625 HE2 LYS 625 -13.644 4.555 -8.592 195 HE3 LYS 625 HE3 LYS 625 -14.872 3.281 -8.582 196 HZ1 LYS 625 HZ1 LYS 625 -15.648 5.415 -7.689 197 HZ2 LYS 625 HZ2 LYS 625 -14.552 5.336 -6.475 198 HZ3 LYS 625 HZ3 LYS 625 -15.799 4.270 -6.552 199 H MET 626 H MET 626 -8.459 2.828 -4.947 200 HA MET 626 HA MET 626 -8.185 0.543 -3.268 201 HB2 MET 626 HB2 MET 626 -6.148 2.314 -4.672 202 HB3 MET 626 HB3 MET 626 -5.685 0.889 -3.752 203 HG2 MET 626 HG2 MET 626 -7.106 -0.518 -5.214 204 HG3 MET 626 HG3 MET 626 -7.534 0.917 -6.154 205 HE1 MET 626 HE1 MET 626 -4.050 -0.506 -4.698 206 HE2 MET 626 HE2 MET 626 -4.973 -1.857 -5.403 207 HE3 MET 626 HE3 MET 626 -3.477 -1.296 -6.180 208 H MET 627 H MET 627 -7.011 3.938 -2.890 209 HA MET 627 HA MET 627 -5.650 3.395 -0.501 210 HB2 MET 627 HB2 MET 627 -6.681 6.082 -1.461 211 HB3 MET 627 HB3 MET 627 -5.503 5.830 -0.186 212 HG2 MET 627 HG2 MET 627 -5.068 5.013 -3.090 213 HG3 MET 627 HG3 MET 627 -4.498 6.503 -2.375 214 HE1 MET 627 HE1 MET 627 -2.101 5.928 -3.352 215 HE2 MET 627 HE2 MET 627 -1.246 4.407 -3.038 216 HE3 MET 627 HE3 MET 627 -2.726 4.400 -4.017 217 H LYS 628 H LYS 628 -8.980 4.240 -1.264 218 HA LYS 628 HA LYS 628 -9.755 4.807 1.464 219 HB2 LYS 628 HB2 LYS 628 -11.065 4.746 -1.159 220 HB3 LYS 628 HB3 LYS 628 -12.070 3.930 0.033 221 HG2 LYS 628 HG2 LYS 628 -10.817 6.671 0.481 222 HG3 LYS 628 HG3 LYS 628 -12.438 6.421 -0.176 223 HD2 LYS 628 HD2 LYS 628 -13.165 5.270 1.851 224 HD3 LYS 628 HD3 LYS 628 -11.554 5.360 2.574 225 HE2 LYS 628 HE2 LYS 628 -12.969 7.835 1.606 226 HE3 LYS 628 HE3 LYS 628 -13.384 7.133 3.180 227 HZ1 LYS 628 HZ1 LYS 628 -11.548 8.918 3.147 228 HZ2 LYS 628 HZ2 LYS 628 -10.537 7.724 2.565 229 HZ3 LYS 628 HZ3 LYS 628 -11.163 7.546 3.973 230 H ILE 629 H ILE 629 -9.943 1.897 -0.624 231 HA ILE 629 HA ILE 629 -11.191 0.197 1.245 232 HB ILE 629 HB ILE 629 -9.214 -0.367 -0.977 233 HG12 ILE 629 HG12 ILE 629 -12.164 -1.117 -0.761 234 HG13 ILE 629 HG13 ILE 629 -11.687 0.484 -1.304 235 HG21 ILE 629 HG21 ILE 629 -10.684 -2.405 0.760 236 HG22 ILE 629 HG22 ILE 629 -9.843 -2.782 -0.759 237 HG23 ILE 629 HG23 ILE 629 -8.924 -2.203 0.621 238 HD11 ILE 629 HD11 ILE 629 -10.348 -0.496 -3.139 239 HD12 ILE 629 HD12 ILE 629 -10.897 -2.117 -2.651 240 HD13 ILE 629 HD13 ILE 629 -12.071 -0.916 -3.221 241 H ILE 630 H ILE 630 -7.639 0.767 0.816 242 HA ILE 630 HA ILE 630 -6.990 -0.866 3.088 243 HB ILE 630 HB ILE 630 -4.796 0.335 3.170 244 HG12 ILE 630 HG12 ILE 630 -4.280 1.426 0.798 245 HG13 ILE 630 HG13 ILE 630 -5.961 1.899 0.928 246 HG21 ILE 630 HG21 ILE 630 -5.650 -0.941 0.557 247 HG22 ILE 630 HG22 ILE 630 -3.987 -0.845 1.164 248 HG23 ILE 630 HG23 ILE 630 -5.189 -1.818 2.031 249 HD11 ILE 630 HD11 ILE 630 -4.488 3.664 1.773 250 HD12 ILE 630 HD12 ILE 630 -5.419 3.020 3.129 251 HD13 ILE 630 HD13 ILE 630 -3.733 2.520 2.898 252 H GLU 631 H GLU 631 -8.156 2.401 2.971 253 HA GLU 631 HA GLU 631 -7.292 3.234 5.606 254 HB2 GLU 631 HB2 GLU 631 -9.002 4.196 3.436 255 HB3 GLU 631 HB3 GLU 631 -9.827 4.369 4.979 256 HG2 GLU 631 HG2 GLU 631 -7.845 5.646 5.791 257 HG3 GLU 631 HG3 GLU 631 -7.127 5.488 4.171 258 H ILE 632 H ILE 632 -10.226 1.636 4.224 259 HA ILE 632 HA ILE 632 -11.449 1.308 6.804 260 HB ILE 632 HB ILE 632 -11.988 -0.755 4.706 261 HG12 ILE 632 HG12 ILE 632 -12.056 0.972 3.159 262 HG13 ILE 632 HG13 ILE 632 -13.701 0.639 3.586 263 HG21 ILE 632 HG21 ILE 632 -13.686 0.836 6.680 264 HG22 ILE 632 HG22 ILE 632 -14.338 -0.367 5.571 265 HG23 ILE 632 HG23 ILE 632 -13.177 -0.860 6.807 266 HD11 ILE 632 HD11 ILE 632 -12.074 3.062 4.473 267 HD12 ILE 632 HD12 ILE 632 -13.427 3.014 3.346 268 HD13 ILE 632 HD13 ILE 632 -13.699 2.681 5.074 269 H ILE 633 H ILE 633 -9.161 -0.726 4.893 270 HA ILE 633 HA ILE 633 -9.423 -2.962 6.652 271 HB ILE 633 HB ILE 633 -7.054 -2.374 4.836 272 HG12 ILE 633 HG12 ILE 633 -9.785 -3.612 4.360 273 HG13 ILE 633 HG13 ILE 633 -8.975 -2.357 3.471 274 HG21 ILE 633 HG21 ILE 633 -6.676 -4.799 4.963 275 HG22 ILE 633 HG22 ILE 633 -6.637 -4.106 6.581 276 HG23 ILE 633 HG23 ILE 633 -8.075 -4.993 6.034 277 HD11 ILE 633 HD11 ILE 633 -8.212 -5.258 3.309 278 HD12 ILE 633 HD12 ILE 633 -9.060 -4.275 2.107 279 HD13 ILE 633 HD13 ILE 633 -7.390 -3.884 2.496 280 H ASP 634 H ASP 634 -7.108 -0.188 6.584 281 HA ASP 634 HA ASP 634 -5.521 -1.120 8.699 282 HB2 ASP 634 HB2 ASP 634 -6.129 1.687 7.685 283 HB3 ASP 634 HB3 ASP 634 -5.001 1.377 9.002 284 H SER 635 H SER 635 -8.606 0.760 8.649 285 HA SER 635 HA SER 635 -8.455 1.355 11.450 286 HB2 SER 635 HB2 SER 635 -9.654 2.746 9.812 287 HB3 SER 635 HB3 SER 635 -10.762 1.418 9.459 288 HG SER 635 HG SER 635 -11.601 2.945 10.962 289 H LEU 636 H LEU 636 -10.081 -1.136 9.452 290 HA LEU 636 HA LEU 636 -11.454 -2.213 11.783 291 HB2 LEU 636 HB2 LEU 636 -11.491 -2.773 8.820 292 HB3 LEU 636 HB3 LEU 636 -12.309 -3.814 9.951 293 HG LEU 636 HG LEU 636 -13.670 -2.037 8.814 294 HD11 LEU 636 HD11 LEU 636 -14.339 -3.390 10.838 295 HD12 LEU 636 HD12 LEU 636 -15.136 -1.815 10.766 296 HD13 LEU 636 HD13 LEU 636 -13.774 -2.069 11.872 297 HD21 LEU 636 HD21 LEU 636 -13.981 0.134 9.835 298 HD22 LEU 636 HD22 LEU 636 -12.392 -0.008 9.099 299 HD23 LEU 636 HD23 LEU 636 -12.564 -0.110 10.870 300 H ALA 637 H ALA 637 -8.470 -3.074 10.089 301 HA ALA 637 HA ALA 637 -8.239 -5.618 11.540 302 HB1 ALA 637 HB1 ALA 637 -5.953 -5.600 10.679 303 HB2 ALA 637 HB2 ALA 637 -7.100 -5.262 9.364 304 HB3 ALA 637 HB3 ALA 637 -6.149 -3.940 10.090 305 H VAL 638 H VAL 638 -8.281 -2.439 12.555 306 HA VAL 638 HA VAL 638 -6.610 -3.070 14.945 307 HB VAL 638 HB VAL 638 -7.457 -0.448 13.653 308 HG11 VAL 638 HG11 VAL 638 -6.315 -0.829 16.463 309 HG12 VAL 638 HG12 VAL 638 -6.434 0.721 15.599 310 HG13 VAL 638 HG13 VAL 638 -7.903 -0.143 16.056 311 HG21 VAL 638 HG21 VAL 638 -5.052 0.001 13.719 312 HG22 VAL 638 HG22 VAL 638 -4.754 -1.540 14.557 313 HG23 VAL 638 HG23 VAL 638 -5.354 -1.526 12.887 314 H SER 639 H SER 639 -9.809 -1.805 13.872 315 HA SER 639 HA SER 639 -11.051 -2.129 16.433 316 HB2 SER 639 HB2 SER 639 -11.633 -0.625 14.395 317 HB3 SER 639 HB3 SER 639 -12.477 -2.049 13.763 318 HG SER 639 HG SER 639 -13.800 -0.609 15.003 319 H SER 640 H SER 640 -9.999 -4.637 14.372 320 HA SER 640 HA SER 640 -11.403 -6.653 15.822 321 HB2 SER 640 HB2 SER 640 -11.987 -6.318 12.834 322 HB3 SER 640 HB3 SER 640 -12.446 -7.712 13.817 323 HG SER 640 HG SER 640 -13.232 -5.320 14.909 324 H GLU 641 H GLU 641 -10.544 -8.890 14.808 325 HA GLU 641 HA GLU 641 -7.731 -8.856 14.842 326 HB2 GLU 641 HB2 GLU 641 -9.561 -10.891 13.499 327 HB3 GLU 641 HB3 GLU 641 -7.894 -11.170 13.988 328 HG2 GLU 641 HG2 GLU 641 -8.533 -11.021 16.358 329 HG3 GLU 641 HG3 GLU 641 -10.210 -10.657 15.898 330 H CYS 642 H CYS 642 -9.992 -8.705 12.161 331 HA CYS 642 HA CYS 642 -8.038 -7.928 10.197 332 HB2 CYS 642 HB2 CYS 642 -8.997 -9.712 8.593 333 HB3 CYS 642 HB3 CYS 642 -7.842 -10.254 9.795 334 H ALA 643 H ALA 643 -9.314 -7.133 8.293 335 HA ALA 643 HA ALA 643 -11.698 -5.725 9.252 336 HB1 ALA 643 HB1 ALA 643 -10.260 -5.653 6.573 337 HB2 ALA 643 HB2 ALA 643 -11.569 -4.566 7.092 338 HB3 ALA 643 HB3 ALA 643 -10.008 -4.550 7.945 339 H LYS 644 H LYS 644 -13.424 -7.000 9.425 340 HA LYS 644 HA LYS 644 -14.165 -9.198 7.794 341 HB2 LYS 644 HB2 LYS 644 -16.251 -7.405 9.040 342 HB3 LYS 644 HB3 LYS 644 -16.314 -9.119 8.693 343 HG2 LYS 644 HG2 LYS 644 -16.008 -9.220 10.967 344 HG3 LYS 644 HG3 LYS 644 -14.328 -9.256 10.449 345 HD2 LYS 644 HD2 LYS 644 -14.140 -7.574 11.978 346 HD3 LYS 644 HD3 LYS 644 -14.659 -6.549 10.628 347 HE2 LYS 644 HE2 LYS 644 -17.032 -6.818 11.401 348 HE3 LYS 644 HE3 LYS 644 -16.418 -7.696 12.825 349 HZ1 LYS 644 HZ1 LYS 644 -15.032 -5.623 13.203 350 HZ2 LYS 644 HZ2 LYS 644 -16.667 -5.463 13.445 351 HZ3 LYS 644 HZ3 LYS 644 -16.045 -4.891 12.051 352 H VAL 645 H VAL 645 -14.921 -9.273 5.746 353 HA VAL 645 HA VAL 645 -14.811 -7.005 4.067 354 HB VAL 645 HB VAL 645 -16.014 -9.773 3.672 355 HG11 VAL 645 HG11 VAL 645 -15.749 -9.336 1.211 356 HG12 VAL 645 HG12 VAL 645 -17.021 -8.378 1.959 357 HG13 VAL 645 HG13 VAL 645 -15.463 -7.618 1.581 358 HG21 VAL 645 HG21 VAL 645 -13.575 -9.725 4.112 359 HG22 VAL 645 HG22 VAL 645 -13.898 -10.142 2.423 360 HG23 VAL 645 HG23 VAL 645 -13.355 -8.508 2.862 361 H LYS 646 H LYS 646 -17.450 -8.118 6.066 362 HA LYS 646 HA LYS 646 -19.625 -6.856 4.665 363 HB2 LYS 646 HB2 LYS 646 -19.828 -8.570 6.477 364 HB3 LYS 646 HB3 LYS 646 -19.221 -7.387 7.649 365 HG2 LYS 646 HG2 LYS 646 -21.185 -5.935 7.206 366 HG3 LYS 646 HG3 LYS 646 -21.763 -7.087 5.981 367 HD2 LYS 646 HD2 LYS 646 -21.909 -8.852 7.737 368 HD3 LYS 646 HD3 LYS 646 -21.377 -7.667 8.953 369 HE2 LYS 646 HE2 LYS 646 -23.354 -6.262 8.456 370 HE3 LYS 646 HE3 LYS 646 -23.872 -7.415 7.214 371 HZ1 LYS 646 HZ1 LYS 646 -25.035 -7.771 9.282 372 HZ2 LYS 646 HZ2 LYS 646 -23.624 -8.008 10.095 373 HZ3 LYS 646 HZ3 LYS 646 -24.099 -9.080 8.939 374 H ASP 647 H ASP 647 -17.260 -5.730 7.142 375 HA ASP 647 HA ASP 647 -18.457 -3.168 7.524 376 HB2 ASP 647 HB2 ASP 647 -15.631 -4.177 8.113 377 HB3 ASP 647 HB3 ASP 647 -16.331 -2.685 8.701 378 H ILE 648 H ILE 648 -15.863 -4.512 5.502 379 HA ILE 648 HA ILE 648 -14.985 -1.998 4.404 380 HB ILE 648 HB ILE 648 -14.769 -4.696 3.001 381 HG12 ILE 648 HG12 ILE 648 -12.891 -3.578 5.134 382 HG13 ILE 648 HG13 ILE 648 -13.919 -4.983 5.295 383 HG21 ILE 648 HG21 ILE 648 -12.818 -3.693 1.907 384 HG22 ILE 648 HG22 ILE 648 -14.187 -2.620 1.695 385 HG23 ILE 648 HG23 ILE 648 -12.956 -2.235 2.913 386 HD11 ILE 648 HD11 ILE 648 -11.529 -4.758 3.470 387 HD12 ILE 648 HD12 ILE 648 -11.758 -5.836 4.845 388 HD13 ILE 648 HD13 ILE 648 -12.712 -6.084 3.379 389 H LEU 649 H LEU 649 -17.240 -4.506 3.217 390 HA LEU 649 HA LEU 649 -18.055 -3.234 0.860 391 HB2 LEU 649 HB2 LEU 649 -19.391 -5.150 2.768 392 HB3 LEU 649 HB3 LEU 649 -20.316 -4.470 1.441 393 HG LEU 649 HG LEU 649 -17.675 -5.912 0.970 394 HD11 LEU 649 HD11 LEU 649 -19.265 -7.445 2.089 395 HD12 LEU 649 HD12 LEU 649 -19.017 -7.902 0.396 396 HD13 LEU 649 HD13 LEU 649 -20.503 -7.057 0.881 397 HD21 LEU 649 HD21 LEU 649 -18.466 -4.490 -0.909 398 HD22 LEU 649 HD22 LEU 649 -20.031 -5.317 -0.882 399 HD23 LEU 649 HD23 LEU 649 -18.556 -6.203 -1.321 400 H LYS 650 H LYS 650 -19.284 -2.777 4.218 401 HA LYS 650 HA LYS 650 -21.329 -0.912 3.512 402 HB2 LYS 650 HB2 LYS 650 -21.249 -1.871 5.751 403 HB3 LYS 650 HB3 LYS 650 -19.681 -1.121 6.068 404 HG2 LYS 650 HG2 LYS 650 -20.712 1.139 5.839 405 HG3 LYS 650 HG3 LYS 650 -22.289 0.384 5.576 406 HD2 LYS 650 HD2 LYS 650 -22.278 -0.553 7.806 407 HD3 LYS 650 HD3 LYS 650 -20.595 -0.079 8.077 408 HE2 LYS 650 HE2 LYS 650 -22.829 1.932 7.547 409 HE3 LYS 650 HE3 LYS 650 -22.370 1.383 9.168 410 HZ1 LYS 650 HZ1 LYS 650 -20.523 2.793 7.293 411 HZ2 LYS 650 HZ2 LYS 650 -20.062 2.164 8.623 412 HZ3 LYS 650 HZ3 LYS 650 -21.180 3.404 8.692 413 H GLU 651 H GLU 651 -17.991 -0.132 4.752 414 HA GLU 651 HA GLU 651 -18.553 2.642 4.294 415 HB2 GLU 651 HB2 GLU 651 -15.802 1.422 4.610 416 HB3 GLU 651 HB3 GLU 651 -16.268 3.082 4.922 417 HG2 GLU 651 HG2 GLU 651 -16.799 0.616 6.565 418 HG3 GLU 651 HG3 GLU 651 -15.989 2.091 7.034 419 H ALA 652 H ALA 652 -17.027 0.232 2.204 420 HA ALA 652 HA ALA 652 -16.098 2.178 0.288 421 HB1 ALA 652 HB1 ALA 652 -15.734 0.173 -1.122 422 HB2 ALA 652 HB2 ALA 652 -15.036 0.031 0.499 423 HB3 ALA 652 HB3 ALA 652 -16.550 -0.803 0.123 424 H GLN 653 H GLN 653 -19.138 0.127 0.488 425 HA GLN 653 HA GLN 653 -20.280 1.173 -1.925 426 HB2 GLN 653 HB2 GLN 653 -21.585 0.117 0.599 427 HB3 GLN 653 HB3 GLN 653 -22.487 0.580 -0.831 428 HG2 GLN 653 HG2 GLN 653 -20.288 -1.452 -1.204 429 HG3 GLN 653 HG3 GLN 653 -21.740 -1.944 -0.347 430 HE21 GLN 653 HE21 GLN 653 -20.829 -0.228 -3.459 431 HE22 GLN 653 HE22 GLN 653 -22.088 -1.073 -4.379 432 H GLN 654 H GLN 654 -20.292 2.393 1.458 433 HA GLN 654 HA GLN 654 -21.926 4.675 0.933 434 HB2 GLN 654 HB2 GLN 654 -19.751 4.184 3.002 435 HB3 GLN 654 HB3 GLN 654 -20.736 5.638 2.970 436 HG2 GLN 654 HG2 GLN 654 -21.931 2.841 3.212 437 HG3 GLN 654 HG3 GLN 654 -21.479 3.847 4.583 438 HE21 GLN 654 HE21 GLN 654 -23.793 3.486 1.879 439 HE22 GLN 654 HE22 GLN 654 -24.895 4.704 2.510 440 H VAL 655 H VAL 655 -18.268 4.443 0.842 441 HA VAL 655 HA VAL 655 -18.129 7.188 0.069 442 HB VAL 655 HB VAL 655 -16.355 5.693 1.211 443 HG11 VAL 655 HG11 VAL 655 -14.614 4.757 -0.146 444 HG12 VAL 655 HG12 VAL 655 -16.137 4.062 -0.713 445 HG13 VAL 655 HG13 VAL 655 -15.358 5.346 -1.646 446 HG21 VAL 655 HG21 VAL 655 -15.573 7.751 -0.884 447 HG22 VAL 655 HG22 VAL 655 -16.078 8.071 0.790 448 HG23 VAL 655 HG23 VAL 655 -14.570 7.202 0.466 449 H GLY 656 H GLY 656 -18.704 4.355 -1.879 450 HA2 GLY 656 HA2 GLY 656 -19.950 4.921 -3.933 451 HA3 GLY 656 HA3 GLY 656 -18.754 6.169 -4.289 452 H ILE 657 H ILE 657 -18.733 2.671 -3.415 453 HA ILE 657 HA ILE 657 -17.133 2.034 -5.822 454 HB ILE 657 HB ILE 657 -16.621 1.033 -2.985 455 HG12 ILE 657 HG12 ILE 657 -14.934 2.934 -4.647 456 HG13 ILE 657 HG13 ILE 657 -15.870 3.402 -3.237 457 HG21 ILE 657 HG21 ILE 657 -14.702 -0.135 -4.023 458 HG22 ILE 657 HG22 ILE 657 -16.224 -0.585 -4.766 459 HG23 ILE 657 HG23 ILE 657 -15.161 0.533 -5.618 460 HD11 ILE 657 HD11 ILE 657 -14.502 2.013 -1.769 461 HD12 ILE 657 HD12 ILE 657 -13.467 1.565 -3.149 462 HD13 ILE 657 HD13 ILE 657 -13.571 3.251 -2.611 463 H GLU 658 H GLU 658 -17.892 0.037 -6.769 464 HA GLU 658 HA GLU 658 -20.465 -0.707 -5.653 465 HB2 GLU 658 HB2 GLU 658 -20.326 -0.464 -8.035 466 HB3 GLU 658 HB3 GLU 658 -19.077 -1.703 -8.132 467 HG2 GLU 658 HG2 GLU 658 -21.296 -2.491 -8.885 468 HG3 GLU 658 HG3 GLU 658 -20.597 -3.451 -7.597 469 H LYS 659 H LYS 659 -21.027 -2.818 -4.998 470 HA LYS 659 HA LYS 659 -19.304 -4.282 -3.333 471 HB2 LYS 659 HB2 LYS 659 -20.912 -6.049 -3.281 472 HB3 LYS 659 HB3 LYS 659 -21.683 -4.471 -3.210 473 HG2 LYS 659 HG2 LYS 659 -22.071 -4.809 -5.799 474 HG3 LYS 659 HG3 LYS 659 -21.684 -6.491 -5.463 475 HD2 LYS 659 HD2 LYS 659 -23.817 -6.803 -4.881 476 HD3 LYS 659 HD3 LYS 659 -23.545 -5.837 -3.443 477 HE2 LYS 659 HE2 LYS 659 -24.557 -4.856 -6.151 478 HE3 LYS 659 HE3 LYS 659 -25.516 -5.087 -4.678 479 HZ1 LYS 659 HZ1 LYS 659 -25.091 -2.829 -4.786 480 HZ2 LYS 659 HZ2 LYS 659 -23.581 -2.987 -5.329 481 HZ3 LYS 659 HZ3 LYS 659 -23.890 -3.274 -3.735 482 H SER 660 H SER 660 -19.985 -5.104 -6.810 483 HA SER 660 HA SER 660 -18.214 -7.340 -6.817 484 HB2 SER 660 HB2 SER 660 -18.369 -7.056 -9.310 485 HB3 SER 660 HB3 SER 660 -19.928 -7.158 -8.471 486 HG SER 660 HG SER 660 -19.978 -5.451 -9.931 487 H ASN 661 H ASN 661 -17.648 -3.883 -7.103 488 HA ASN 661 HA ASN 661 -14.936 -4.079 -8.155 489 HB2 ASN 661 HB2 ASN 661 -16.154 -1.926 -6.422 490 HB3 ASN 661 HB3 ASN 661 -14.623 -1.867 -7.180 491 HD21 ASN 661 HD21 ASN 661 -16.328 -3.186 -9.675 492 HD22 ASN 661 HD22 ASN 661 -17.006 -1.712 -10.342 493 H ILE 662 H ILE 662 -16.475 -4.314 -4.861 494 HA ILE 662 HA ILE 662 -13.925 -3.779 -3.513 495 HB ILE 662 HB ILE 662 -16.717 -4.596 -2.612 496 HG12 ILE 662 HG12 ILE 662 -15.290 -2.055 -1.814 497 HG13 ILE 662 HG13 ILE 662 -15.879 -2.180 -3.447 498 HG21 ILE 662 HG21 ILE 662 -15.935 -4.125 -0.271 499 HG22 ILE 662 HG22 ILE 662 -15.234 -5.583 -0.977 500 HG23 ILE 662 HG23 ILE 662 -14.264 -4.095 -0.874 501 HD11 ILE 662 HD11 ILE 662 -17.615 -2.393 -0.992 502 HD12 ILE 662 HD12 ILE 662 -17.562 -1.066 -2.163 503 HD13 ILE 662 HD13 ILE 662 -18.176 -2.641 -2.648 504 H GLU 663 H GLU 663 -15.874 -6.377 -4.721 505 HA GLU 663 HA GLU 663 -14.503 -8.576 -3.401 506 HB2 GLU 663 HB2 GLU 663 -16.181 -8.491 -5.949 507 HB3 GLU 663 HB3 GLU 663 -15.666 -9.962 -5.114 508 HG2 GLU 663 HG2 GLU 663 -16.914 -9.282 -3.103 509 HG3 GLU 663 HG3 GLU 663 -17.351 -7.788 -3.784 510 H LYS 664 H LYS 664 -14.340 -7.247 -6.767 511 HA LYS 664 HA LYS 664 -12.029 -8.819 -7.359 512 HB2 LYS 664 HB2 LYS 664 -11.894 -7.789 -9.451 513 HB3 LYS 664 HB3 LYS 664 -13.596 -7.922 -9.076 514 HG2 LYS 664 HG2 LYS 664 -13.842 -5.789 -9.577 515 HG3 LYS 664 HG3 LYS 664 -12.921 -5.335 -8.171 516 HD2 LYS 664 HD2 LYS 664 -11.800 -5.771 -10.968 517 HD3 LYS 664 HD3 LYS 664 -12.231 -4.238 -10.241 518 HE2 LYS 664 HE2 LYS 664 -9.941 -4.236 -10.093 519 HE3 LYS 664 HE3 LYS 664 -10.451 -4.648 -8.457 520 HZ1 LYS 664 HZ1 LYS 664 -9.644 -6.709 -10.418 521 HZ2 LYS 664 HZ2 LYS 664 -9.691 -6.828 -8.755 522 HZ3 LYS 664 HZ3 LYS 664 -8.538 -5.939 -9.498 523 H LEU 665 H LEU 665 -12.319 -5.521 -5.962 524 HA LEU 665 HA LEU 665 -9.503 -4.956 -6.305 525 HB2 LEU 665 HB2 LEU 665 -11.644 -3.633 -4.612 526 HB3 LEU 665 HB3 LEU 665 -9.968 -3.122 -4.597 527 HG LEU 665 HG LEU 665 -11.508 -3.238 -7.212 528 HD11 LEU 665 HD11 LEU 665 -12.039 -0.893 -7.013 529 HD12 LEU 665 HD12 LEU 665 -11.204 -0.770 -5.455 530 HD13 LEU 665 HD13 LEU 665 -12.701 -1.719 -5.593 531 HD21 LEU 665 HD21 LEU 665 -9.832 -1.590 -7.938 532 HD22 LEU 665 HD22 LEU 665 -9.023 -3.057 -7.364 533 HD23 LEU 665 HD23 LEU 665 -9.079 -1.615 -6.334 534 H LEU 666 H LEU 666 -11.484 -6.097 -3.426 535 HA LEU 666 HA LEU 666 -9.247 -6.314 -1.686 536 HB2 LEU 666 HB2 LEU 666 -11.803 -7.956 -1.926 537 HB3 LEU 666 HB3 LEU 666 -10.605 -8.266 -0.687 538 HG LEU 666 HG LEU 666 -11.963 -5.553 -0.963 539 HD11 LEU 666 HD11 LEU 666 -13.356 -6.297 0.943 540 HD12 LEU 666 HD12 LEU 666 -12.628 -7.922 0.829 541 HD13 LEU 666 HD13 LEU 666 -13.630 -7.300 -0.492 542 HD21 LEU 666 HD21 LEU 666 -9.779 -5.560 0.245 543 HD22 LEU 666 HD22 LEU 666 -10.390 -6.839 1.319 544 HD23 LEU 666 HD23 LEU 666 -11.137 -5.227 1.308 545 H THR 667 H THR 667 -10.560 -8.599 -4.111 546 HA THR 667 HA THR 667 -8.648 -10.625 -3.738 547 HB THR 667 HB THR 667 -10.133 -9.759 -6.234 548 HG1 THR 667 HG1 THR 667 -11.559 -10.402 -4.814 549 HG21 THR 667 HG21 THR 667 -8.223 -11.089 -6.934 550 HG22 THR 667 HG22 THR 667 -9.691 -12.065 -7.036 551 HG23 THR 667 HG23 THR 667 -8.552 -12.304 -5.682 552 H ASP 668 H ASP 668 -8.467 -7.745 -5.917 553 HA ASP 668 HA ASP 668 -5.964 -8.259 -7.098 554 HB2 ASP 668 HB2 ASP 668 -7.920 -6.389 -7.308 555 HB3 ASP 668 HB3 ASP 668 -6.767 -5.447 -6.400 556 H MET 669 H MET 669 -6.878 -6.493 -4.151 557 HA MET 669 HA MET 669 -4.331 -5.650 -3.393 558 HB2 MET 669 HB2 MET 669 -6.847 -6.169 -1.741 559 HB3 MET 669 HB3 MET 669 -5.398 -5.415 -1.098 560 HG2 MET 669 HG2 MET 669 -5.820 -3.943 -3.390 561 HG3 MET 669 HG3 MET 669 -7.453 -4.270 -2.867 562 HE1 MET 669 HE1 MET 669 -6.692 -1.379 -3.086 563 HE2 MET 669 HE2 MET 669 -5.803 -0.624 -1.739 564 HE3 MET 669 HE3 MET 669 -4.966 -1.738 -2.835 565 H ARG 670 H ARG 670 -6.112 -8.564 -2.201 566 HA ARG 670 HA ARG 670 -3.868 -9.432 -0.640 567 HB2 ARG 670 HB2 ARG 670 -5.052 -11.503 -0.249 568 HB3 ARG 670 HB3 ARG 670 -6.209 -10.188 -0.200 569 HG2 ARG 670 HG2 ARG 670 -7.067 -10.638 -2.316 570 HG3 ARG 670 HG3 ARG 670 -5.772 -11.731 -2.774 571 HD2 ARG 670 HD2 ARG 670 -6.558 -13.467 -1.414 572 HD3 ARG 670 HD3 ARG 670 -7.627 -12.374 -0.499 573 HE ARG 670 HE ARG 670 -8.183 -12.392 -3.336 574 HH11 ARG 670 HH11 ARG 670 -8.716 -14.420 -0.507 575 HH12 ARG 670 HH12 ARG 670 -10.421 -14.641 -0.795 576 HH21 ARG 670 HH21 ARG 670 -10.501 -12.541 -3.722 577 HH22 ARG 670 HH22 ARG 670 -11.398 -13.625 -2.723 578 H LYS 671 H LYS 671 -4.550 -9.675 -4.061 579 HA LYS 671 HA LYS 671 -2.656 -11.899 -4.355 580 HB2 LYS 671 HB2 LYS 671 -4.872 -11.472 -5.672 581 HB3 LYS 671 HB3 LYS 671 -3.891 -10.380 -6.668 582 HG2 LYS 671 HG2 LYS 671 -2.351 -12.345 -7.099 583 HG3 LYS 671 HG3 LYS 671 -3.416 -13.345 -6.088 584 HD2 LYS 671 HD2 LYS 671 -5.322 -12.795 -7.655 585 HD3 LYS 671 HD3 LYS 671 -4.146 -11.980 -8.715 586 HE2 LYS 671 HE2 LYS 671 -2.850 -14.113 -8.853 587 HE3 LYS 671 HE3 LYS 671 -4.061 -14.900 -7.824 588 HZ1 LYS 671 HZ1 LYS 671 -4.454 -15.360 -10.138 589 HZ2 LYS 671 HZ2 LYS 671 -4.563 -13.760 -10.501 590 HZ3 LYS 671 HZ3 LYS 671 -5.700 -14.469 -9.540 591 H SER 672 H SER 672 -2.730 -8.395 -4.937 592 HA SER 672 HA SER 672 -0.027 -8.293 -6.000 593 HB2 SER 672 HB2 SER 672 -1.771 -6.630 -6.614 594 HB3 SER 672 HB3 SER 672 -1.844 -6.095 -4.924 595 HG SER 672 HG SER 672 0.595 -5.893 -5.283 596 H GLY 673 H GLY 673 -1.401 -8.414 -2.720 597 HA2 GLY 673 HA2 GLY 673 -0.000 -9.075 -0.926 598 HA3 GLY 673 HA3 GLY 673 1.417 -8.421 -1.760 599 H ILE 674 H ILE 674 -1.484 -6.523 -1.730 600 HA ILE 674 HA ILE 674 -0.438 -4.378 -0.060 601 HB ILE 674 HB ILE 674 -3.306 -5.006 -0.734 602 HG12 ILE 674 HG12 ILE 674 -2.226 -5.089 -2.896 603 HG13 ILE 674 HG13 ILE 674 -3.459 -3.855 -2.692 604 HG21 ILE 674 HG21 ILE 674 -3.580 -2.513 -0.625 605 HG22 ILE 674 HG22 ILE 674 -2.988 -3.206 0.891 606 HG23 ILE 674 HG23 ILE 674 -1.863 -2.375 -0.199 607 HD11 ILE 674 HD11 ILE 674 -1.663 -3.115 -4.077 608 HD12 ILE 674 HD12 ILE 674 -1.844 -2.109 -2.629 609 HD13 ILE 674 HD13 ILE 674 -0.510 -3.314 -2.726 610 H ILE 675 H ILE 675 -2.727 -7.124 0.164 611 HA ILE 675 HA ILE 675 -2.774 -7.046 3.134 612 HB ILE 675 HB ILE 675 -5.122 -7.229 3.184 613 HG12 ILE 675 HG12 ILE 675 -5.091 -7.276 0.180 614 HG13 ILE 675 HG13 ILE 675 -5.522 -8.602 1.253 615 HG21 ILE 675 HG21 ILE 675 -5.585 -5.031 2.936 616 HG22 ILE 675 HG22 ILE 675 -3.895 -4.856 2.556 617 HG23 ILE 675 HG23 ILE 675 -5.032 -4.957 1.243 618 HD11 ILE 675 HD11 ILE 675 -7.107 -6.039 0.855 619 HD12 ILE 675 HD12 ILE 675 -7.514 -7.653 0.281 620 HD13 ILE 675 HD13 ILE 675 -7.503 -7.322 2.025 621 H TYR 676 H TYR 676 -3.919 -9.146 3.851 622 HA TYR 676 HA TYR 676 -3.697 -11.349 1.915 623 HB2 TYR 676 HB2 TYR 676 -3.243 -12.866 3.852 624 HB3 TYR 676 HB3 TYR 676 -1.899 -11.873 3.303 625 HD1 TYR 676 HD2 TYR 676 -4.355 -12.361 6.072 626 HD2 TYR 676 HD1 TYR 676 -0.730 -10.421 4.782 627 HE1 TYR 676 HE2 TYR 676 -3.737 -11.980 8.423 628 HE2 TYR 676 HE1 TYR 676 -0.105 -10.000 7.138 629 HH TYR 676 HH TYR 676 -1.884 -11.450 9.833 630 H GLU 677 H GLU 677 -5.360 -13.223 3.000 631 HA GLU 677 HA GLU 677 -7.255 -11.665 4.547 632 HB2 GLU 677 HB2 GLU 677 -9.143 -12.615 3.788 633 HB3 GLU 677 HB3 GLU 677 -8.197 -12.200 2.356 634 HG2 GLU 677 HG2 GLU 677 -8.589 -14.953 3.532 635 HG3 GLU 677 HG3 GLU 677 -9.393 -14.265 2.112 636 H ALA 678 H ALA 678 -6.174 -15.006 4.166 637 HA ALA 678 HA ALA 678 -5.700 -16.609 5.691 638 HB1 ALA 678 HB1 ALA 678 -4.144 -14.905 6.597 639 HB2 ALA 678 HB2 ALA 678 -5.402 -14.380 7.738 640 HB3 ALA 678 HB3 ALA 678 -4.750 -16.019 7.846 641 H LYS 679 H LYS 679 -8.442 -14.554 6.515 642 HA LYS 679 HA LYS 679 -9.710 -16.959 7.728 643 HB2 LYS 679 HB2 LYS 679 -10.078 -14.035 8.533 644 HB3 LYS 679 HB3 LYS 679 -11.133 -15.350 9.046 645 HG2 LYS 679 HG2 LYS 679 -8.923 -16.457 9.953 646 HG3 LYS 679 HG3 LYS 679 -8.258 -14.817 9.821 647 HD2 LYS 679 HD2 LYS 679 -10.247 -14.024 11.228 648 HD3 LYS 679 HD3 LYS 679 -10.680 -15.732 11.437 649 HE2 LYS 679 HE2 LYS 679 -8.277 -16.053 12.347 650 HE3 LYS 679 HE3 LYS 679 -8.179 -14.285 12.386 651 HZ1 LYS 679 HZ1 LYS 679 -8.907 -14.861 14.517 652 HZ2 LYS 679 HZ2 LYS 679 -10.015 -15.988 13.968 653 HZ3 LYS 679 HZ3 LYS 679 -10.201 -14.340 13.852 654 HA PRO 680 HA PRO 680 -12.711 -16.317 4.497 655 HB2 PRO 680 HB2 PRO 680 -15.058 -17.188 5.642 656 HB3 PRO 680 HB3 PRO 680 -13.751 -18.287 5.102 657 HG2 PRO 680 HG2 PRO 680 -14.273 -17.242 7.902 658 HG3 PRO 680 HG3 PRO 680 -13.938 -18.930 7.393 659 HD2 PRO 680 HD2 PRO 680 -11.986 -17.328 8.386 660 HD3 PRO 680 HD3 PRO 680 -11.642 -18.461 7.046 661 H GLU 681 H GLU 681 -13.874 -14.628 3.826 662 HA GLU 681 HA GLU 681 -14.668 -12.510 3.742 663 HB2 GLU 681 HB2 GLU 681 -16.391 -13.663 5.957 664 HB3 GLU 681 HB3 GLU 681 -16.740 -12.172 5.068 665 HG2 GLU 681 HG2 GLU 681 -16.729 -13.455 2.927 666 HG3 GLU 681 HG3 GLU 681 -16.532 -14.951 3.850 667 H CYS 682 H CYS 682 -12.271 -12.779 5.649 668 HA CYS 682 HA CYS 682 -12.578 -10.093 6.815 669 HB2 CYS 682 HB2 CYS 682 -13.385 -11.849 8.445 670 HB3 CYS 682 HB3 CYS 682 -11.796 -12.583 8.401 671 H TYR 683 H TYR 683 -10.950 -9.010 5.911 672 HA TYR 683 HA TYR 683 -8.545 -10.585 5.245 673 HB2 TYR 683 HB2 TYR 683 -9.641 -8.234 3.687 674 HB3 TYR 683 HB3 TYR 683 -8.165 -9.116 3.346 675 HD1 TYR 683 HD1 TYR 683 -11.453 -10.904 3.947 676 HD2 TYR 683 HD2 TYR 683 -8.570 -9.479 1.075 677 HE1 TYR 683 HE1 TYR 683 -12.549 -12.208 2.226 678 HE2 TYR 683 HE2 TYR 683 -9.722 -10.746 -0.697 679 HH TYR 683 HH TYR 683 -12.769 -12.523 -0.061 680 H LYS 684 H LYS 684 -6.373 -9.270 5.149 681 HA LYS 684 HA LYS 684 -6.596 -6.913 6.956 682 HB2 LYS 684 HB2 LYS 684 -6.645 -8.919 8.352 683 HB3 LYS 684 HB3 LYS 684 -5.163 -9.511 7.640 684 HG2 LYS 684 HG2 LYS 684 -4.929 -6.742 8.712 685 HG3 LYS 684 HG3 LYS 684 -5.447 -7.909 9.939 686 HD2 LYS 684 HD2 LYS 684 -3.570 -9.312 9.595 687 HD3 LYS 684 HD3 LYS 684 -3.133 -8.516 8.076 688 HE2 LYS 684 HE2 LYS 684 -2.621 -6.428 9.439 689 HE3 LYS 684 HE3 LYS 684 -2.783 -7.444 10.889 690 HZ1 LYS 684 HZ1 LYS 684 -1.073 -8.918 9.675 691 HZ2 LYS 684 HZ2 LYS 684 -0.500 -7.471 10.269 692 HZ3 LYS 684 HZ3 LYS 684 -0.779 -7.651 8.689 693 H LYS 685 H LYS 685 -5.089 -5.449 6.608 694 HA LYS 685 HA LYS 685 -3.330 -5.407 4.390 695 HB2 LYS 685 HB2 LYS 685 -4.240 -3.377 5.453 696 HB3 LYS 685 HB3 LYS 685 -3.467 -3.825 6.975 697 HG2 LYS 685 HG2 LYS 685 -2.055 -2.227 6.221 698 HG3 LYS 685 HG3 LYS 685 -1.238 -3.670 5.688 699 HD2 LYS 685 HD2 LYS 685 -0.970 -2.417 3.826 700 HD3 LYS 685 HD3 LYS 685 -2.464 -3.243 3.408 701 HE2 LYS 685 HE2 LYS 685 -2.522 -0.853 2.855 702 HE3 LYS 685 HE3 LYS 685 -3.782 -1.297 4.029 703 HZ1 LYS 685 HZ1 LYS 685 -1.226 -0.185 4.956 704 HZ2 LYS 685 HZ2 LYS 685 -2.701 -0.253 5.717 705 HZ3 LYS 685 HZ3 LYS 685 -2.458 0.815 4.517 706 H VAL 686 H VAL 686 -1.099 -5.850 4.159 707 HA VAL 686 HA VAL 686 -0.298 -8.117 5.573 708 HB VAL 686 HB VAL 686 2.008 -7.720 4.713 709 HG11 VAL 686 HG11 VAL 686 -0.244 -7.508 2.678 710 HG12 VAL 686 HG12 VAL 686 1.400 -8.077 2.361 711 HG13 VAL 686 HG13 VAL 686 0.347 -8.996 3.437 712 HG21 VAL 686 HG21 VAL 686 0.822 -5.224 3.421 713 HG22 VAL 686 HG22 VAL 686 2.100 -5.270 4.647 714 HG23 VAL 686 HG23 VAL 686 2.389 -5.954 3.039 Start of MODEL 20 1 H1 GLY 600 H1 GLY 600 -0.073 4.225 7.573 2 H2 GLY 600 H2 GLY 600 -1.115 4.264 6.311 3 H3 GLY 600 H3 GLY 600 -0.672 2.808 6.966 4 HA2 GLY 600 HA2 GLY 600 1.620 3.194 6.255 5 HA3 GLY 600 HA3 GLY 600 0.477 3.141 4.895 6 H SER 601 H SER 601 3.075 4.514 4.868 7 HA SER 601 HA SER 601 2.206 7.168 4.070 8 HB2 SER 601 HB2 SER 601 3.776 8.326 5.544 9 HB3 SER 601 HB3 SER 601 2.630 7.401 6.514 10 HG SER 601 HG SER 601 4.398 5.679 6.428 11 H HIS 602 H HIS 602 5.092 8.008 3.993 12 HA HIS 602 HA HIS 602 6.176 6.390 1.818 13 HB2 HIS 602 HB2 HIS 602 6.523 8.909 2.257 14 HB3 HIS 602 HB3 HIS 602 7.635 8.426 3.538 15 HD1 HIS 602 HD1 HIS 602 8.911 5.976 1.664 16 HD2 HIS 602 HD2 HIS 602 8.415 10.069 0.789 17 HE1 HIS 602 HE1 HIS 602 10.623 6.565 -0.170 18 H MET 603 H MET 603 5.952 6.089 5.242 19 HA MET 603 HA MET 603 7.815 3.788 5.178 20 HB2 MET 603 HB2 MET 603 7.292 5.675 7.513 21 HB3 MET 603 HB3 MET 603 8.194 4.156 7.610 22 HG2 MET 603 HG2 MET 603 9.789 5.043 5.891 23 HG3 MET 603 HG3 MET 603 8.976 6.605 5.987 24 HE1 MET 603 HE1 MET 603 9.852 7.831 9.604 25 HE2 MET 603 HE2 MET 603 9.045 8.214 8.066 26 HE3 MET 603 HE3 MET 603 8.375 6.961 9.141 27 H GLY 604 H GLY 604 7.156 2.132 6.782 28 HA2 GLY 604 HA2 GLY 604 5.288 0.918 7.858 29 HA3 GLY 604 HA3 GLY 604 4.196 1.730 6.712 30 H GLU 605 H GLU 605 6.482 -0.858 7.163 31 HA GLU 605 HA GLU 605 7.656 -2.250 5.889 32 HB2 GLU 605 HB2 GLU 605 4.942 -2.670 4.628 33 HB3 GLU 605 HB3 GLU 605 6.197 -3.861 4.977 34 HG2 GLU 605 HG2 GLU 605 4.326 -2.459 6.902 35 HG3 GLU 605 HG3 GLU 605 4.553 -4.185 6.652 36 H SER 606 H SER 606 7.644 0.405 4.602 37 HA SER 606 HA SER 606 7.058 0.137 1.844 38 HB2 SER 606 HB2 SER 606 8.353 2.363 3.466 39 HB3 SER 606 HB3 SER 606 7.716 2.545 1.835 40 HG SER 606 HG SER 606 5.893 1.460 3.686 41 H GLY 607 H GLY 607 9.012 -1.710 2.261 42 HA2 GLY 607 HA2 GLY 607 11.597 -1.642 2.269 43 HA3 GLY 607 HA3 GLY 607 10.817 -2.545 0.973 44 H LYS 608 H LYS 608 10.190 -0.955 -0.968 45 HA LYS 608 HA LYS 608 11.867 1.394 -1.121 46 HB2 LYS 608 HB2 LYS 608 13.033 -0.647 -2.349 47 HB3 LYS 608 HB3 LYS 608 11.913 -0.282 -3.647 48 HG2 LYS 608 HG2 LYS 608 13.942 1.655 -2.396 49 HG3 LYS 608 HG3 LYS 608 14.179 0.720 -3.862 50 HD2 LYS 608 HD2 LYS 608 13.666 2.806 -4.706 51 HD3 LYS 608 HD3 LYS 608 12.139 1.940 -4.833 52 HE2 LYS 608 HE2 LYS 608 11.951 3.093 -2.311 53 HE3 LYS 608 HE3 LYS 608 12.920 4.302 -3.160 54 HZ1 LYS 608 HZ1 LYS 608 11.128 4.468 -4.787 55 HZ2 LYS 608 HZ2 LYS 608 10.516 4.673 -3.282 56 HZ3 LYS 608 HZ3 LYS 608 10.324 3.218 -4.031 57 H ILE 609 H ILE 609 9.284 1.274 -0.446 58 HA ILE 609 HA ILE 609 7.664 1.743 -2.914 59 HB ILE 609 HB ILE 609 6.646 1.017 -0.151 60 HG12 ILE 609 HG12 ILE 609 7.767 -0.975 -0.893 61 HG13 ILE 609 HG13 ILE 609 6.046 -1.216 -1.091 62 HG21 ILE 609 HG21 ILE 609 4.510 0.564 -1.359 63 HG22 ILE 609 HG22 ILE 609 4.998 2.255 -1.410 64 HG23 ILE 609 HG23 ILE 609 5.233 1.232 -2.839 65 HD11 ILE 609 HD11 ILE 609 6.274 -0.753 -3.546 66 HD12 ILE 609 HD12 ILE 609 8.028 -0.574 -3.326 67 HD13 ILE 609 HD13 ILE 609 7.255 -2.127 -2.996 68 H ASP 610 H ASP 610 6.523 3.652 -3.021 69 HA ASP 610 HA ASP 610 6.454 5.487 -0.812 70 HB2 ASP 610 HB2 ASP 610 6.957 6.998 -3.258 71 HB3 ASP 610 HB3 ASP 610 7.551 7.234 -1.651 72 H ILE 611 H ILE 611 4.738 7.226 -1.605 73 HA ILE 611 HA ILE 611 2.560 5.708 -2.914 74 HB ILE 611 HB ILE 611 2.725 8.469 -1.657 75 HG12 ILE 611 HG12 ILE 611 0.959 6.310 -0.532 76 HG13 ILE 611 HG13 ILE 611 2.681 6.017 -0.366 77 HG21 ILE 611 HG21 ILE 611 0.214 8.464 -1.736 78 HG22 ILE 611 HG22 ILE 611 0.974 8.605 -3.324 79 HG23 ILE 611 HG23 ILE 611 0.292 7.046 -2.810 80 HD11 ILE 611 HD11 ILE 611 1.286 8.546 0.565 81 HD12 ILE 611 HD12 ILE 611 1.818 7.187 1.587 82 HD13 ILE 611 HD13 ILE 611 3.021 8.173 0.729 83 H ASP 612 H ASP 612 4.738 8.377 -3.589 84 HA ASP 612 HA ASP 612 3.253 9.545 -5.803 85 HB2 ASP 612 HB2 ASP 612 4.823 10.895 -4.483 86 HB3 ASP 612 HB3 ASP 612 6.171 9.862 -4.985 87 H THR 613 H THR 613 5.959 7.419 -5.372 88 HA THR 613 HA THR 613 6.968 6.800 -7.843 89 HB THR 613 HB THR 613 7.007 6.034 -5.137 90 HG1 THR 613 HG1 THR 613 8.893 5.909 -5.414 91 HG21 THR 613 HG21 THR 613 7.356 3.731 -4.961 92 HG22 THR 613 HG22 THR 613 6.838 3.477 -6.656 93 HG23 THR 613 HG23 THR 613 5.706 4.106 -5.436 94 H ILE 614 H ILE 614 3.815 6.036 -6.645 95 HA ILE 614 HA ILE 614 3.363 4.087 -8.838 96 HB ILE 614 HB ILE 614 1.364 4.379 -6.622 97 HG12 ILE 614 HG12 ILE 614 3.896 2.749 -6.194 98 HG13 ILE 614 HG13 ILE 614 3.479 4.263 -5.368 99 HG21 ILE 614 HG21 ILE 614 1.107 2.896 -8.678 100 HG22 ILE 614 HG22 ILE 614 2.490 1.957 -8.111 101 HG23 ILE 614 HG23 ILE 614 1.008 1.997 -7.148 102 HD11 ILE 614 HD11 ILE 614 1.513 3.279 -4.373 103 HD12 ILE 614 HD12 ILE 614 1.952 1.694 -5.085 104 HD13 ILE 614 HD13 ILE 614 3.024 2.475 -3.908 105 H MET 615 H MET 615 1.793 6.863 -7.088 106 HA MET 615 HA MET 615 -0.308 6.969 -9.162 107 HB2 MET 615 HB2 MET 615 -1.293 8.689 -7.814 108 HB3 MET 615 HB3 MET 615 -0.805 7.329 -6.807 109 HG2 MET 615 HG2 MET 615 -0.314 9.235 -5.545 110 HG3 MET 615 HG3 MET 615 1.223 8.635 -6.119 111 HE1 MET 615 HE1 MET 615 -0.774 12.537 -7.613 112 HE2 MET 615 HE2 MET 615 -1.384 10.958 -8.143 113 HE3 MET 615 HE3 MET 615 -1.494 11.430 -6.423 114 H THR 616 H THR 616 2.800 8.412 -8.908 115 HA THR 616 HA THR 616 2.296 10.530 -10.825 116 HB THR 616 HB THR 616 4.287 10.168 -9.222 117 HG1 THR 616 HG1 THR 616 5.392 11.494 -10.327 118 HG21 THR 616 HG21 THR 616 6.233 9.029 -10.021 119 HG22 THR 616 HG22 THR 616 5.480 8.662 -11.590 120 HG23 THR 616 HG23 THR 616 4.913 7.854 -10.116 121 H GLY 617 H GLY 617 2.386 7.081 -10.943 122 HA2 GLY 617 HA2 GLY 617 2.838 6.816 -13.830 123 HA3 GLY 617 HA3 GLY 617 2.714 5.545 -12.589 124 H LYS 618 H LYS 618 0.422 5.898 -11.346 125 HA LYS 618 HA LYS 618 -1.473 5.096 -13.462 126 HB2 LYS 618 HB2 LYS 618 -2.867 4.317 -11.543 127 HB3 LYS 618 HB3 LYS 618 -1.278 3.533 -11.686 128 HG2 LYS 618 HG2 LYS 618 -0.511 5.011 -9.855 129 HG3 LYS 618 HG3 LYS 618 -2.159 5.649 -9.684 130 HD2 LYS 618 HD2 LYS 618 -2.934 3.388 -9.114 131 HD3 LYS 618 HD3 LYS 618 -1.304 2.732 -9.421 132 HE2 LYS 618 HE2 LYS 618 -0.357 4.198 -7.716 133 HE3 LYS 618 HE3 LYS 618 -1.920 4.957 -7.436 134 HZ1 LYS 618 HZ1 LYS 618 -2.745 2.773 -6.679 135 HZ2 LYS 618 HZ2 LYS 618 -1.474 3.279 -5.756 136 HZ3 LYS 618 HZ3 LYS 618 -1.256 2.118 -6.899 137 HA PRO 619 HA PRO 619 -3.578 8.802 -13.196 138 HB2 PRO 619 HB2 PRO 619 -6.174 8.248 -14.023 139 HB3 PRO 619 HB3 PRO 619 -4.757 8.116 -15.110 140 HG2 PRO 619 HG2 PRO 619 -6.095 5.903 -13.519 141 HG3 PRO 619 HG3 PRO 619 -5.642 5.895 -15.254 142 HD2 PRO 619 HD2 PRO 619 -4.073 4.788 -13.315 143 HD3 PRO 619 HD3 PRO 619 -3.352 5.585 -14.736 144 H LYS 620 H LYS 620 -5.350 10.081 -12.081 145 HA LYS 620 HA LYS 620 -5.156 9.627 -9.391 146 HB2 LYS 620 HB2 LYS 620 -6.567 11.361 -8.901 147 HB3 LYS 620 HB3 LYS 620 -5.778 11.815 -10.403 148 HG2 LYS 620 HG2 LYS 620 -7.798 11.481 -11.669 149 HG3 LYS 620 HG3 LYS 620 -8.580 10.601 -10.347 150 HD2 LYS 620 HD2 LYS 620 -8.552 12.638 -8.931 151 HD3 LYS 620 HD3 LYS 620 -7.961 13.550 -10.341 152 HE2 LYS 620 HE2 LYS 620 -10.073 13.738 -11.065 153 HE3 LYS 620 HE3 LYS 620 -10.090 11.983 -11.314 154 HZ1 LYS 620 HZ1 LYS 620 -10.881 13.257 -8.762 155 HZ2 LYS 620 HZ2 LYS 620 -10.929 11.683 -9.078 156 HZ3 LYS 620 HZ3 LYS 620 -11.931 12.676 -9.905 157 H SER 621 H SER 621 -7.817 8.461 -11.447 158 HA SER 621 HA SER 621 -9.697 7.867 -9.484 159 HB2 SER 621 HB2 SER 621 -10.482 6.252 -11.350 160 HB3 SER 621 HB3 SER 621 -10.405 7.990 -11.693 161 HG SER 621 HG SER 621 -9.447 6.680 -13.349 162 H ALA 622 H ALA 622 -6.780 6.099 -10.513 163 HA ALA 622 HA ALA 622 -7.509 3.516 -9.495 164 HB1 ALA 622 HB1 ALA 622 -4.748 4.757 -9.869 165 HB2 ALA 622 HB2 ALA 622 -5.124 3.027 -9.647 166 HB3 ALA 622 HB3 ALA 622 -5.667 3.876 -11.105 167 H ARG 623 H ARG 623 -5.275 5.999 -8.049 168 HA ARG 623 HA ARG 623 -5.424 4.809 -5.415 169 HB2 ARG 623 HB2 ARG 623 -4.426 6.877 -4.585 170 HB3 ARG 623 HB3 ARG 623 -3.546 6.281 -5.985 171 HG2 ARG 623 HG2 ARG 623 -4.467 7.974 -7.401 172 HG3 ARG 623 HG3 ARG 623 -5.652 8.461 -6.184 173 HD2 ARG 623 HD2 ARG 623 -2.664 8.769 -5.810 174 HD3 ARG 623 HD3 ARG 623 -3.704 10.031 -6.469 175 HE ARG 623 HE ARG 623 -3.340 9.327 -3.728 176 HH11 ARG 623 HH11 ARG 623 -5.842 10.558 -5.912 177 HH12 ARG 623 HH12 ARG 623 -6.723 11.395 -4.683 178 HH21 ARG 623 HH21 ARG 623 -4.519 10.411 -2.071 179 HH22 ARG 623 HH22 ARG 623 -5.946 11.292 -2.456 180 H GLU 624 H GLU 624 -7.446 7.313 -6.967 181 HA GLU 624 HA GLU 624 -8.887 8.178 -4.741 182 HB2 GLU 624 HB2 GLU 624 -8.859 9.047 -7.028 183 HB3 GLU 624 HB3 GLU 624 -9.746 7.605 -7.559 184 HG2 GLU 624 HG2 GLU 624 -11.766 8.362 -6.749 185 HG3 GLU 624 HG3 GLU 624 -10.967 9.430 -5.583 186 H LYS 625 H LYS 625 -9.406 5.232 -6.693 187 HA LYS 625 HA LYS 625 -11.669 4.338 -5.028 188 HB2 LYS 625 HB2 LYS 625 -10.084 3.000 -7.262 189 HB3 LYS 625 HB3 LYS 625 -11.493 2.277 -6.478 190 HG2 LYS 625 HG2 LYS 625 -12.996 3.898 -7.375 191 HG3 LYS 625 HG3 LYS 625 -11.704 5.023 -7.764 192 HD2 LYS 625 HD2 LYS 625 -12.268 4.186 -9.852 193 HD3 LYS 625 HD3 LYS 625 -10.810 3.309 -9.425 194 HE2 LYS 625 HE2 LYS 625 -12.263 1.688 -10.351 195 HE3 LYS 625 HE3 LYS 625 -12.313 1.407 -8.605 196 HZ1 LYS 625 HZ1 LYS 625 -14.400 2.616 -8.546 197 HZ2 LYS 625 HZ2 LYS 625 -14.510 1.372 -9.626 198 HZ3 LYS 625 HZ3 LYS 625 -14.327 2.909 -10.166 199 H MET 626 H MET 626 -8.251 3.290 -5.580 200 HA MET 626 HA MET 626 -8.386 0.962 -3.945 201 HB2 MET 626 HB2 MET 626 -6.077 2.728 -4.821 202 HB3 MET 626 HB3 MET 626 -5.850 1.220 -3.950 203 HG2 MET 626 HG2 MET 626 -6.888 -0.029 -5.809 204 HG3 MET 626 HG3 MET 626 -7.177 1.474 -6.668 205 HE1 MET 626 HE1 MET 626 -3.110 -0.643 -6.060 206 HE2 MET 626 HE2 MET 626 -4.042 -0.056 -4.667 207 HE3 MET 626 HE3 MET 626 -4.720 -1.311 -5.731 208 H MET 627 H MET 627 -7.247 4.308 -3.296 209 HA MET 627 HA MET 627 -6.245 3.838 -0.722 210 HB2 MET 627 HB2 MET 627 -7.315 6.403 -1.955 211 HB3 MET 627 HB3 MET 627 -6.496 6.322 -0.413 212 HG2 MET 627 HG2 MET 627 -5.217 5.423 -3.020 213 HG3 MET 627 HG3 MET 627 -5.028 7.021 -2.308 214 HE1 MET 627 HE1 MET 627 -2.421 6.915 -2.313 215 HE2 MET 627 HE2 MET 627 -1.488 5.515 -1.741 216 HE3 MET 627 HE3 MET 627 -2.549 5.353 -3.160 217 H LYS 628 H LYS 628 -9.424 4.683 -1.966 218 HA LYS 628 HA LYS 628 -10.534 5.250 0.659 219 HB2 LYS 628 HB2 LYS 628 -11.673 5.063 -2.102 220 HB3 LYS 628 HB3 LYS 628 -12.798 4.683 -0.798 221 HG2 LYS 628 HG2 LYS 628 -11.063 7.184 -0.776 222 HG3 LYS 628 HG3 LYS 628 -12.687 7.136 -1.476 223 HD2 LYS 628 HD2 LYS 628 -13.685 6.519 0.650 224 HD3 LYS 628 HD3 LYS 628 -12.127 6.374 1.450 225 HE2 LYS 628 HE2 LYS 628 -12.944 8.931 0.073 226 HE3 LYS 628 HE3 LYS 628 -13.520 8.560 1.712 227 HZ1 LYS 628 HZ1 LYS 628 -10.617 8.436 1.131 228 HZ2 LYS 628 HZ2 LYS 628 -11.282 8.520 2.524 229 HZ3 LYS 628 HZ3 LYS 628 -11.354 9.875 1.579 230 H ILE 629 H ILE 629 -10.587 2.381 -1.458 231 HA ILE 629 HA ILE 629 -12.093 0.736 0.278 232 HB ILE 629 HB ILE 629 -9.886 0.073 -1.691 233 HG12 ILE 629 HG12 ILE 629 -12.851 -0.542 -1.961 234 HG13 ILE 629 HG13 ILE 629 -12.274 1.080 -2.318 235 HG21 ILE 629 HG21 ILE 629 -9.937 -1.785 -0.113 236 HG22 ILE 629 HG22 ILE 629 -11.712 -1.860 -0.189 237 HG23 ILE 629 HG23 ILE 629 -10.726 -2.294 -1.601 238 HD11 ILE 629 HD11 ILE 629 -12.362 -0.235 -4.343 239 HD12 ILE 629 HD12 ILE 629 -10.686 0.223 -3.982 240 HD13 ILE 629 HD13 ILE 629 -11.237 -1.430 -3.654 241 H ILE 630 H ILE 630 -8.503 1.134 0.145 242 HA ILE 630 HA ILE 630 -8.138 -0.536 2.465 243 HB ILE 630 HB ILE 630 -5.843 0.325 2.659 244 HG12 ILE 630 HG12 ILE 630 -5.052 1.587 0.473 245 HG13 ILE 630 HG13 ILE 630 -6.695 2.177 0.461 246 HG21 ILE 630 HG21 ILE 630 -6.652 -0.604 -0.106 247 HG22 ILE 630 HG22 ILE 630 -5.048 -0.771 0.649 248 HG23 ILE 630 HG23 ILE 630 -6.432 -1.638 1.324 249 HD11 ILE 630 HD11 ILE 630 -4.743 2.524 2.777 250 HD12 ILE 630 HD12 ILE 630 -5.112 3.748 1.539 251 HD13 ILE 630 HD13 ILE 630 -6.352 3.251 2.673 252 H GLU 631 H GLU 631 -9.036 2.874 2.230 253 HA GLU 631 HA GLU 631 -8.257 3.640 4.882 254 HB2 GLU 631 HB2 GLU 631 -10.049 4.625 2.701 255 HB3 GLU 631 HB3 GLU 631 -10.470 5.107 4.320 256 HG2 GLU 631 HG2 GLU 631 -8.314 6.215 4.585 257 HG3 GLU 631 HG3 GLU 631 -7.794 5.639 2.992 258 H ILE 632 H ILE 632 -11.265 2.248 3.380 259 HA ILE 632 HA ILE 632 -12.644 2.020 5.873 260 HB ILE 632 HB ILE 632 -13.015 -0.164 3.849 261 HG12 ILE 632 HG12 ILE 632 -13.061 1.459 2.210 262 HG13 ILE 632 HG13 ILE 632 -14.721 1.138 2.604 263 HG21 ILE 632 HG21 ILE 632 -14.266 -0.078 5.988 264 HG22 ILE 632 HG22 ILE 632 -14.943 1.485 5.535 265 HG23 ILE 632 HG23 ILE 632 -15.339 0.029 4.596 266 HD11 ILE 632 HD11 ILE 632 -13.150 3.602 3.479 267 HD12 ILE 632 HD12 ILE 632 -14.364 3.509 2.206 268 HD13 ILE 632 HD13 ILE 632 -14.842 3.253 3.903 269 H ILE 633 H ILE 633 -10.340 -0.218 4.227 270 HA ILE 633 HA ILE 633 -10.833 -2.345 6.106 271 HB ILE 633 HB ILE 633 -8.358 -2.020 4.368 272 HG12 ILE 633 HG12 ILE 633 -11.150 -2.995 3.679 273 HG13 ILE 633 HG13 ILE 633 -10.164 -1.787 2.901 274 HG21 ILE 633 HG21 ILE 633 -9.738 -4.543 5.366 275 HG22 ILE 633 HG22 ILE 633 -8.193 -4.436 4.520 276 HG23 ILE 633 HG23 ILE 633 -8.338 -3.819 6.172 277 HD11 ILE 633 HD11 ILE 633 -9.656 -4.737 2.705 278 HD12 ILE 633 HD12 ILE 633 -10.187 -3.599 1.449 279 HD13 ILE 633 HD13 ILE 633 -8.576 -3.428 2.125 280 H ASP 634 H ASP 634 -8.271 0.176 5.883 281 HA ASP 634 HA ASP 634 -6.733 -0.739 8.051 282 HB2 ASP 634 HB2 ASP 634 -6.133 0.891 6.159 283 HB3 ASP 634 HB3 ASP 634 -6.949 2.147 7.083 284 H SER 635 H SER 635 -9.535 1.503 7.783 285 HA SER 635 HA SER 635 -9.572 2.322 10.507 286 HB2 SER 635 HB2 SER 635 -10.699 3.507 8.638 287 HB3 SER 635 HB3 SER 635 -11.827 2.154 8.456 288 HG SER 635 HG SER 635 -11.512 3.824 10.734 289 H LEU 636 H LEU 636 -11.522 -0.213 8.775 290 HA LEU 636 HA LEU 636 -12.862 -1.155 11.092 291 HB2 LEU 636 HB2 LEU 636 -12.112 -2.477 8.470 292 HB3 LEU 636 HB3 LEU 636 -13.085 -3.306 9.685 293 HG LEU 636 HG LEU 636 -13.912 -0.656 8.424 294 HD11 LEU 636 HD11 LEU 636 -14.765 -3.464 7.639 295 HD12 LEU 636 HD12 LEU 636 -13.700 -2.387 6.698 296 HD13 LEU 636 HD13 LEU 636 -15.385 -1.940 6.974 297 HD21 LEU 636 HD21 LEU 636 -15.011 -1.091 10.577 298 HD22 LEU 636 HD22 LEU 636 -15.508 -2.702 10.012 299 HD23 LEU 636 HD23 LEU 636 -16.151 -1.244 9.242 300 H ALA 637 H ALA 637 -9.695 -2.126 9.693 301 HA ALA 637 HA ALA 637 -9.259 -4.295 11.514 302 HB1 ALA 637 HB1 ALA 637 -8.132 -4.119 9.334 303 HB2 ALA 637 HB2 ALA 637 -7.279 -2.654 9.886 304 HB3 ALA 637 HB3 ALA 637 -6.957 -4.220 10.661 305 H VAL 638 H VAL 638 -8.864 -0.786 11.961 306 HA VAL 638 HA VAL 638 -6.671 -0.829 13.644 307 HB VAL 638 HB VAL 638 -8.077 1.124 12.543 308 HG11 VAL 638 HG11 VAL 638 -9.009 1.447 15.422 309 HG12 VAL 638 HG12 VAL 638 -9.363 2.481 14.025 310 HG13 VAL 638 HG13 VAL 638 -10.055 0.855 14.117 311 HG21 VAL 638 HG21 VAL 638 -6.852 2.745 13.900 312 HG22 VAL 638 HG22 VAL 638 -6.500 1.490 15.111 313 HG23 VAL 638 HG23 VAL 638 -5.838 1.362 13.464 314 H SER 639 H SER 639 -9.771 -2.025 14.417 315 HA SER 639 HA SER 639 -8.949 -2.468 17.237 316 HB2 SER 639 HB2 SER 639 -10.543 -0.578 17.181 317 HB3 SER 639 HB3 SER 639 -11.705 -1.586 16.292 318 HG SER 639 HG SER 639 -11.436 -3.082 18.107 319 H SER 640 H SER 640 -9.015 -4.187 14.591 320 HA SER 640 HA SER 640 -10.764 -6.365 15.626 321 HB2 SER 640 HB2 SER 640 -10.725 -5.526 12.708 322 HB3 SER 640 HB3 SER 640 -11.823 -6.656 13.506 323 HG SER 640 HG SER 640 -11.926 -3.933 13.236 324 H GLU 641 H GLU 641 -10.273 -8.477 14.636 325 HA GLU 641 HA GLU 641 -7.511 -9.003 14.043 326 HB2 GLU 641 HB2 GLU 641 -10.027 -10.570 13.290 327 HB3 GLU 641 HB3 GLU 641 -8.368 -11.156 13.165 328 HG2 GLU 641 HG2 GLU 641 -8.138 -10.927 15.656 329 HG3 GLU 641 HG3 GLU 641 -9.848 -10.460 15.736 330 H CYS 642 H CYS 642 -10.452 -8.507 12.040 331 HA CYS 642 HA CYS 642 -8.951 -7.651 9.758 332 HB2 CYS 642 HB2 CYS 642 -9.924 -9.461 8.277 333 HB3 CYS 642 HB3 CYS 642 -8.768 -10.045 9.466 334 H ALA 643 H ALA 643 -10.624 -7.387 7.875 335 HA ALA 643 HA ALA 643 -12.964 -5.923 8.978 336 HB1 ALA 643 HB1 ALA 643 -11.352 -5.488 6.446 337 HB2 ALA 643 HB2 ALA 643 -12.688 -4.490 7.007 338 HB3 ALA 643 HB3 ALA 643 -11.174 -4.551 7.945 339 H LYS 644 H LYS 644 -14.823 -6.958 8.632 340 HA LYS 644 HA LYS 644 -15.254 -9.081 6.811 341 HB2 LYS 644 HB2 LYS 644 -17.710 -8.571 7.292 342 HB3 LYS 644 HB3 LYS 644 -16.632 -9.016 8.637 343 HG2 LYS 644 HG2 LYS 644 -16.600 -6.338 8.912 344 HG3 LYS 644 HG3 LYS 644 -18.190 -6.574 8.130 345 HD2 LYS 644 HD2 LYS 644 -18.811 -8.195 9.895 346 HD3 LYS 644 HD3 LYS 644 -17.201 -8.033 10.608 347 HE2 LYS 644 HE2 LYS 644 -18.201 -6.530 11.941 348 HE3 LYS 644 HE3 LYS 644 -17.812 -5.451 10.588 349 HZ1 LYS 644 HZ1 LYS 644 -20.455 -6.713 10.994 350 HZ2 LYS 644 HZ2 LYS 644 -20.002 -5.619 9.807 351 HZ3 LYS 644 HZ3 LYS 644 -20.021 -5.133 11.323 352 H VAL 645 H VAL 645 -15.741 -9.180 4.732 353 HA VAL 645 HA VAL 645 -15.659 -7.135 2.861 354 HB VAL 645 HB VAL 645 -17.038 -9.813 2.968 355 HG11 VAL 645 HG11 VAL 645 -17.231 -9.729 0.448 356 HG12 VAL 645 HG12 VAL 645 -18.382 -8.730 1.320 357 HG13 VAL 645 HG13 VAL 645 -16.964 -7.971 0.547 358 HG21 VAL 645 HG21 VAL 645 -14.699 -8.849 1.301 359 HG22 VAL 645 HG22 VAL 645 -14.502 -9.638 2.876 360 HG23 VAL 645 HG23 VAL 645 -15.222 -10.526 1.523 361 H LYS 646 H LYS 646 -18.503 -8.190 4.739 362 HA LYS 646 HA LYS 646 -20.530 -6.766 3.368 363 HB2 LYS 646 HB2 LYS 646 -20.129 -7.683 6.251 364 HB3 LYS 646 HB3 LYS 646 -21.605 -6.860 5.739 365 HG2 LYS 646 HG2 LYS 646 -22.201 -8.573 4.197 366 HG3 LYS 646 HG3 LYS 646 -20.587 -9.287 4.224 367 HD2 LYS 646 HD2 LYS 646 -20.888 -10.046 6.530 368 HD3 LYS 646 HD3 LYS 646 -22.459 -9.228 6.613 369 HE2 LYS 646 HE2 LYS 646 -22.844 -11.600 6.209 370 HE3 LYS 646 HE3 LYS 646 -23.316 -10.663 4.784 371 HZ1 LYS 646 HZ1 LYS 646 -22.077 -12.543 4.035 372 HZ2 LYS 646 HZ2 LYS 646 -20.812 -12.282 5.056 373 HZ3 LYS 646 HZ3 LYS 646 -21.006 -11.285 3.883 374 H ASP 647 H ASP 647 -18.230 -5.731 6.014 375 HA ASP 647 HA ASP 647 -19.672 -3.299 6.341 376 HB2 ASP 647 HB2 ASP 647 -17.228 -4.643 7.484 377 HB3 ASP 647 HB3 ASP 647 -17.341 -2.918 7.663 378 H ILE 648 H ILE 648 -16.832 -4.428 4.586 379 HA ILE 648 HA ILE 648 -15.949 -1.831 3.723 380 HB ILE 648 HB ILE 648 -15.491 -4.474 2.264 381 HG12 ILE 648 HG12 ILE 648 -13.786 -3.311 4.514 382 HG13 ILE 648 HG13 ILE 648 -14.859 -4.646 4.714 383 HG21 ILE 648 HG21 ILE 648 -13.858 -1.888 2.409 384 HG22 ILE 648 HG22 ILE 648 -13.436 -3.320 1.460 385 HG23 ILE 648 HG23 ILE 648 -14.863 -2.391 1.035 386 HD11 ILE 648 HD11 ILE 648 -12.672 -5.544 4.466 387 HD12 ILE 648 HD12 ILE 648 -13.636 -6.006 3.057 388 HD13 ILE 648 HD13 ILE 648 -12.425 -4.714 2.930 389 H LEU 649 H LEU 649 -18.019 -4.327 2.167 390 HA LEU 649 HA LEU 649 -18.727 -2.908 -0.150 391 HB2 LEU 649 HB2 LEU 649 -20.104 -4.973 1.565 392 HB3 LEU 649 HB3 LEU 649 -20.998 -4.227 0.254 393 HG LEU 649 HG LEU 649 -18.307 -5.556 -0.223 394 HD11 LEU 649 HD11 LEU 649 -19.937 -7.188 0.767 395 HD12 LEU 649 HD12 LEU 649 -19.549 -7.565 -0.922 396 HD13 LEU 649 HD13 LEU 649 -21.095 -6.791 -0.512 397 HD21 LEU 649 HD21 LEU 649 -19.163 -4.004 -2.000 398 HD22 LEU 649 HD22 LEU 649 -20.654 -4.952 -2.091 399 HD23 LEU 649 HD23 LEU 649 -19.102 -5.682 -2.551 400 H LYS 650 H LYS 650 -20.177 -2.766 3.127 401 HA LYS 650 HA LYS 650 -22.276 -0.954 2.447 402 HB2 LYS 650 HB2 LYS 650 -22.288 -2.208 4.542 403 HB3 LYS 650 HB3 LYS 650 -20.818 -1.397 5.087 404 HG2 LYS 650 HG2 LYS 650 -22.015 0.787 5.070 405 HG3 LYS 650 HG3 LYS 650 -23.502 -0.040 4.571 406 HD2 LYS 650 HD2 LYS 650 -23.526 -1.337 6.639 407 HD3 LYS 650 HD3 LYS 650 -21.949 -0.704 7.119 408 HE2 LYS 650 HE2 LYS 650 -24.476 0.980 6.779 409 HE3 LYS 650 HE3 LYS 650 -23.844 0.358 8.314 410 HZ1 LYS 650 HZ1 LYS 650 -21.725 1.587 7.694 411 HZ2 LYS 650 HZ2 LYS 650 -23.015 2.523 8.153 412 HZ3 LYS 650 HZ3 LYS 650 -22.559 2.375 6.574 413 H GLU 651 H GLU 651 -19.087 -0.179 4.061 414 HA GLU 651 HA GLU 651 -19.763 2.603 3.822 415 HB2 GLU 651 HB2 GLU 651 -17.009 1.478 4.328 416 HB3 GLU 651 HB3 GLU 651 -17.569 3.085 4.708 417 HG2 GLU 651 HG2 GLU 651 -18.137 0.498 6.130 418 HG3 GLU 651 HG3 GLU 651 -17.502 1.992 6.774 419 H ALA 652 H ALA 652 -17.785 0.490 1.718 420 HA ALA 652 HA ALA 652 -16.790 2.684 0.142 421 HB1 ALA 652 HB1 ALA 652 -15.688 0.525 0.108 422 HB2 ALA 652 HB2 ALA 652 -17.151 -0.247 -0.523 423 HB3 ALA 652 HB3 ALA 652 -16.265 0.921 -1.524 424 H GLN 653 H GLN 653 -19.883 0.732 -0.058 425 HA GLN 653 HA GLN 653 -20.678 2.206 -2.444 426 HB2 GLN 653 HB2 GLN 653 -22.227 0.450 -0.526 427 HB3 GLN 653 HB3 GLN 653 -22.946 1.251 -1.933 428 HG2 GLN 653 HG2 GLN 653 -21.441 0.149 -3.473 429 HG3 GLN 653 HG3 GLN 653 -20.513 -0.560 -2.157 430 HE21 GLN 653 HE21 GLN 653 -21.876 -1.881 -0.588 431 HE22 GLN 653 HE22 GLN 653 -23.040 -3.012 -1.332 432 H GLN 654 H GLN 654 -21.099 2.752 1.073 433 HA GLN 654 HA GLN 654 -22.811 5.045 0.740 434 HB2 GLN 654 HB2 GLN 654 -20.774 4.516 2.952 435 HB3 GLN 654 HB3 GLN 654 -21.946 5.826 2.917 436 HG2 GLN 654 HG2 GLN 654 -23.702 3.847 2.596 437 HG3 GLN 654 HG3 GLN 654 -22.436 2.895 3.373 438 HE21 GLN 654 HE21 GLN 654 -21.526 3.894 5.613 439 HE22 GLN 654 HE22 GLN 654 -22.729 4.889 6.449 440 H VAL 655 H VAL 655 -19.229 4.741 0.675 441 HA VAL 655 HA VAL 655 -18.679 7.493 0.132 442 HB VAL 655 HB VAL 655 -17.222 4.878 -0.352 443 HG11 VAL 655 HG11 VAL 655 -16.100 7.619 -1.036 444 HG12 VAL 655 HG12 VAL 655 -15.192 6.084 -0.979 445 HG13 VAL 655 HG13 VAL 655 -16.444 6.308 -2.186 446 HG21 VAL 655 HG21 VAL 655 -17.431 5.829 1.975 447 HG22 VAL 655 HG22 VAL 655 -15.767 5.658 1.418 448 HG23 VAL 655 HG23 VAL 655 -16.547 7.260 1.425 449 H GLY 656 H GLY 656 -19.482 4.770 -2.061 450 HA2 GLY 656 HA2 GLY 656 -21.094 5.518 -3.822 451 HA3 GLY 656 HA3 GLY 656 -19.955 6.795 -4.235 452 H ILE 657 H ILE 657 -18.454 3.756 -3.440 453 HA ILE 657 HA ILE 657 -17.823 3.187 -6.270 454 HB ILE 657 HB ILE 657 -17.067 1.783 -3.675 455 HG12 ILE 657 HG12 ILE 657 -15.089 3.351 -5.363 456 HG13 ILE 657 HG13 ILE 657 -16.107 4.239 -4.245 457 HG21 ILE 657 HG21 ILE 657 -16.867 0.202 -5.513 458 HG22 ILE 657 HG22 ILE 657 -15.992 1.377 -6.511 459 HG23 ILE 657 HG23 ILE 657 -15.254 0.688 -5.050 460 HD11 ILE 657 HD11 ILE 657 -13.973 3.678 -3.223 461 HD12 ILE 657 HD12 ILE 657 -15.338 2.955 -2.352 462 HD13 ILE 657 HD13 ILE 657 -14.318 1.944 -3.406 463 H GLU 658 H GLU 658 -18.310 0.614 -6.821 464 HA GLU 658 HA GLU 658 -21.148 0.142 -6.041 465 HB2 GLU 658 HB2 GLU 658 -20.989 0.739 -8.328 466 HB3 GLU 658 HB3 GLU 658 -19.592 -0.284 -8.592 467 HG2 GLU 658 HG2 GLU 658 -22.153 -1.623 -7.749 468 HG3 GLU 658 HG3 GLU 658 -22.143 -0.883 -9.342 469 H LYS 659 H LYS 659 -21.698 -1.940 -5.515 470 HA LYS 659 HA LYS 659 -20.461 -3.861 -4.252 471 HB2 LYS 659 HB2 LYS 659 -22.804 -3.902 -5.054 472 HB3 LYS 659 HB3 LYS 659 -22.239 -4.240 -6.684 473 HG2 LYS 659 HG2 LYS 659 -21.122 -6.354 -5.557 474 HG3 LYS 659 HG3 LYS 659 -22.225 -5.997 -4.230 475 HD2 LYS 659 HD2 LYS 659 -23.271 -7.661 -5.651 476 HD3 LYS 659 HD3 LYS 659 -24.135 -6.133 -5.863 477 HE2 LYS 659 HE2 LYS 659 -23.854 -7.046 -8.061 478 HE3 LYS 659 HE3 LYS 659 -22.718 -5.708 -7.926 479 HZ1 LYS 659 HZ1 LYS 659 -21.098 -7.666 -7.211 480 HZ2 LYS 659 HZ2 LYS 659 -21.369 -7.228 -8.764 481 HZ3 LYS 659 HZ3 LYS 659 -22.139 -8.552 -8.098 482 H SER 660 H SER 660 -20.305 -4.014 -7.892 483 HA SER 660 HA SER 660 -18.719 -6.452 -7.698 484 HB2 SER 660 HB2 SER 660 -18.986 -4.808 -10.223 485 HB3 SER 660 HB3 SER 660 -18.816 -6.560 -10.042 486 HG SER 660 HG SER 660 -21.052 -4.824 -9.532 487 H ASN 661 H ASN 661 -18.088 -3.045 -8.311 488 HA ASN 661 HA ASN 661 -15.304 -3.189 -8.899 489 HB2 ASN 661 HB2 ASN 661 -16.844 -1.020 -7.394 490 HB3 ASN 661 HB3 ASN 661 -15.144 -1.023 -7.668 491 HD21 ASN 661 HD21 ASN 661 -18.157 -1.640 -9.787 492 HD22 ASN 661 HD22 ASN 661 -17.486 -0.637 -11.057 493 H ILE 662 H ILE 662 -17.033 -3.432 -5.677 494 HA ILE 662 HA ILE 662 -14.496 -3.091 -4.237 495 HB ILE 662 HB ILE 662 -17.340 -3.814 -3.423 496 HG12 ILE 662 HG12 ILE 662 -15.915 -1.313 -2.519 497 HG13 ILE 662 HG13 ILE 662 -16.439 -1.389 -4.183 498 HG21 ILE 662 HG21 ILE 662 -14.921 -3.414 -1.617 499 HG22 ILE 662 HG22 ILE 662 -16.604 -3.388 -1.051 500 HG23 ILE 662 HG23 ILE 662 -15.947 -4.860 -1.761 501 HD11 ILE 662 HD11 ILE 662 -18.766 -1.931 -3.449 502 HD12 ILE 662 HD12 ILE 662 -18.251 -1.685 -1.783 503 HD13 ILE 662 HD13 ILE 662 -18.189 -0.337 -2.930 504 H GLU 663 H GLU 663 -16.614 -5.591 -5.448 505 HA GLU 663 HA GLU 663 -15.442 -7.818 -3.983 506 HB2 GLU 663 HB2 GLU 663 -16.985 -7.794 -6.617 507 HB3 GLU 663 HB3 GLU 663 -16.586 -9.235 -5.675 508 HG2 GLU 663 HG2 GLU 663 -17.873 -8.280 -3.745 509 HG3 GLU 663 HG3 GLU 663 -18.329 -6.933 -4.700 510 H LYS 664 H LYS 664 -15.027 -6.578 -7.344 511 HA LYS 664 HA LYS 664 -12.851 -8.368 -7.868 512 HB2 LYS 664 HB2 LYS 664 -12.521 -7.351 -9.890 513 HB3 LYS 664 HB3 LYS 664 -14.254 -7.143 -9.634 514 HG2 LYS 664 HG2 LYS 664 -13.849 -4.808 -8.901 515 HG3 LYS 664 HG3 LYS 664 -12.112 -5.001 -9.156 516 HD2 LYS 664 HD2 LYS 664 -14.244 -5.094 -11.289 517 HD3 LYS 664 HD3 LYS 664 -13.106 -3.782 -10.985 518 HE2 LYS 664 HE2 LYS 664 -12.438 -6.604 -11.900 519 HE3 LYS 664 HE3 LYS 664 -12.399 -5.127 -12.879 520 HZ1 LYS 664 HZ1 LYS 664 -10.190 -5.653 -12.246 521 HZ2 LYS 664 HZ2 LYS 664 -10.496 -5.863 -10.683 522 HZ3 LYS 664 HZ3 LYS 664 -10.603 -4.351 -11.333 523 H LEU 665 H LEU 665 -12.930 -4.934 -6.636 524 HA LEU 665 HA LEU 665 -10.096 -4.776 -6.802 525 HB2 LEU 665 HB2 LEU 665 -12.082 -3.095 -5.269 526 HB3 LEU 665 HB3 LEU 665 -10.344 -2.800 -5.228 527 HG LEU 665 HG LEU 665 -11.809 -2.994 -7.888 528 HD11 LEU 665 HD11 LEU 665 -12.846 -1.168 -6.511 529 HD12 LEU 665 HD12 LEU 665 -12.060 -0.631 -8.001 530 HD13 LEU 665 HD13 LEU 665 -11.246 -0.387 -6.440 531 HD21 LEU 665 HD21 LEU 665 -9.194 -1.672 -7.061 532 HD22 LEU 665 HD22 LEU 665 -9.909 -1.631 -8.688 533 HD23 LEU 665 HD23 LEU 665 -9.361 -3.165 -8.008 534 H LEU 666 H LEU 666 -12.210 -5.661 -3.963 535 HA LEU 666 HA LEU 666 -10.052 -6.113 -2.168 536 HB2 LEU 666 HB2 LEU 666 -12.755 -7.481 -2.491 537 HB3 LEU 666 HB3 LEU 666 -11.642 -7.875 -1.190 538 HG LEU 666 HG LEU 666 -12.713 -5.052 -1.629 539 HD11 LEU 666 HD11 LEU 666 -14.258 -5.501 0.206 540 HD12 LEU 666 HD12 LEU 666 -13.632 -7.153 0.370 541 HD13 LEU 666 HD13 LEU 666 -14.536 -6.685 -1.083 542 HD21 LEU 666 HD21 LEU 666 -11.968 -4.764 0.712 543 HD22 LEU 666 HD22 LEU 666 -10.627 -5.081 -0.377 544 HD23 LEU 666 HD23 LEU 666 -11.234 -6.377 0.683 545 H THR 667 H THR 667 -11.377 -8.167 -4.787 546 HA THR 667 HA THR 667 -9.825 -10.499 -4.123 547 HB THR 667 HB THR 667 -10.958 -9.505 -6.785 548 HG1 THR 667 HG1 THR 667 -12.598 -9.829 -5.396 549 HG21 THR 667 HG21 THR 667 -10.787 -11.851 -7.491 550 HG22 THR 667 HG22 THR 667 -9.835 -12.201 -6.014 551 HG23 THR 667 HG23 THR 667 -9.218 -11.078 -7.249 552 H ASP 668 H ASP 668 -9.314 -7.720 -6.363 553 HA ASP 668 HA ASP 668 -6.918 -8.681 -7.524 554 HB2 ASP 668 HB2 ASP 668 -8.504 -6.129 -7.382 555 HB3 ASP 668 HB3 ASP 668 -6.883 -6.095 -8.076 556 H MET 669 H MET 669 -7.654 -6.498 -4.860 557 HA MET 669 HA MET 669 -5.069 -5.702 -4.109 558 HB2 MET 669 HB2 MET 669 -7.680 -6.062 -2.574 559 HB3 MET 669 HB3 MET 669 -6.221 -5.456 -1.824 560 HG2 MET 669 HG2 MET 669 -6.393 -3.925 -4.133 561 HG3 MET 669 HG3 MET 669 -8.048 -4.063 -3.660 562 HE1 MET 669 HE1 MET 669 -6.244 -0.572 -2.457 563 HE2 MET 669 HE2 MET 669 -5.428 -1.721 -3.538 564 HE3 MET 669 HE3 MET 669 -7.127 -1.282 -3.836 565 H ARG 670 H ARG 670 -7.012 -8.509 -2.825 566 HA ARG 670 HA ARG 670 -4.688 -9.509 -1.422 567 HB2 ARG 670 HB2 ARG 670 -5.987 -11.155 -0.589 568 HB3 ARG 670 HB3 ARG 670 -7.166 -9.889 -0.810 569 HG2 ARG 670 HG2 ARG 670 -8.454 -11.203 -2.080 570 HG3 ARG 670 HG3 ARG 670 -7.166 -11.542 -3.197 571 HD2 ARG 670 HD2 ARG 670 -6.630 -13.567 -2.271 572 HD3 ARG 670 HD3 ARG 670 -6.912 -13.023 -0.627 573 HE ARG 670 HE ARG 670 -9.136 -13.597 -0.678 574 HH11 ARG 670 HH11 ARG 670 -7.855 -14.206 -3.925 575 HH12 ARG 670 HH12 ARG 670 -9.203 -15.209 -4.372 576 HH21 ARG 670 HH21 ARG 670 -10.744 -14.734 -1.172 577 HH22 ARG 670 HH22 ARG 670 -10.994 -15.535 -2.723 578 H LYS 671 H LYS 671 -5.517 -9.615 -4.688 579 HA LYS 671 HA LYS 671 -4.070 -12.140 -5.231 580 HB2 LYS 671 HB2 LYS 671 -6.225 -11.534 -6.328 581 HB3 LYS 671 HB3 LYS 671 -5.428 -10.148 -7.085 582 HG2 LYS 671 HG2 LYS 671 -3.971 -11.761 -8.350 583 HG3 LYS 671 HG3 LYS 671 -4.832 -13.083 -7.551 584 HD2 LYS 671 HD2 LYS 671 -6.171 -13.025 -9.363 585 HD3 LYS 671 HD3 LYS 671 -6.970 -11.673 -8.576 586 HE2 LYS 671 HE2 LYS 671 -4.696 -11.502 -10.609 587 HE3 LYS 671 HE3 LYS 671 -6.409 -11.274 -10.979 588 HZ1 LYS 671 HZ1 LYS 671 -5.150 -9.199 -10.696 589 HZ2 LYS 671 HZ2 LYS 671 -4.945 -9.521 -9.101 590 HZ3 LYS 671 HZ3 LYS 671 -6.460 -9.268 -9.749 591 H SER 672 H SER 672 -3.454 -8.709 -5.179 592 HA SER 672 HA SER 672 -0.800 -9.198 -6.444 593 HB2 SER 672 HB2 SER 672 -2.614 -6.788 -6.728 594 HB3 SER 672 HB3 SER 672 -1.020 -7.016 -7.484 595 HG SER 672 HG SER 672 -2.014 -9.092 -8.250 596 H GLY 673 H GLY 673 -2.113 -8.147 -3.380 597 HA2 GLY 673 HA2 GLY 673 -0.124 -8.751 -1.934 598 HA3 GLY 673 HA3 GLY 673 0.769 -7.497 -2.773 599 H ILE 674 H ILE 674 -2.452 -6.497 -2.305 600 HA ILE 674 HA ILE 674 -1.407 -4.397 -0.570 601 HB ILE 674 HB ILE 674 -4.240 -4.824 -1.466 602 HG12 ILE 674 HG12 ILE 674 -3.032 -5.115 -3.526 603 HG13 ILE 674 HG13 ILE 674 -4.123 -3.739 -3.491 604 HG21 ILE 674 HG21 ILE 674 -3.955 -2.966 0.076 605 HG22 ILE 674 HG22 ILE 674 -2.585 -2.334 -0.850 606 HG23 ILE 674 HG23 ILE 674 -4.222 -2.256 -1.516 607 HD11 ILE 674 HD11 ILE 674 -2.295 -2.202 -3.322 608 HD12 ILE 674 HD12 ILE 674 -1.133 -3.572 -3.232 609 HD13 ILE 674 HD13 ILE 674 -2.097 -3.296 -4.709 610 H ILE 675 H ILE 675 -3.723 -7.145 -0.292 611 HA ILE 675 HA ILE 675 -3.998 -6.650 2.576 612 HB ILE 675 HB ILE 675 -6.389 -6.548 2.548 613 HG12 ILE 675 HG12 ILE 675 -6.257 -7.202 -0.407 614 HG13 ILE 675 HG13 ILE 675 -6.905 -8.201 0.889 615 HG21 ILE 675 HG21 ILE 675 -5.135 -4.383 1.822 616 HG22 ILE 675 HG22 ILE 675 -5.763 -4.692 0.224 617 HG23 ILE 675 HG23 ILE 675 -6.861 -4.458 1.579 618 HD11 ILE 675 HD11 ILE 675 -8.122 -5.651 -0.201 619 HD12 ILE 675 HD12 ILE 675 -8.759 -7.305 -0.273 620 HD13 ILE 675 HD13 ILE 675 -8.673 -6.455 1.280 621 H TYR 676 H TYR 676 -5.304 -8.577 3.626 622 HA TYR 676 HA TYR 676 -4.964 -10.986 1.943 623 HB2 TYR 676 HB2 TYR 676 -3.518 -12.050 3.518 624 HB3 TYR 676 HB3 TYR 676 -2.808 -10.581 2.867 625 HD1 TYR 676 HD1 TYR 676 -2.578 -8.513 4.290 626 HD2 TYR 676 HD2 TYR 676 -3.577 -12.406 5.866 627 HE1 TYR 676 HE1 TYR 676 -1.623 -7.869 6.473 628 HE2 TYR 676 HE2 TYR 676 -2.602 -11.784 8.045 629 HH TYR 676 HH TYR 676 -1.220 -10.169 9.142 630 H GLU 677 H GLU 677 -6.322 -12.698 2.421 631 HA GLU 677 HA GLU 677 -8.657 -11.853 3.845 632 HB2 GLU 677 HB2 GLU 677 -8.506 -12.847 1.512 633 HB3 GLU 677 HB3 GLU 677 -8.213 -14.412 2.256 634 HG2 GLU 677 HG2 GLU 677 -10.262 -14.329 3.435 635 HG3 GLU 677 HG3 GLU 677 -10.565 -12.630 3.046 636 H ALA 678 H ALA 678 -7.478 -11.835 5.885 637 HA ALA 678 HA ALA 678 -6.223 -14.006 7.103 638 HB1 ALA 678 HB1 ALA 678 -6.555 -12.773 9.214 639 HB2 ALA 678 HB2 ALA 678 -6.065 -11.690 7.891 640 HB3 ALA 678 HB3 ALA 678 -7.769 -11.746 8.422 641 H LYS 679 H LYS 679 -9.690 -13.446 6.835 642 HA LYS 679 HA LYS 679 -10.009 -16.220 7.596 643 HB2 LYS 679 HB2 LYS 679 -12.098 -14.230 8.560 644 HB3 LYS 679 HB3 LYS 679 -12.020 -15.949 8.885 645 HG2 LYS 679 HG2 LYS 679 -10.037 -15.602 10.332 646 HG3 LYS 679 HG3 LYS 679 -10.100 -13.859 9.989 647 HD2 LYS 679 HD2 LYS 679 -12.478 -13.861 10.891 648 HD3 LYS 679 HD3 LYS 679 -12.186 -15.503 11.483 649 HE2 LYS 679 HE2 LYS 679 -10.535 -13.023 12.176 650 HE3 LYS 679 HE3 LYS 679 -11.809 -13.679 13.196 651 HZ1 LYS 679 HZ1 LYS 679 -10.527 -15.650 13.512 652 HZ2 LYS 679 HZ2 LYS 679 -9.634 -14.328 13.901 653 HZ3 LYS 679 HZ3 LYS 679 -9.330 -15.110 12.488 654 HA PRO 680 HA PRO 680 -12.136 -15.799 3.700 655 HB2 PRO 680 HB2 PRO 680 -14.358 -17.457 3.944 656 HB3 PRO 680 HB3 PRO 680 -12.697 -17.993 3.553 657 HG2 PRO 680 HG2 PRO 680 -14.067 -17.964 6.250 658 HG3 PRO 680 HG3 PRO 680 -13.074 -19.266 5.525 659 HD2 PRO 680 HD2 PRO 680 -12.026 -17.550 7.348 660 HD3 PRO 680 HD3 PRO 680 -11.051 -18.059 5.940 661 H GLU 681 H GLU 681 -13.448 -14.265 2.928 662 HA GLU 681 HA GLU 681 -14.902 -12.587 2.782 663 HB2 GLU 681 HB2 GLU 681 -16.503 -14.509 3.935 664 HB3 GLU 681 HB3 GLU 681 -16.635 -13.213 5.113 665 HG2 GLU 681 HG2 GLU 681 -16.951 -11.930 2.614 666 HG3 GLU 681 HG3 GLU 681 -17.716 -13.477 2.367 667 H CYS 682 H CYS 682 -12.665 -12.764 5.092 668 HA CYS 682 HA CYS 682 -13.292 -10.088 6.215 669 HB2 CYS 682 HB2 CYS 682 -13.718 -12.119 7.732 670 HB3 CYS 682 HB3 CYS 682 -11.965 -12.298 7.758 671 H TYR 683 H TYR 683 -11.931 -8.935 4.954 672 HA TYR 683 HA TYR 683 -9.212 -9.922 4.257 673 HB2 TYR 683 HB2 TYR 683 -10.863 -7.477 3.463 674 HB3 TYR 683 HB3 TYR 683 -9.162 -7.677 3.053 675 HD1 TYR 683 HD1 TYR 683 -8.416 -9.796 1.838 676 HD2 TYR 683 HD2 TYR 683 -12.513 -8.493 2.049 677 HE1 TYR 683 HE1 TYR 683 -9.010 -11.361 0.036 678 HE2 TYR 683 HE2 TYR 683 -13.103 -10.084 0.190 679 HH TYR 683 HH TYR 683 -11.134 -12.677 -0.449 680 H LYS 684 H LYS 684 -7.257 -8.757 4.960 681 HA LYS 684 HA LYS 684 -7.889 -6.168 6.117 682 HB2 LYS 684 HB2 LYS 684 -6.575 -6.420 8.176 683 HB3 LYS 684 HB3 LYS 684 -8.047 -7.331 7.982 684 HG2 LYS 684 HG2 LYS 684 -6.841 -8.875 9.070 685 HG3 LYS 684 HG3 LYS 684 -6.668 -9.383 7.412 686 HD2 LYS 684 HD2 LYS 684 -4.530 -9.547 8.504 687 HD3 LYS 684 HD3 LYS 684 -4.448 -8.227 7.331 688 HE2 LYS 684 HE2 LYS 684 -3.304 -7.542 9.330 689 HE3 LYS 684 HE3 LYS 684 -4.774 -6.584 9.182 690 HZ1 LYS 684 HZ1 LYS 684 -4.523 -7.330 11.426 691 HZ2 LYS 684 HZ2 LYS 684 -4.376 -8.902 10.972 692 HZ3 LYS 684 HZ3 LYS 684 -5.816 -8.139 10.822 693 H LYS 685 H LYS 685 -6.275 -4.669 6.097 694 HA LYS 685 HA LYS 685 -4.707 -5.233 3.733 695 HB2 LYS 685 HB2 LYS 685 -4.636 -2.818 3.457 696 HB3 LYS 685 HB3 LYS 685 -6.250 -3.428 3.673 697 HG2 LYS 685 HG2 LYS 685 -6.166 -1.428 4.890 698 HG3 LYS 685 HG3 LYS 685 -6.222 -2.725 6.083 699 HD2 LYS 685 HD2 LYS 685 -4.666 -0.999 6.719 700 HD3 LYS 685 HD3 LYS 685 -3.765 -2.474 6.441 701 HE2 LYS 685 HE2 LYS 685 -3.020 -1.726 4.267 702 HE3 LYS 685 HE3 LYS 685 -4.178 -0.404 4.257 703 HZ1 LYS 685 HZ1 LYS 685 -2.917 0.442 6.254 704 HZ2 LYS 685 HZ2 LYS 685 -2.010 0.382 4.825 705 HZ3 LYS 685 HZ3 LYS 685 -1.766 -0.786 5.926 706 H VAL 686 H VAL 686 -2.577 -4.079 3.439 707 HA VAL 686 HA VAL 686 -0.891 -4.443 5.846 708 HB VAL 686 HB VAL 686 -0.744 -5.997 3.740 709 HG11 VAL 686 HG11 VAL 686 0.762 -5.422 2.001 710 HG12 VAL 686 HG12 VAL 686 -0.453 -4.134 2.047 711 HG13 VAL 686 HG13 VAL 686 1.138 -3.847 2.743 712 HG21 VAL 686 HG21 VAL 686 0.736 -6.115 5.650 713 HG22 VAL 686 HG22 VAL 686 1.623 -6.356 4.131 714 HG23 VAL 686 HG23 VAL 686 1.733 -4.797 4.980
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